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					<div class="scheda"><h1>PCCP. Physical chemistry chemical physics</h1>
<dl><dt>Label</dt><dd><ul><li>PCCP. Physical chemistry chemical physics (literal)</li></ul></dd><dt>Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#rivistaDi</dt><dd><ul><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID315521'>Excess electrons in ice: a density functional theory study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID241083'>Ultrafast spectroscopy of linear carbon chains: The case of dinaphthylpolyynes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39824'>Position-dependent energy of molecules in nano-confined water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID317635'>Self-seeded nucleation of Cu nanoclusters on Al2O3/Ni3Al(111): an ab initio investigation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID27120'>Different factors affecting polyat conformation in microemulsions. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195085'>Challenges in the simulation of dye-sensitized ZnO solar cells: quantum confinement, alignment of energy levels and excited state nature at the dye/semiconductor interface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39356'>B3LYP/6-31G* conformational landscape in vacuo of some pterocarpan stereoisomers with biological activity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID283498'>Vaporization of the prototypical ionic liquid BMImNTf(2) under equilibrium conditions: a multitechnique study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID193878'>The initiation mechanisms for surface hydrosilylation with 1-alkenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168709'>Germanium K edge in GeO2 polymorphs. Correlation between local coordination and electronic structure of germanium (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288601'>Highly efficient photoanodes for dye solar cells with a hierarchical meso-ordered structure (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172373'>Tetraphenylporphyrin electronic properties: a combined theoretical and experimental study of thin films deposited by SuMBD (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190278'>Dissociative double photoionization of benzene molecules in the 26-33 eV energy range (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300291'>Photothermally controlled structural switching in fluorinated polyene-graphene hybrids (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194432'>A first step towards the understanding of the 5-HT3 receptor subunit heterogeneity from a computational point of view (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48078'>Application Of Valence-Bond Techniques To The Study Of Weakly Bound  Complexes. The Potential Energy Surface Of The Ne-CH4 Systyem (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID315458'>Cyclic dipeptide immobilization on Au(111) and Cu(110) surfaces (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190288'>Amino-carboxylic recognition on surfaces: From 2D to 2D + 1 nano-architectures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53605'>Crossed beam studies of radical-radical reactions: O(3P)+ C3H5 (alyl) (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39190'>Aggregation processes and photophysical properties of chlorophyll a in aqueous solutions modulated by the presence of cyclodextrins (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID305213'>Influence of metal-support interaction on the surface structure of gold nanoclusters deposited on native SiOx/Si substrates (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39177'>Activity coefficients of lanthanum salts at 298.15 K (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33680'>Laser spectroscopy of 1, 2, 3, 4-Tetrahydro-1-naphthol-ROH (R=H, CH3) clusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33681'>Chiral aggregates of indan-1-ol with secondary alcohols and water: laser spectroscopy in supersonic beams (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48189'>Two-photon absorption of Zn(II) octupolar molecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID177424'>Water adsorption on the stoichiometric and reduced CeO2(111) surface:A first-principles investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39540'>Spontaneous emulsification of detergent solubilized Reaction Center: protein conformational changes precede droplets growth (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID277861'>Lithium salts as \"redox active\" p-type dopants for organic semiconductors and their impact in solid-state dye-sensitized solar cells (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID299738'>Viologen-based ionic liquid crystals: Induction of a smectic A phase by dimerisation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48396'>The intermolecular potential in NO-N-2 and (NO-N-2)(+) systems: implications for the neutralization of ionic molecular aggregates (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288604'>Computational modeling of single-versus double-anchoring modes in di-branched organic sensitizers on TiO2 surfaces: structural and electronic properties (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288883'>Interaction of cisplatin and two potential antitumoral platinum(II) complexes with a model lipid membrane: a combined NMR and MD study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48338'>Quasi-classical trajectory study of the adiabatic reactions occurrion the two lowest-lying electronic states of the LiH2+ systemng (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID320737'>Photoionization and imaging spectroscopy of rubidium atoms attached to helium nanodroplets (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48367'>Carbonyl copper(I) complexes with hydrotris(1,2,4-triazolyl)borate,    hydrotris(pyrazolyl)borate, and tris(pyrazolyl)methane ligands: a DFT    study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260519'>An EINS Study on the Fragility of Homologues Disaccharides/H2O Mixtures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190549'>Organic photovoltaic devices with colloidal TiO2 nanorods as key functional components (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15374'>Binding of a chiral drug to a protein: an investigation of the 2-(3-benzoylphenyl) propionic acid/bovine serum albumin system by circular dichroism and fluorescence (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID177781'>Theoretical investigation of the hydrogen atoms transfer in the adenine-thymine base pair and its coupling with the electronic rearrangement. Concerted vs stepwise mechanism (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300892'>Large ferroelectric polarization in the new double perovskite NaLaMnWO6 induced by non-polar instabilities (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169699'>Micron-sized [6,6]-phenyl C61 butyric acid methyl ester crystals grown by dip coating in solvent vapour atmosphere: interfaces for organic photovoltaics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID193485'>Cavitation dynamics of laser ablation of bulk and wire-shaped metals in water during nanoparticles production (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51215'>Energy Transfer Processes in Electronically Coupled Porphyrin Hetero-Dyads Connected at the beta Position (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID327388'>Wavelength dispersion of the local field intensity in silver-gold nanocages. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID298681'>Analytical model and multiscale simulations of A? peptide aggregation in lipid membranes: Towards a unifying description of conformational transitions, oligomerization and membrane damage (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51228'>Chiral recognition of 2-(3-benzoylphenyl)propionic acid (ketoprofen) by serum albumin: an investigation with microcalorimetry, circular dichroism and molecular modelling (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260584'>Can we control the electronic energy transfer in molecular dyads through metal nanoparticles? A QM/continuum investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172002'>Preferential solvation of glucose and talose in water-acetonitrile mixtures: a molecular dynamics simulation study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID216147'>Nano-Raman imaging of Cu-TCNQ clusters in TCNQ thin films by scanning near-field optical microscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15180'>Solvent Effect on the Distance Distribution Between Spin Labels in Aggregated Spin Labeled Trichogin GA IV Dimer Peptides as Studied by Pulsed ElectronElectron Double Resonance. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID286444'>The H + HeH+ -> He + H-2(+) reaction from the ultra-cold regime to the three-body breakup: exact quantum mechanical integral cross sections and rate constants (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID170019'>Molecular origin and hydration dependence of protein anharmonicity: an elastic neutron scattering study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID697'>Dielectric scaling in polyelectrolyte solutions with different solvent quality in the dilute concentration regime (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51249'>Spectroscopic signatures for planar equilibrium geometries in methyl-substituted oligothiophenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195848'>The soft X-ray absorption spectrum of the allyl free radical (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID209557'>JOYCE and ULYSSES: integrated and user-friendly tools for the parameterization of intramolecular force fields from quantum mechanical data (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51163'>Structure and properties of licochalcone A-human serum albumin complexes in solution: a spectroscopic, photophysical and computational approach to understand drug-protein interaction (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47871'>Gas phase protonation of trifluoromethyl sulfur pentafluoride (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168552'>Optical Characterization of Quasi-monomolecular Layers of the Nonlinear Polymer polyDCHD-HS (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39032'>Effect of heterogeneity in the distribution of ligands and proteins among disconnected particles: the binding of ubiquinone to bacterial reaction center (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51321'>Affinity of the anthracycline antitumoral drugs Doxorubicin and Sabarubicin for human telomeric G-quadruplex structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168616'>Dissymmetry effects on the laser spectroscopy of supersonically expanded rare gas/chiral arene heteroclusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID308137'>Palladium local structure of La1-xSrxCo1-yFey-0.03Pd0.03O3-? perovskites synthesized using a one pot citrate method (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172601'>Conformational preferences of chiral molecules: free jet rotational spectrum of 1-phenyl-1-propanol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58575'>Role of the reagents consumption in the chaotic dynamics of the Belousov- Zhabotinsky oscillator in closed unstirred reactors (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318962'>Influence of the molecular architecture on the adsorption onto solid surfaces: comb-like polymers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID229'>Time dependent density functional investigation of the near-edge absorption spectra of V2O5 (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID184465'>Empty level structure of boryl-substituted pentacyclic heteroaromatics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID271528'>Blue-green emitting sulphonamido-imidazole derivatives: ESIPT based excited state dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318957'>Influence of the percentage of acetylation on the assembly of LbL multilayers of poly(acrylic acid) and chitosan (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID314117'>Accurate structure, thermodynamic and spectroscopic parameters from CC and CC/DFT schemes: the challenge of the conformational equilibrium in glycine (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50714'>The electron transfer rate of large TPA based compounds: a joint theoretical and electrochemical approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50671'>Redox and Spin Trapping Properties of phosphoryldithioformates. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58662'>Valence electronic properties of porphyrin derivatives (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID167639'>Searching for the optimum structures of alloy nanoclusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50789'>Functional polymers: Scanning Force Microscopy insights (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID189656'>Superparamagnetic blocking and superspin-glass freezing in ultra small delta-(Fe0.67Mn0.33)OOH particles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID187777'>Design of efficient methanol impermeable membranes for fuel cell applications (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21807'>The columbite-type Fe1-xMnxNb2O6 solid solution: structural characterization and magnetic behavior (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318092'>Thermal evolution of the submonolayer near-surface alloy of ZnPd on Pd(111) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID173744'>Structural organization and phase behaviour of 1-butyl-3-methylimidazolium hexafluorophosphate: an high pressure Raman spectroscopy study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58697'>Dissociative double photoionization of CO2 molecules in the 36-49 eV energy range: angular and energy distribution of ion products (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID254401'>Determination of the oxidation and coordination state of copper on different Cu-based catalysts by XANES spectroscopy in situ or in operando conditions (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192667'>Intermolecular Exciton Coupling and Vibronic Effects in Solid-State Circular Dichroism: a Case Study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297558'>A grouping approach to homotop global optimization in alloy nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192662'>Comparison of vertical and adiabatic harmonic approaches for the calculation of the vibrational structure of electronic spectra (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID27225'>PolyAT chemical denaturation in w/o microemulsion (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284255'>Structural and morphological modifications of thermally reduced cerium oxide ultrathin epitaxial films on Pt(111) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID198721'>Switching of emissive and NLO properties in push-pull chromophores with crescent PPV-like structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196674'>The dynamic crossover in water does not require bulk water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51954'>Very high resolution near-field chemical imaging using an infrared free electron laser (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192663'>Barrierless photoisomerisation of the ''simplest cyanine'': Joining computational and femtosecond optical spectroscopies to trace the full reaction path (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169666'>Manganese ions in the monoclinic, tetragonal and cubic phases of zirconia: an XRD and EPR study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169676'>Mass resolved laser spectroscopy of micro-solvated R(+)-1-phenyl-1-propanol: A chiral molecule of biological interest (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48632'>Halogen bonding in ligand-receptor systems in the framework of classical force fields (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291577'>Roads leading to roam. Role of triple fragmentation and of conical intersections in photochemical reactions: Experiments and theory on methyl formate (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21438'>Raman spectroscopy of AMn2O4 (A=Mn, Mg, Zn) spinels (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48598'>Optical properties of ZnO nanostructures: a hybrid DFT/TDDFT investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54031'>Valence electronic structure of epichlorohydrin: experiment and theory (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48716'>Effect of SiO2 on the dynamics of proton conducting [Nafion/(SiO2)X] composite membranes: a solid-state 19F NMR study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID225392'>Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171139'>Characterization of vanadium oxide on ZrO2-based catalyst precursors (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318264'>Dynamics of a lipid bilayer induced by electric fields (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID272283'>Efficient solar water oxidation using photovoltaic devices functionalized with earth-abundant oxygen evolving catalysts (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID321006'>Vibrational branching ratios in the photoelectron spectra of N-2 and CO: interference and diffraction effects (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID303930'>Molecular dynamics simulations of PNA-PNA and PNA-DNA duplexes by the use of new parameters implemented in the GROMACS package: A conformational and dynamics study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID181164'>Local structure of [Cu-I(CO)(2)](+) adducts hosted inside ZSM-5 zeolite probed by EXAFS, XANES and IR spectroscopies (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID44431'>Analysis of the n3+n7 combination band of CF2Cl2 from spectra obtained by diode laser and Fourier Transform Spectrometer supersonic jet techniques (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID4023'>Theoretical study on oligothiophene N-succinimidyl esters: size and push-pull effects (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21501'>The Eu1-xBa2-xCu3Oy system: oxygen content, phase transitions, point defect equilibria, and charge carriers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID308068'>Keggin heteropolyacid H3PW12O40 supported on different oxides for catalytic and catalytic photo-assisted propene hydration (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52470'>Protonation states in a cobalt-oxide catalyst for water oxidation: fine comparison of ab initio molecular dynamics and X-ray absorption spectroscopy results (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID323847'>Corrosion of Ni in 1-butyl-1-methyl-pyrrolidinium bis (trifluoromethylsulfonyl) amide room-temperature ionic liquid: an in situ X-ray imaging and spectromicroscopy study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21513'>Do we have a probe for the initial stages of solid state reactions?, (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294376'>The interactions of methyl tert-butyl ether on high silica zeolites: a combined experimental and computational study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID211457'>Insights into the polymorphism of glycine: membrane crystallization in an electric field (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID57767'>Förster resonance energy transfer (FRET) with a donor-acceptor system adsorbed on silver or gold nanoisland films (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID57510'>Photopolymerization of Diacetylene-Capped Gold Nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53587'>Dimerization of urea in water solution: a quantum mechanical investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID263172'>Coinage Metal Exciplexes with Helium Atoms: A Theoretical Study of the M*(2L)Hen (M = Cu, Ag, Au; L = P, D) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195066'>Selective TDDFT with automatic removal of ghost transitions: application to a perylene-dye-sensitized solar cell model (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260571'>Cytochrome C on a gold surface: investigating structural relaxations and their role in protein-surface electron transfer by molecular dynamics simulations (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17098'>Complementary and partially complementary DNA duplexes tethered to a functionalized substrate: a molecular dynamics approach to biosensing (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID3619'>About the albumin structure in solution: cigar Expanded form versus heart Normal shape (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17100'>Molecular Dynamics and Monte Carlo Simulations for the Structure of the Aqueous Trimethylammonium Chloride Solution in the 0.2-1 Molar Range (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID292245'>Hydrogen-dimer lines and electron waveguides in graphene (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48265'>Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID228204'>Synthesis and microstructure of manganese ferrite colloidal nanocrystals (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID303459'>Structural, electronic and ferroelectric properties of croconic acid crystal: a DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48418'>Results and perspectives of the MO-VB method. Application examples on the He2 and the LiHHe complexes. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313785'>Fully anharmonic IR and Raman spectra of medium-size molecular systems: accuracy and interpretation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48465'>Vinblastine perturbation of tubulin protofilament structure: a computational insight (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID301292'>Evidence of benzenoid domains in nanographenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17021'>Singlet-triplet energy gap of a diarylnitroxide diradical by an accurate many-body perturbative approach (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40632'>Pushing the limit of liquid-state Dynamic Nuclear Polarization at high field (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288237'>The effect of protein composition on hydration dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17099'>Theoretical Study of the Conformational and Optical Properties of a Fluorescent Sensor Grafted on Apolar Polymer Structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291568'>Control of conformers combining cooling by supersonic expansion of seeded molecular beams with hexapole selection and alignment: Experiment and theory on 2-butanol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID278776'>Collective dynamics of supercooled water close to the liquid-liquid coexistence lines (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID191805'>Excitonic recombination in superstoichiometric nanocrystalline TiO2 grown by cluster precursors at room temperature (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284173'>Concentration dependence of hydration water in a model peptide (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID179458'>The free jet microwave spectrum of 2-phenylethylamine-water (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID275255'>The effect of fluorine substitution on chiral recognition: interplay of CH...pi p, OH...pi p and CH... pi interactions in gas- phase complexes of 1-aryl-1-ethanol with butan-2-ol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40821'>The fourth virial coefficient of a nonadditive hard-disc mixture (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313080'>Silver nanoparticles linked by a Pt-containing organometallic dithiol bridge: study of local structure and interface by XAFS and SR-XPS (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID319479'>Surface structure of Pd(111) with less than half a monolayer of Zn (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195025'>Computational modelling of TiO2 surfaces sensitized by organic dyes with different anchoring groups: adsorption modes, electronic structure and implication for electron injection/recombination (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53392'>Structure dipole moment and large amplitude motions of 1-benzofuran (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40765'>Optimization of chemical ordering in AgAu nanoalloys (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40769'>Tracking thermally-activated transformations in a nanostructured metal/oxide/metal system (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID319219'>The interactions of nitrogen dioxide with graphene-stabilized Rh clusters: a DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40808'>Interaction of single water molecules with silanols in mesoporous silica (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51257'>Solvent polarity effect on intramolecular electron transfer in a corrole-naphthalene bisimide dyad (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52444'>The valence electronic structure and conformational flexibility of epichlorohydrin (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53288'>Conformation of dimethoxymethane: roles of anomeric effects and weak hydrogen bonds. A free jet microwave study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51325'>Silyloxyazadienes: one intermediate and two competitive pericyclic reactions (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34559'>A study of  selected fragmentation path of the etyne dication: theory and experiment (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313174'>Selectivity in fragmentation of N-methylacetamide after resonant K-shell excitation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34562'>Exploring the accuracy level of new potential energy surfaces for the F+HD reactions: from exact quantum rate constants to the state-to-state reaction dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15203'>Structure and Spatial Distribution of the Spin-Labelled Lipopeptide Trichogin GA IV in a Phospholipid Membrane Studied by Pulsed ElectronElectron Double Resonance (PELDOR). (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39974'>Metal adsorption on oxide polar ultrathin films (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297442'>Interface structure and reactivity of water-oxidation Ru-polyoxometalate catalysts on functionalized graphene electrodes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195198'>Adsorption of organic dyes on TiO2 surfaces in dye-sensitized solar cells: interplay of theory and experiment (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312310'>Axial iron coordination and spin state change in a heme c upon electrostatic protein-SAM interaction (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID16914'>Modeling the Zn+2 binding in the 1-16 region of the amyloid-beta peptide involved in Alzheimer's disease (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID18187'>Extension of the AMBER force-field for the study of large nitroxides in condensed phases: an ab initio parameterization (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID178683'>Combination of spectroscopic and computational methods to get an understanding of supramolecular chemistry of drugs: from simple host systems to biomolecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17015'>Computing the inhomogeneous broadening of electronic transitions in solution: a first-principle quantum mechanical approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17018'>Fluorescence spectra of organic dyes in solution: a time dependent multilevel approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17062'>In-situ FTIR spectroelectrochemical study on mechanism of ethylene glycol electrocatalytic oxidation at Pd electrode (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40296'>Emerging methods for fabricating functional structure by patterning and assembling engineered nanocrystals (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40321'>Au nanoparticles on a templating TiOx/Pt(111) ultrathin polar film: a photoemission and photoelectron diffraction study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312337'>High resolution NEXAFS of perylene and PTCDI: a surface science approach to molecular orbital analysis (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID217202'>Prospects for hydrogen storage in graphene (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21908'>Oscillation of interfacial properties in liquid systems: assessment of harmonic distortion (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312344'>Theoretical investigation of the coupling between hydrogen atoms transfer and stacking interaction in guanine-cytosine dimers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40317'>Theoretical Multilevel Approach for studying the Photophysical Properties of Organic Dyes in solution (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40151'>Assessment of a computational strategy approaching spectroscopic accuracy for structure, magnetic properties and vibrational frequencies of organic free radicals: the F2CN and F2BO case (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50745'>Diastereoselectivity and site-dependency in the photochemistry of ketoprofen in the bovine serum albumin matrix (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40324'>The CO-Ne van der Waals complex: ab initio intermolecular potential energy, interaction induced electric dipole moment and polarizability surfaces, and second virial coefficients (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID14128'>The polarizability in solution of tetra-phenyl-porphyrin derivatives in their excited electronic states: A PCM/TD-DFT study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40341'>Directed assembly of Au and Fe nanoparticles on a TiOx/Pt(111) ultrathin template: the role of oxygen affinity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318846'>Surface models and reaction barrier in Eley-Rideal formation of H-2 on graphitic surfaces (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40332'>The catalytic effect of water on the ketoenol tautomerism. Pyruvate and acetylacetone: a computational challenge (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40410'>The excited states of adenine-guanine stacked dimers in aqueous solution: a PCM/TD-DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID273022'>Oxygen transport in nanostructured lanthanum manganites (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40311'>Absorption and emission UV-Vis spectra of the TRITC fluorophore molecule in solution: a quantum mechanical study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19890'>Affinity of the anthracycline antitumor drugs Doxorubicin and Sabarubicin for human telomeric G-quadruplex structures. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID299764'>Spectroscopic signatures of the carbon buckyonions C-60@C-180 and C-60@C-240: a dispersion-corrected DFT study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297401'>Chemical ordering in magic-size Ag-Pd nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34316'>VUV Photon induced fluorescence study of SF5CF3 (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID202566'>High resolution inner-shell spectroscopy and ab initio CI calculations on TiCl4 and isoelectronic molecules (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297448'>Adsorbate induced vacancy formation on silver surfaces (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291469'>On the macromolecular cellulosic network of paper: Changes induced by acid hydrolysis studied by NMR diffusometry and relaxometry (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39733'>Structures and Energetics of 98-atom Pd-Pt Nanoalloys: Potential Stability of the Leary Tetrahedron for Bimetallic Nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID324937'>Theoretical study of sulfur L-edge XANES of thiol protected gold nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22092'>Oxygen diffusion in nanocrystalline yttria-stabilized zirconia: the effect of grain boundaries (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294172'>Structural, dynamic and photophysical properties of a fluorescent dye incorporated in an amorphous hydrophobic polymer bundle (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34360'>Eley-Rideal recombination of hydrogen atoms on a tungsten surface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52224'>XAS characterization and CO oxidation on delta-allumina supported La, Mn, Co and Fe oxides (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297552'>Ligand/cluster/support catalytic complexes in heterogeneous ultrananocatalysis: NO oxidation on Ag-3/MgO(100) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168995'>Observation and control of coherent torsional dynamics in a quinquethiophene molecule (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID3064'>Water hydrogen bond analysis on hydrophilic and hydrophobic biomolecule sites (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274146'>In situ pair distribution function study on lanthanum doped ceria (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19468'>Stability and transformation mechanism of weddellite nanocrystals studied by X-Ray diffraction and Infrared spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50486'>A spectroscopic and structural characterization of the inclusion complexes of p-dimethylaminobenzonitrile with cyclodextrins (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171412'>A numerical study of one-patch colloidal particles: from square-well to Janus (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39939'>Absorption and electroabsorption spectra of [(NH3)5Ru-pyrazine]+2 and [(NH3)5Ru-pyrazine-H]+3 by vibronic model Hamiltonian (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39015'>A coupled cluster response study of the electr ic dipole polarizability, first and second hyperpolarizabilities of hcl. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID287225'>Ultrafast resonance energy transfer in the umbelliferone-alizarin bichromophore (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID637'>Unravelling single metalloprotein electron transfer by scanning probe techniques (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39009'>Analytic calculations of nonlinear mixed electric and magnetic frequency-dependent molecular properties using London atomic orbitals: Buckingham birefringence (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID265070'>NIR emission of cyclic [4]rotaxanes containing pi-extended porphyrin chromophores (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294384'>Novel insights on magadiite disaggregation: a multitechnique study on thermal stability. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21511'>Localized and itinerant electronic states at the insulatormetal transition in Y1xCaxVO3+d: evidence from electric transport, magnetic properties and XAS spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172764'>Amphoteric behaviour of Er3+ dopants in BaTiO3: an Er-LIII edge EXAFS assessment (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID287391'>Controllable synthesis and SERS characteristics of hollow sea-urchin gold nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39028'>The heat capacity relaxation and the enthalpy decrease in mass and diffusion-controlled polymerization reaction kinetics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21537'>Preparation, structural and magnetic characterization of RF-sputtered La1-xNaxMnO3±d thin film manganites (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33803'>LaAl1-xMnxO3 perovskite-type oxide solid solutions: structural,magnetic and electronic properties. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194059'>Status and perspectives in thin films and patterning of spin crossover compounds (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194253'>Implementation and validation of a multi-purpose virtual spectrometer for large systems in complex environments (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297010'>On the origin of the very strong two-photon activity of squaraine dyes - a standard/damped response theory study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50574'>A correlation between electrochemical properties and geometrical structure of some triarylamines used as hole transporting materials in organic electroluminescent devices (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID281874'>Electronic properties of CuPc and H2Pc: an experimental and theoretical study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID9761'>Protein stability modulated by a conformational effector: effects of trifluoroethanol on bovine serum albumin. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID55209'>Relativistic DFT calculations of the NMR properties and reactivity of transition metal methane s­complexes: insights on C-H bond activation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19830'>Colloidal semiconductor/magnetic heterostructures based on iron-oxide-functionalized brookite TiO2 nanorods (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22375'>mu-XANES mapping of buried interfaces: pushing microbeam techniques to the nanoscale (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312300'>Glycine conformers: a never-ending story? (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274953'>Exploring and rationalising an effective n-doping of large area CVD-Graphene by NH3 (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID252031'>Large amplitude motions in the electronic ground state of 4-fluoroaniline (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313894'>Electronic excitations of C-60 aggregates (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53715'>The Grounds for the Activity of TPAP in Oxidation Catalysis in Supercritical Carbon Dioxide when Confined in Hybrid Fluorinated Sol-Gel Silica Matrices (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51930'>Lithium Fluoride films and crystals containing metallic colloids studied by Scanning Near-Field Optical Microscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274984'>Pulsed laser ablation of a continuously-fed wire in liquid flow for high-yield production of silver nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53697'>Single molecule magnets: from thin films to nano-patterns (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID275001'>Effects of post-reactor functionalization on the phase behaviour of an ethylene-1-octene copolymer studied using solid-state high resolution C-13 NMR spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33696'>Exact reaction dynamics by the hyperquantization algorithm: integral and differential cross sections for F + H2, including long-range and spin-orbit effects (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID9779'>Vibrational analysis as a powerful tool in structure elucidation of polyarsenicals: a DFT-based investigation of arsenicin A. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54565'>Development of a semiempirical potential for simulations of thiol-gold interfaces. Application to thiol-protected gold nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40861'>Enhanced mechanical strength of zeolites by adsorption of guest molecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID273248'>Structures and excited state properties of 2-and 3-hydroxybiphenyl complexed with cyclodextrins (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33664'>Analysis of the n3+n7 combination band of CF2Cl2 from spectra obtained by high resolution diode laser and FTIR supersonic jet techniques (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171136'>Chiral recognition of diols by complexation with (R)-(+)-1-phenyl-1-propanol: a R2PI approach in supersonic beam (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID175722'>Absorption and fluorescence properties of oligothiophene biomarkers from long-range-corrected time-dependent density functional theory (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47544'>Electroanalytical Features of non-Uniformly Doped Conducting Poly-3-(3,4,5-Trifluorophenyl)Thiophene Films (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID13904'>The excited states of pi-stacked 9-methyl adenine oligomers: a TD-DFT study in aqueous solution (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33491'>WATER ACTIVATION BY SO2+ IONS: AN EFFECTIVE SOURCE OF OH RADICALS (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196830'>Recent advances and perspectives in four-component Dirac-Kohn-Sham calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID289800'>Electro-osmotic flow in coated nanocapillaries: A theoretical investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID228173'>Inverse freezing in molecular binary mixtures of alpha-cyclodextrin and 4-methylpyridine (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33627'>Laal1-xcrxo3 perovskite-type solid solutions: Structural, electronic, magnetic properties and catalytic activity towards CO oxidation. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17109'>Extended Viologen as a Source of Electric Oscillations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17105'>Absorption and emission spectra of fluorescent silica nanoparticles from TD-DFT/MM/PCM calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID55200'>Thermal behaviour and electrochemical properties of bis(trifluoromethanesulfonyl)amide and dodecatungstosilicate viologen dimers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID187591'>Transport properties of armchair graphene nanoribbon junctions between graphene electrodes (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194802'>Optoelectronic properties of (ZnO)(60) isomers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195172'>Optoelectronic properties of (ZnO)60 isomers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313744'>Environmental and complexation effects on the structures and spectroscopic signatures of organic pigments relevant to cultural heritage: the case of alizarin and alizarin-Mg(II)/Al(III) complexes (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47933'>Dynamics of the insertion reaction C(D1)+H2: A comparison of crossed molecular beam experiments with quasiclassical trajectory and quantum mechanical scattering calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168341'>Diffusion-mediated resonant energy transfer in lanthanide-based polymer white-light-emitting diodes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40313'>Parameterization and Validation of an Accurate Force-Field for the Simulation of Alkyl-Amine Functionalized Silicon (111) Surfaces (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40349'>Prediction of the structures of free and oxide-supported nanoparticles by means of atomistic approaches: the benchmark case of nickel clusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID200681'>Properties and structure of interfacial layers formed by hydrophilic silica dispersions and palmitic acid (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195371'>Absorption spectra of natural pigments as sensitizers in solar cells by TD-DFT and MRPT2: protonated cyanidin (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171150'>Chiral recognition between 1-(4-fluorophenyl)ethanol and 2-butanol: higher binding energy of homochiral complexes in the gas phase (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID178821'>First principles study of water oxidation catalyzed by a tetraruthenium-oxo core embedded in polyoxometalate ligands (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54594'>Efficient crystallization induced emissive materials based on a simple pushpull molecular structure (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22265'>Charge storage and the oxygen evolution reaction in mixed Ni  Li oxides (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40629'>Silver nanoparticles behave as hydrophobic solutes towards the liquid water structure in the interaction shell. A Raman study in the O-H stretching region (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22655'>A computational study of the excited states of bilirubin IX (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54518'>Weak forces at work in dye-loaded zeolite materials: spectroscopic investigation on cation-sulfur interactions (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47261'>Adsorption of CS2 on mgo microcrystals: formation of a S-doped mgo surface (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48491'>Complexation of apigenin and luteolin in weld lake: a DFT/TDDFT investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID25622'>A semi-classical model of attosecond electron localization in dissociative ionization of hydrogen (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID36500'>Chemoresistive sensing of light alkanes with SnO2 nanocrystals: a DFT-based insight (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID302264'>Characterisation of the electronic structure of some stable nitroxyl radicals using variable energy photoelectron spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID200069'>Study of the ST2 model of water close to the liquid-liquid critical point (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48439'>An integrated experimental and theoretical investigation on Cu(hfa)2?TMEDA: structure, bonding and reactivity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192664'>Vibrationally resolved circular dichroism spectra of a molecule with isotopically engendered chirality (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34155'>On the origin of the forward peak and backward oscillations in the F+H2(v=0) --> HF(v'=2) + H reaction (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID295435'>XAS of tetrakis(phenyl)- and tetrakis(pentafluorophenyl)-porphyrin: An experimental and theoretical study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48382'>First-principles semiclassical initial-value representation molecular dynamics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID295391'>The effect of donor content on the efficiency of P3HT:PCBM bilayers: optical and photocurrent spectral data analyses (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47487'>A Theoretical Study of the Chemisorption of H2O and H2S on the Ti2O3(1012) Non-Polar Surface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284256'>Niobium-silica catalysts for the selective epoxidation of cyclic alkenes: the generation of the active site by grafting niobocene dichloride (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48529'>Enhancing the efficiency of two-photon absorption by metal coordination (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID285751'>IrO2 as a promoter of Pt-Ru for methanol electro-oxidation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48535'>Synthesis and studies of water-soluble Prussian Blue-type nanoparticles   into chitosan beads (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300273'>Ab initio study of the circular intensity difference in electric-field-induced second harmonic generation of chiral natural amino acids (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID167911'>Fluorescence emission from photo-fragments after resonant S 2p excitations in H2S (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40038'>Plicatin B Conformational Landscape and Affinity to Copper (I and II) Metal Cations. A DFT Study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196822'>Experimental and theoretical evidence of charge transfer in weakly bound complexes of water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID204650'>Formation of ultracold metastable RbCs molecules by short-range photoassociation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID310015'>Solid state effects on the electronic structure of H2OEP (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID14229'>The excited electronic states of adenine-guanine stacked dimers in aqueous solution: a PCM/TD-DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52384'>Thermal hysteresis of Morin transition in hematite particles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID283446'>Structural and electronic properties of organo-halide lead perovskites: A combined IR-spectroscopy and ab initio molecular dynamics investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li></ul></dd><dt>Alternative label</dt><dd><ul><li>PCCP, Phys. chem. chem. phys. (literal)</li><li>Physical chemistry chemical physics. (literal)</li><li>PCCP (literal)</li></ul></dd><dt>Language</dt><dd><ul><li>eng (literal)</li></ul></dd><dt>Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#issn</dt><dd><ul><li>1463-9076 (literal)</li></ul></dd><dt>Preferred label</dt><dd><ul><li>PCCP. Physical chemistry chemical physics (literal)</li></ul></dd><dt>Publisher</dt><dd><ul><li>The Royal Society of Chemistry, Cambridge : GBR (literal)</li></ul></dd>

</dl>

<br/><h4>Incoming links:</h4><br/><dl><dt>Rivista</dt><dd><ul><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID229'>Time dependent density functional investigation of the near-edge absorption spectra of V2O5 (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID697'>Dielectric scaling in polyelectrolyte solutions with different solvent quality in the dilute concentration regime (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID637'>Unravelling single metalloprotein electron transfer by scanning probe techniques (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID3064'>Water hydrogen bond analysis on hydrophilic and hydrophobic biomolecule sites (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID3619'>About the albumin structure in solution: cigar Expanded form versus heart Normal shape (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID4023'>Theoretical study on oligothiophene N-succinimidyl esters: size and push-pull effects (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID9761'>Protein stability modulated by a conformational effector: effects of trifluoroethanol on bovine serum albumin. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID14229'>The excited electronic states of adenine-guanine stacked dimers in aqueous solution: a PCM/TD-DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15203'>Structure and Spatial Distribution of the Spin-Labelled Lipopeptide Trichogin GA IV in a Phospholipid Membrane Studied by Pulsed ElectronElectron Double Resonance (PELDOR). (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17105'>Absorption and emission spectra of fluorescent silica nanoparticles from TD-DFT/MM/PCM calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17109'>Extended Viologen as a Source of Electric Oscillations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID18187'>Extension of the AMBER force-field for the study of large nitroxides in condensed phases: an ab initio parameterization (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21511'>Localized and itinerant electronic states at the insulatormetal transition in Y1xCaxVO3+d: evidence from electric transport, magnetic properties and XAS spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21537'>Preparation, structural and magnetic characterization of RF-sputtered La1-xNaxMnO3±d thin film manganites (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21908'>Oscillation of interfacial properties in liquid systems: assessment of harmonic distortion (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22092'>Oxygen diffusion in nanocrystalline yttria-stabilized zirconia: the effect of grain boundaries (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID27120'>Different factors affecting polyat conformation in microemulsions. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33664'>Analysis of the n3+n7 combination band of CF2Cl2 from spectra obtained by high resolution diode laser and FTIR supersonic jet techniques (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33696'>Exact reaction dynamics by the hyperquantization algorithm: integral and differential cross sections for F + H2, including long-range and spin-orbit effects (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID36500'>Chemoresistive sensing of light alkanes with SnO2 nanocrystals: a DFT-based insight (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID9779'>Vibrational analysis as a powerful tool in structure elucidation of polyarsenicals: a DFT-based investigation of arsenicin A. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID14128'>The polarizability in solution of tetra-phenyl-porphyrin derivatives in their excited electronic states: A PCM/TD-DFT study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15180'>Solvent Effect on the Distance Distribution Between Spin Labels in Aggregated Spin Labeled Trichogin GA IV Dimer Peptides as Studied by Pulsed ElectronElectron Double Resonance. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17021'>Singlet-triplet energy gap of a diarylnitroxide diradical by an accurate many-body perturbative approach (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17099'>Theoretical Study of the Conformational and Optical Properties of a Fluorescent Sensor Grafted on Apolar Polymer Structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19890'>Affinity of the anthracycline antitumor drugs Doxorubicin and Sabarubicin for human telomeric G-quadruplex structures. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22265'>Charge storage and the oxygen evolution reaction in mixed Ni  Li oxides (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22375'>mu-XANES mapping of buried interfaces: pushing microbeam techniques to the nanoscale (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID27225'>PolyAT chemical denaturation in w/o microemulsion (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33680'>Laser spectroscopy of 1, 2, 3, 4-Tetrahydro-1-naphthol-ROH (R=H, CH3) clusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33681'>Chiral aggregates of indan-1-ol with secondary alcohols and water: laser spectroscopy in supersonic beams (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34155'>On the origin of the forward peak and backward oscillations in the F+H2(v=0) --> HF(v'=2) + H reaction (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34559'>A study of  selected fragmentation path of the etyne dication: theory and experiment (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34562'>Exploring the accuracy level of new potential energy surfaces for the F+HD reactions: from exact quantum rate constants to the state-to-state reaction dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID13904'>The excited states of pi-stacked 9-methyl adenine oligomers: a TD-DFT study in aqueous solution (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID15374'>Binding of a chiral drug to a protein: an investigation of the 2-(3-benzoylphenyl) propionic acid/bovine serum albumin system by circular dichroism and fluorescence (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID16914'>Modeling the Zn+2 binding in the 1-16 region of the amyloid-beta peptide involved in Alzheimer's disease (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17015'>Computing the inhomogeneous broadening of electronic transitions in solution: a first-principle quantum mechanical approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17018'>Fluorescence spectra of organic dyes in solution: a time dependent multilevel approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17062'>In-situ FTIR spectroelectrochemical study on mechanism of ethylene glycol electrocatalytic oxidation at Pd electrode (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17098'>Complementary and partially complementary DNA duplexes tethered to a functionalized substrate: a molecular dynamics approach to biosensing (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID17100'>Molecular Dynamics and Monte Carlo Simulations for the Structure of the Aqueous Trimethylammonium Chloride Solution in the 0.2-1 Molar Range (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19468'>Stability and transformation mechanism of weddellite nanocrystals studied by X-Ray diffraction and Infrared spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID19830'>Colloidal semiconductor/magnetic heterostructures based on iron-oxide-functionalized brookite TiO2 nanorods (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21438'>Raman spectroscopy of AMn2O4 (A=Mn, Mg, Zn) spinels (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21501'>The Eu1-xBa2-xCu3Oy system: oxygen content, phase transitions, point defect equilibria, and charge carriers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21513'>Do we have a probe for the initial stages of solid state reactions?, (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID21807'>The columbite-type Fe1-xMnxNb2O6 solid solution: structural characterization and magnetic behavior (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID22655'>A computational study of the excited states of bilirubin IX (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID25622'>A semi-classical model of attosecond electron localization in dissociative ionization of hydrogen (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33491'>WATER ACTIVATION BY SO2+ IONS: AN EFFECTIVE SOURCE OF OH RADICALS (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33627'>Laal1-xcrxo3 perovskite-type solid solutions: Structural, electronic, magnetic properties and catalytic activity towards CO oxidation. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID33803'>LaAl1-xMnxO3 perovskite-type oxide solid solutions: structural,magnetic and electronic properties. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34316'>VUV Photon induced fluorescence study of SF5CF3 (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID34360'>Eley-Rideal recombination of hydrogen atoms on a tungsten surface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39032'>Effect of heterogeneity in the distribution of ligands and proteins among disconnected particles: the binding of ubiquinone to bacterial reaction center (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39177'>Activity coefficients of lanthanum salts at 298.15 K (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39190'>Aggregation processes and photophysical properties of chlorophyll a in aqueous solutions modulated by the presence of cyclodextrins (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39824'>Position-dependent energy of molecules in nano-confined water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39974'>Metal adsorption on oxide polar ultrathin films (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40151'>Assessment of a computational strategy approaching spectroscopic accuracy for structure, magnetic properties and vibrational frequencies of organic free radicals: the F2CN and F2BO case (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40311'>Absorption and emission UV-Vis spectra of the TRITC fluorophore molecule in solution: a quantum mechanical study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40324'>The CO-Ne van der Waals complex: ab initio intermolecular potential energy, interaction induced electric dipole moment and polarizability surfaces, and second virial coefficients (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40332'>The catalytic effect of water on the ketoenol tautomerism. Pyruvate and acetylacetone: a computational challenge (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40341'>Directed assembly of Au and Fe nanoparticles on a TiOx/Pt(111) ultrathin template: the role of oxygen affinity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40632'>Pushing the limit of liquid-state Dynamic Nuclear Polarization at high field (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40765'>Optimization of chemical ordering in AgAu nanoalloys (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40769'>Tracking thermally-activated transformations in a nanostructured metal/oxide/metal system (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40808'>Interaction of single water molecules with silanols in mesoporous silica (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40821'>The fourth virial coefficient of a nonadditive hard-disc mixture (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID44431'>Analysis of the n3+n7 combination band of CF2Cl2 from spectra obtained by diode laser and Fourier Transform Spectrometer supersonic jet techniques (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47871'>Gas phase protonation of trifluoromethyl sulfur pentafluoride (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48078'>Application Of Valence-Bond Techniques To The Study Of Weakly Bound  Complexes. The Potential Energy Surface Of The Ne-CH4 Systyem (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48367'>Carbonyl copper(I) complexes with hydrotris(1,2,4-triazolyl)borate,    hydrotris(pyrazolyl)borate, and tris(pyrazolyl)methane ligands: a DFT    study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48382'>First-principles semiclassical initial-value representation molecular dynamics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48439'>An integrated experimental and theoretical investigation on Cu(hfa)2?TMEDA: structure, bonding and reactivity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50486'>A spectroscopic and structural characterization of the inclusion complexes of p-dimethylaminobenzonitrile with cyclodextrins (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50789'>Functional polymers: Scanning Force Microscopy insights (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51163'>Structure and properties of licochalcone A-human serum albumin complexes in solution: a spectroscopic, photophysical and computational approach to understand drug-protein interaction (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51249'>Spectroscopic signatures for planar equilibrium geometries in methyl-substituted oligothiophenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51321'>Affinity of the anthracycline antitumoral drugs Doxorubicin and Sabarubicin for human telomeric G-quadruplex structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52384'>Thermal hysteresis of Morin transition in hematite particles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52444'>The valence electronic structure and conformational flexibility of epichlorohydrin (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53587'>Dimerization of urea in water solution: a quantum mechanical investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54031'>Valence electronic structure of epichlorohydrin: experiment and theory (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54518'>Weak forces at work in dye-loaded zeolite materials: spectroscopic investigation on cation-sulfur interactions (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54565'>Development of a semiempirical potential for simulations of thiol-gold interfaces. Application to thiol-protected gold nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID55209'>Relativistic DFT calculations of the NMR properties and reactivity of transition metal methane s­complexes: insights on C-H bond activation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID57767'>Förster resonance energy transfer (FRET) with a donor-acceptor system adsorbed on silver or gold nanoisland films (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58575'>Role of the reagents consumption in the chaotic dynamics of the Belousov- Zhabotinsky oscillator in closed unstirred reactors (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58662'>Valence electronic properties of porphyrin derivatives (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39356'>B3LYP/6-31G* conformational landscape in vacuo of some pterocarpan stereoisomers with biological activity (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39540'>Spontaneous emulsification of detergent solubilized Reaction Center: protein conformational changes precede droplets growth (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40038'>Plicatin B Conformational Landscape and Affinity to Copper (I and II) Metal Cations. A DFT Study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40313'>Parameterization and Validation of an Accurate Force-Field for the Simulation of Alkyl-Amine Functionalized Silicon (111) Surfaces (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40349'>Prediction of the structures of free and oxide-supported nanoparticles by means of atomistic approaches: the benchmark case of nickel clusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40629'>Silver nanoparticles behave as hydrophobic solutes towards the liquid water structure in the interaction shell. A Raman study in the O-H stretching region (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40861'>Enhanced mechanical strength of zeolites by adsorption of guest molecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48189'>Two-photon absorption of Zn(II) octupolar molecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48338'>Quasi-classical trajectory study of the adiabatic reactions occurrion the two lowest-lying electronic states of the LiH2+ systemng (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48396'>The intermolecular potential in NO-N-2 and (NO-N-2)(+) systems: implications for the neutralization of ionic molecular aggregates (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48491'>Complexation of apigenin and luteolin in weld lake: a DFT/TDDFT investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48529'>Enhancing the efficiency of two-photon absorption by metal coordination (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48535'>Synthesis and studies of water-soluble Prussian Blue-type nanoparticles   into chitosan beads (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50671'>Redox and Spin Trapping Properties of phosphoryldithioformates. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50714'>The electron transfer rate of large TPA based compounds: a joint theoretical and electrochemical approach (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51215'>Energy Transfer Processes in Electronically Coupled Porphyrin Hetero-Dyads Connected at the beta Position (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51228'>Chiral recognition of 2-(3-benzoylphenyl)propionic acid (ketoprofen) by serum albumin: an investigation with microcalorimetry, circular dichroism and molecular modelling (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51930'>Lithium Fluoride films and crystals containing metallic colloids studied by Scanning Near-Field Optical Microscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52224'>XAS characterization and CO oxidation on delta-allumina supported La, Mn, Co and Fe oxides (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53288'>Conformation of dimethoxymethane: roles of anomeric effects and weak hydrogen bonds. A free jet microwave study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53392'>Structure dipole moment and large amplitude motions of 1-benzofuran (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53605'>Crossed beam studies of radical-radical reactions: O(3P)+ C3H5 (alyl) (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID54594'>Efficient crystallization induced emissive materials based on a simple pushpull molecular structure (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID55200'>Thermal behaviour and electrochemical properties of bis(trifluoromethanesulfonyl)amide and dodecatungstosilicate viologen dimers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39009'>Analytic calculations of nonlinear mixed electric and magnetic frequency-dependent molecular properties using London atomic orbitals: Buckingham birefringence (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39015'>A coupled cluster response study of the electr ic dipole polarizability, first and second hyperpolarizabilities of hcl. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39028'>The heat capacity relaxation and the enthalpy decrease in mass and diffusion-controlled polymerization reaction kinetics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39733'>Structures and Energetics of 98-atom Pd-Pt Nanoalloys: Potential Stability of the Leary Tetrahedron for Bimetallic Nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID39939'>Absorption and electroabsorption spectra of [(NH3)5Ru-pyrazine]+2 and [(NH3)5Ru-pyrazine-H]+3 by vibronic model Hamiltonian (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40296'>Emerging methods for fabricating functional structure by patterning and assembling engineered nanocrystals (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40317'>Theoretical Multilevel Approach for studying the Photophysical Properties of Organic Dyes in solution (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40321'>Au nanoparticles on a templating TiOx/Pt(111) ultrathin polar film: a photoemission and photoelectron diffraction study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID40410'>The excited states of adenine-guanine stacked dimers in aqueous solution: a PCM/TD-DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47261'>Adsorption of CS2 on mgo microcrystals: formation of a S-doped mgo surface (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47487'>A Theoretical Study of the Chemisorption of H2O and H2S on the Ti2O3(1012) Non-Polar Surface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47544'>Electroanalytical Features of non-Uniformly Doped Conducting Poly-3-(3,4,5-Trifluorophenyl)Thiophene Films (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID47933'>Dynamics of the insertion reaction C(D1)+H2: A comparison of crossed molecular beam experiments with quasiclassical trajectory and quantum mechanical scattering calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48265'>Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48418'>Results and perspectives of the MO-VB method. Application examples on the He2 and the LiHHe complexes. (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48465'>Vinblastine perturbation of tubulin protofilament structure: a computational insight (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48598'>Optical properties of ZnO nanostructures: a hybrid DFT/TDDFT investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48632'>Halogen bonding in ligand-receptor systems in the framework of classical force fields (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID48716'>Effect of SiO2 on the dynamics of proton conducting [Nafion/(SiO2)X] composite membranes: a solid-state 19F NMR study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50574'>A correlation between electrochemical properties and geometrical structure of some triarylamines used as hole transporting materials in organic electroluminescent devices (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID50745'>Diastereoselectivity and site-dependency in the photochemistry of ketoprofen in the bovine serum albumin matrix (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51257'>Solvent polarity effect on intramolecular electron transfer in a corrole-naphthalene bisimide dyad (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51325'>Silyloxyazadienes: one intermediate and two competitive pericyclic reactions (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID51954'>Very high resolution near-field chemical imaging using an infrared free electron laser (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID52470'>Protonation states in a cobalt-oxide catalyst for water oxidation: fine comparison of ab initio molecular dynamics and X-ray absorption spectroscopy results (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53697'>Single molecule magnets: from thin films to nano-patterns (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID53715'>The Grounds for the Activity of TPAP in Oxidation Catalysis in Supercritical Carbon Dioxide when Confined in Hybrid Fluorinated Sol-Gel Silica Matrices (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID57510'>Photopolymerization of Diacetylene-Capped Gold Nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID58697'>Dissociative double photoionization of CO2 molecules in the 36-49 eV energy range: angular and energy distribution of ion products (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168552'>Optical Characterization of Quasi-monomolecular Layers of the Nonlinear Polymer polyDCHD-HS (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168616'>Dissymmetry effects on the laser spectroscopy of supersonically expanded rare gas/chiral arene heteroclusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168709'>Germanium K edge in GeO2 polymorphs. Correlation between local coordination and electronic structure of germanium (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171139'>Characterization of vanadium oxide on ZrO2-based catalyst precursors (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172764'>Amphoteric behaviour of Er3+ dopants in BaTiO3: an Er-LIII edge EXAFS assessment (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID173744'>Structural organization and phase behaviour of 1-butyl-3-methylimidazolium hexafluorophosphate: an high pressure Raman spectroscopy study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID175722'>Absorption and fluorescence properties of oligothiophene biomarkers from long-range-corrected time-dependent density functional theory (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID178683'>Combination of spectroscopic and computational methods to get an understanding of supramolecular chemistry of drugs: from simple host systems to biomolecules (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID184465'>Empty level structure of boryl-substituted pentacyclic heteroaromatics (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID187591'>Transport properties of armchair graphene nanoribbon junctions between graphene electrodes (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID189656'>Superparamagnetic blocking and superspin-glass freezing in ultra small delta-(Fe0.67Mn0.33)OOH particles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192664'>Vibrationally resolved circular dichroism spectra of a molecule with isotopically engendered chirality (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194059'>Status and perspectives in thin films and patterning of spin crossover compounds (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194253'>Implementation and validation of a multi-purpose virtual spectrometer for large systems in complex environments (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195025'>Computational modelling of TiO2 surfaces sensitized by organic dyes with different anchoring groups: adsorption modes, electronic structure and implication for electron injection/recombination (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195198'>Adsorption of organic dyes on TiO2 surfaces in dye-sensitized solar cells: interplay of theory and experiment (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195848'>The soft X-ray absorption spectrum of the allyl free radical (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196822'>Experimental and theoretical evidence of charge transfer in weakly bound complexes of water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196830'>Recent advances and perspectives in four-component Dirac-Kohn-Sham calculations (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID198721'>Switching of emissive and NLO properties in push-pull chromophores with crescent PPV-like structures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID167639'>Searching for the optimum structures of alloy nanoclusters (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168995'>Observation and control of coherent torsional dynamics in a quinquethiophene molecule (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169699'>Micron-sized [6,6]-phenyl C61 butyric acid methyl ester crystals grown by dip coating in solvent vapour atmosphere: interfaces for organic photovoltaics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID170019'>Molecular origin and hydration dependence of protein anharmonicity: an elastic neutron scattering study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171150'>Chiral recognition between 1-(4-fluorophenyl)ethanol and 2-butanol: higher binding energy of homochiral complexes in the gas phase (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172601'>Conformational preferences of chiral molecules: free jet rotational spectrum of 1-phenyl-1-propanol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID187777'>Design of efficient methanol impermeable membranes for fuel cell applications (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190278'>Dissociative double photoionization of benzene molecules in the 26-33 eV energy range (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192663'>Barrierless photoisomerisation of the ''simplest cyanine'': Joining computational and femtosecond optical spectroscopies to trace the full reaction path (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID193485'>Cavitation dynamics of laser ablation of bulk and wire-shaped metals in water during nanoparticles production (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID193878'>The initiation mechanisms for surface hydrosilylation with 1-alkenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194802'>Optoelectronic properties of (ZnO)(60) isomers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195066'>Selective TDDFT with automatic removal of ghost transitions: application to a perylene-dye-sensitized solar cell model (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID200069'>Study of the ST2 model of water close to the liquid-liquid critical point (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID200681'>Properties and structure of interfacial layers formed by hydrophilic silica dispersions and palmitic acid (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID202566'>High resolution inner-shell spectroscopy and ab initio CI calculations on TiCl4 and isoelectronic molecules (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID204650'>Formation of ultracold metastable RbCs molecules by short-range photoassociation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID209557'>JOYCE and ULYSSES: integrated and user-friendly tools for the parameterization of intramolecular force fields from quantum mechanical data (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID167911'>Fluorescence emission from photo-fragments after resonant S 2p excitations in H2S (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID168341'>Diffusion-mediated resonant energy transfer in lanthanide-based polymer white-light-emitting diodes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169666'>Manganese ions in the monoclinic, tetragonal and cubic phases of zirconia: an XRD and EPR study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID169676'>Mass resolved laser spectroscopy of micro-solvated R(+)-1-phenyl-1-propanol: A chiral molecule of biological interest (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171136'>Chiral recognition of diols by complexation with (R)-(+)-1-phenyl-1-propanol: a R2PI approach in supersonic beam (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID171412'>A numerical study of one-patch colloidal particles: from square-well to Janus (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172002'>Preferential solvation of glucose and talose in water-acetonitrile mixtures: a molecular dynamics simulation study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID172373'>Tetraphenylporphyrin electronic properties: a combined theoretical and experimental study of thin films deposited by SuMBD (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID177424'>Water adsorption on the stoichiometric and reduced CeO2(111) surface:A first-principles investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID177781'>Theoretical investigation of the hydrogen atoms transfer in the adenine-thymine base pair and its coupling with the electronic rearrangement. Concerted vs stepwise mechanism (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID178821'>First principles study of water oxidation catalyzed by a tetraruthenium-oxo core embedded in polyoxometalate ligands (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID179458'>The free jet microwave spectrum of 2-phenylethylamine-water (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID181164'>Local structure of [Cu-I(CO)(2)](+) adducts hosted inside ZSM-5 zeolite probed by EXAFS, XANES and IR spectroscopies (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190288'>Amino-carboxylic recognition on surfaces: From 2D to 2D + 1 nano-architectures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID190549'>Organic photovoltaic devices with colloidal TiO2 nanorods as key functional components (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID191805'>Excitonic recombination in superstoichiometric nanocrystalline TiO2 grown by cluster precursors at room temperature (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192662'>Comparison of vertical and adiabatic harmonic approaches for the calculation of the vibrational structure of electronic spectra (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID192667'>Intermolecular Exciton Coupling and Vibronic Effects in Solid-State Circular Dichroism: a Case Study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID194432'>A first step towards the understanding of the 5-HT3 receptor subunit heterogeneity from a computational point of view (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195085'>Challenges in the simulation of dye-sensitized ZnO solar cells: quantum confinement, alignment of energy levels and excited state nature at the dye/semiconductor interface (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195172'>Optoelectronic properties of (ZnO)60 isomers (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID195371'>Absorption spectra of natural pigments as sensitizers in solar cells by TD-DFT and MRPT2: protonated cyanidin (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID196674'>The dynamic crossover in water does not require bulk water (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID211457'>Insights into the polymorphism of glycine: membrane crystallization in an electric field (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID217202'>Prospects for hydrogen storage in graphene (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID225392'>Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260519'>An EINS Study on the Fragility of Homologues Disaccharides/H2O Mixtures (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260584'>Can we control the electronic energy transfer in molecular dyads through metal nanoparticles? A QM/continuum investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID263172'>Coinage Metal Exciplexes with Helium Atoms: A Theoretical Study of the M*(2L)Hen (M = Cu, Ag, Au; L = P, D) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID273248'>Structures and excited state properties of 2-and 3-hydroxybiphenyl complexed with cyclodextrins (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID228173'>Inverse freezing in molecular binary mixtures of alpha-cyclodextrin and 4-methylpyridine (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID271528'>Blue-green emitting sulphonamido-imidazole derivatives: ESIPT based excited state dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID273022'>Oxygen transport in nanostructured lanthanum manganites (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID216147'>Nano-Raman imaging of Cu-TCNQ clusters in TCNQ thin films by scanning near-field optical microscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID228204'>Synthesis and microstructure of manganese ferrite colloidal nanocrystals (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID241083'>Ultrafast spectroscopy of linear carbon chains: The case of dinaphthylpolyynes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID252031'>Large amplitude motions in the electronic ground state of 4-fluoroaniline (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID254401'>Determination of the oxidation and coordination state of copper on different Cu-based catalysts by XANES spectroscopy in situ or in operando conditions (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID260571'>Cytochrome C on a gold surface: investigating structural relaxations and their role in protein-surface electron transfer by molecular dynamics simulations (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID265070'>NIR emission of cyclic [4]rotaxanes containing pi-extended porphyrin chromophores (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID272283'>Efficient solar water oxidation using photovoltaic devices functionalized with earth-abundant oxygen evolving catalysts (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274146'>In situ pair distribution function study on lanthanum doped ceria (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID275255'>The effect of fluorine substitution on chiral recognition: interplay of CH...pi p, OH...pi p and CH... pi interactions in gas- phase complexes of 1-aryl-1-ethanol with butan-2-ol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID277861'>Lithium salts as \"redox active\" p-type dopants for organic semiconductors and their impact in solid-state dye-sensitized solar cells (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274953'>Exploring and rationalising an effective n-doping of large area CVD-Graphene by NH3 (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID274984'>Pulsed laser ablation of a continuously-fed wire in liquid flow for high-yield production of silver nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID275001'>Effects of post-reactor functionalization on the phase behaviour of an ethylene-1-octene copolymer studied using solid-state high resolution C-13 NMR spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID278776'>Collective dynamics of supercooled water close to the liquid-liquid coexistence lines (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284173'>Concentration dependence of hydration water in a model peptide (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288237'>The effect of protein composition on hydration dynamics (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288601'>Highly efficient photoanodes for dye solar cells with a hierarchical meso-ordered structure (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288883'>Interaction of cisplatin and two potential antitumoral platinum(II) complexes with a model lipid membrane: a combined NMR and MD study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291577'>Roads leading to roam. Role of triple fragmentation and of conical intersections in photochemical reactions: Experiments and theory on methyl formate (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294376'>The interactions of methyl tert-butyl ether on high silica zeolites: a combined experimental and computational study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297010'>On the origin of the very strong two-photon activity of squaraine dyes - a standard/damped response theory study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297401'>Chemical ordering in magic-size Ag-Pd nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297448'>Adsorbate induced vacancy formation on silver surfaces (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297552'>Ligand/cluster/support catalytic complexes in heterogeneous ultrananocatalysis: NO oxidation on Ag-3/MgO(100) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID299738'>Viologen-based ionic liquid crystals: Induction of a smectic A phase by dimerisation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300273'>Ab initio study of the circular intensity difference in electric-field-induced second harmonic generation of chiral natural amino acids (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID305213'>Influence of metal-support interaction on the surface structure of gold nanoclusters deposited on native SiOx/Si substrates (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID308068'>Keggin heteropolyacid H3PW12O40 supported on different oxides for catalytic and catalytic photo-assisted propene hydration (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312310'>Axial iron coordination and spin state change in a heme c upon electrostatic protein-SAM interaction (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312337'>High resolution NEXAFS of perylene and PTCDI: a surface science approach to molecular orbital analysis (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312344'>Theoretical investigation of the coupling between hydrogen atoms transfer and stacking interaction in guanine-cytosine dimers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID314117'>Accurate structure, thermodynamic and spectroscopic parameters from CC and CC/DFT schemes: the challenge of the conformational equilibrium in glycine (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID315458'>Cyclic dipeptide immobilization on Au(111) and Cu(110) surfaces (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318264'>Dynamics of a lipid bilayer induced by electric fields (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID281874'>Electronic properties of CuPc and H2Pc: an experimental and theoretical study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID283446'>Structural and electronic properties of organo-halide lead perovskites: A combined IR-spectroscopy and ab initio molecular dynamics investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID283498'>Vaporization of the prototypical ionic liquid BMImNTf(2) under equilibrium conditions: a multitechnique study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284256'>Niobium-silica catalysts for the selective epoxidation of cyclic alkenes: the generation of the active site by grafting niobocene dichloride (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID286444'>The H + HeH+ -> He + H-2(+) reaction from the ultra-cold regime to the three-body breakup: exact quantum mechanical integral cross sections and rate constants (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID289800'>Electro-osmotic flow in coated nanocapillaries: A theoretical investigation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291469'>On the macromolecular cellulosic network of paper: Changes induced by acid hydrolysis studied by NMR diffusometry and relaxometry (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID291568'>Control of conformers combining cooling by supersonic expansion of seeded molecular beams with hexapole selection and alignment: Experiment and theory on 2-butanol (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID292245'>Hydrogen-dimer lines and electron waveguides in graphene (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294172'>Structural, dynamic and photophysical properties of a fluorescent dye incorporated in an amorphous hydrophobic polymer bundle (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID294384'>Novel insights on magadiite disaggregation: a multitechnique study on thermal stability. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297442'>Interface structure and reactivity of water-oxidation Ru-polyoxometalate catalysts on functionalized graphene electrodes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300291'>Photothermally controlled structural switching in fluorinated polyene-graphene hybrids (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID300892'>Large ferroelectric polarization in the new double perovskite NaLaMnWO6 induced by non-polar instabilities (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID303459'>Structural, electronic and ferroelectric properties of croconic acid crystal: a DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID303930'>Molecular dynamics simulations of PNA-PNA and PNA-DNA duplexes by the use of new parameters implemented in the GROMACS package: A conformational and dynamics study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID308137'>Palladium local structure of La1-xSrxCo1-yFey-0.03Pd0.03O3-? perovskites synthesized using a one pot citrate method (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313744'>Environmental and complexation effects on the structures and spectroscopic signatures of organic pigments relevant to cultural heritage: the case of alizarin and alizarin-Mg(II)/Al(III) complexes (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313894'>Electronic excitations of C-60 aggregates (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID317635'>Self-seeded nucleation of Cu nanoclusters on Al2O3/Ni3Al(111): an ab initio investigation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID319219'>The interactions of nitrogen dioxide with graphene-stabilized Rh clusters: a DFT study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID324937'>Theoretical study of sulfur L-edge XANES of thiol protected gold nanoparticles (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID284255'>Structural and morphological modifications of thermally reduced cerium oxide ultrathin epitaxial films on Pt(111) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID285751'>IrO2 as a promoter of Pt-Ru for methanol electro-oxidation (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID287225'>Ultrafast resonance energy transfer in the umbelliferone-alizarin bichromophore (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID287391'>Controllable synthesis and SERS characteristics of hollow sea-urchin gold nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID288604'>Computational modeling of single-versus double-anchoring modes in di-branched organic sensitizers on TiO2 surfaces: structural and electronic properties (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID295391'>The effect of donor content on the efficiency of P3HT:PCBM bilayers: optical and photocurrent spectral data analyses (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID295435'>XAS of tetrakis(phenyl)- and tetrakis(pentafluorophenyl)-porphyrin: An experimental and theoretical study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID297558'>A grouping approach to homotop global optimization in alloy nanoparticles (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID298681'>Analytical model and multiscale simulations of A? peptide aggregation in lipid membranes: Towards a unifying description of conformational transitions, oligomerization and membrane damage (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID299764'>Spectroscopic signatures of the carbon buckyonions C-60@C-180 and C-60@C-240: a dispersion-corrected DFT study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID301292'>Evidence of benzenoid domains in nanographenes (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID302264'>Characterisation of the electronic structure of some stable nitroxyl radicals using variable energy photoelectron spectroscopy (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID310015'>Solid state effects on the electronic structure of H2OEP (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID312300'>Glycine conformers: a never-ending story? (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313080'>Silver nanoparticles linked by a Pt-containing organometallic dithiol bridge: study of local structure and interface by XAFS and SR-XPS (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313174'>Selectivity in fragmentation of N-methylacetamide after resonant K-shell excitation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID313785'>Fully anharmonic IR and Raman spectra of medium-size molecular systems: accuracy and interpretation (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID315521'>Excess electrons in ice: a density functional theory study (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318092'>Thermal evolution of the submonolayer near-surface alloy of ZnPd on Pd(111) (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318957'>Influence of the percentage of acetylation on the assembly of LbL multilayers of poly(acrylic acid) and chitosan (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318962'>Influence of the molecular architecture on the adsorption onto solid surfaces: comb-like polymers (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID320737'>Photoionization and imaging spectroscopy of rubidium atoms attached to helium nanodroplets (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID323847'>Corrosion of Ni in 1-butyl-1-methyl-pyrrolidinium bis (trifluoromethylsulfonyl) amide room-temperature ionic liquid: an in situ X-ray imaging and spectromicroscopy study (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID318846'>Surface models and reaction barrier in Eley-Rideal formation of H-2 on graphitic surfaces (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID319479'>Surface structure of Pd(111) with less than half a monolayer of Zn (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID321006'>Vibrational branching ratios in the photoelectron spectra of N-2 and CO: interference and diffraction effects (Articolo in rivista)</a> (Prodotto della ricerca)</li><li><a href='http://www.cnr.it/ontology/cnr/individuo/prodotto/ID327388'>Wavelength dispersion of the local field intensity in silver-gold nanocages. (Articolo in rivista)</a> (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)</li></ul></dd>

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