Alloy Catalyst in a Reactive Environment: The Example of Ag-Cu Particles for Ethylene Epoxidation (Articolo in rivista)

Type

• Articolo in rivista (Classe)
• Prodotto della ricerca (Classe)

Label

• Alloy Catalyst in a Reactive Environment: The Example of Ag-Cu Particles for Ethylene Epoxidation (Articolo in rivista) (literal)

Anno

• 2010-01-01T00:00:00+01:00 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi

• 10.1103/PhysRevLett.104.035503 (literal)

Alternative label

• Piccinin, Simone; Zafeiratos, Spiros; Stampfl, Catherine; Hansen, Thomas W.; Haevecker, Michael; Teschner, Detre; Bukhtiyarov, Valerii I.; Girgsdies, Frank; Knop-Gericke, Axel; Schloegl, Robert; Scheffler, Matthias (2010)
  Alloy Catalyst in a Reactive Environment: The Example of Ag-Cu Particles for Ethylene Epoxidation
  in Physical review letters (Print)
  (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori

• Piccinin, Simone; Zafeiratos, Spiros; Stampfl, Catherine; Hansen, Thomas W.; Haevecker, Michael; Teschner, Detre; Bukhtiyarov, Valerii I.; Girgsdies, Frank; Knop-Gericke, Axel; Schloegl, Robert; Scheffler, Matthias (literal)

Pagina inizio

• 35503 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#url

• http://link.aps.org/doi/10.1103/PhysRevLett.104.035503 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume

• 104 (literal)

Rivista

• Physical review letters (Rivista)

Note

• ISI Web of Science (WOS) (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni

• (1) School of Physics, The University of Sydney, Sydney, New South Wales 2006, Australia; (2) CNR-INFM DEMOCRITOS National Simulation Center, Theory@Elettra Group, Trieste, Italy; (3) Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, D-14195 Berlin, Germany; (4) LMSPC-UMR 7515 du CNRS, Strasbourg, France; (5) Boreskov Institute of Catalysis, SB RAS, Novosibirsk 630090, Russia (literal)

Titolo

• Alloy Catalyst in a Reactive Environment: The Example of Ag-Cu Particles for Ethylene Epoxidation (literal)

Abstract

• Combining first-principles calculations and in situ photoelectron spectroscopy, we show how the composition and structure of the surface of an alloy catalyst is affected by the temperature and pressure of the reagents. The Ag-Cu alloy, recently proposed as an improved catalyst for ethylene epoxidation, forms a thin Cu-O surface oxide, while a Ag-Cu surface alloy is found not to be stable. Several possible surface structures are identified, among which the catalyst surface is likely to dynamically evolve under reaction conditions. (literal)

Prodotto di

• Teoria, simulazione e progetto assistito dal calcolatore di materiali nanostrutturati (MD.P06.025.001) (Modulo)
• MD.P06.025.001 Teoria, simulazione e progetto assistito dal calcolatore di materiali nanostrutturati (MD.P06.025.002) (Modulo)

Autore CNR

• SIMONE PICCININ (Unità di personale interno)

Incoming links:

Autore CNR di

• SIMONE PICCININ (Unità di personale interno)

Prodotto

• Teoria, simulazione e progetto assistito dal calcolatore di materiali nanostrutturati (MD.P06.025.001) (Modulo)
• MD.P06.025.001 Teoria, simulazione e progetto assistito dal calcolatore di materiali nanostrutturati (MD.P06.025.002) (Modulo)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#rivistaDi

• Physical review letters (Rivista)