FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2065455332> ?p ?o ?g. }

• W2065455332 endingPage "14928" @default.
• W2065455332 startingPage "14922" @default.
• W2065455332 abstract "Using first principles calculations, we examine how the ensemble effect on the performance of bimetallic catalysts is affected by the change of surface electronic structure associated with their geometric parameters. We look at H2O2 formation from H2 and O2 based on three different Pd monomer systems including AuPd adlayers with a Pd monomer each on Pd(111) [AuPdM/Pd(111)] and Au(111) [AuPdM/Au(111)] and a 55-atom cluster with Au41Pd shell and Pd13 core [Au41Pd@Pd13]. Our calculations show that H2O2 selectivity tends to be significantly deteriorated in the Au41Pd@Pd13 and AuPdM/Au(111) cases, as compared to the AuPdM/Pd(111) case. This is largely due to enhancement of the activity of corresponding surface Pd and its Au neighbors, while isolated Pd surface sites surrounded by less active Au are responsible for the H2O2 formation by suppressing O−O cleavage. This study highlights that ensemble contributions in multimetallic nanocatalysts can be a strong function of their geometric conditions, particularly local strain and effective atomic coordination number at the surface, that are directly related to surface electronic states." @default.
• W2065455332 created "2016-06-24" @default.
• W2065455332 creator A5019219285 @default.
• W2065455332 creator A5042623076 @default.
• W2065455332 creator A5048924452 @default.
• W2065455332 creator A5066805209 @default.
• W2065455332 creator A5087273177 @default.
• W2065455332 date "2010-08-19" @default.
• W2065455332 modified "2023-09-27" @default.
• W2065455332 title "Geometric Parameter Effects on Ensemble Contributions to Catalysis: H₂O₂ Formation from H₂ and O₂ on AuPd Alloys. A First Principles Study" @default.
• W2065455332 cites W1528588768 @default.
• W2065455332 cites W1970127494 @default.
• W2065455332 cites W1985571715 @default.
• W2065455332 cites W1991037743 @default.
• W2065455332 cites W2005178098 @default.
• W2065455332 cites W2006726351 @default.
• W2065455332 cites W2032364562 @default.
• W2065455332 cites W2034229688 @default.
• W2065455332 cites W2035826213 @default.
• W2065455332 cites W2040259333 @default.
• W2065455332 cites W2047514586 @default.
• W2065455332 cites W2049079467 @default.
• W2065455332 cites W2069988560 @default.
• W2065455332 cites W2080804906 @default.
• W2065455332 cites W2090621911 @default.
• W2065455332 cites W2095201585 @default.
• W2065455332 cites W2100657568 @default.
• W2065455332 cites W2118159177 @default.
• W2065455332 cites W2119607070 @default.
• W2065455332 cites W2122427541 @default.
• W2065455332 cites W2950812752 @default.
• W2065455332 doi "https://doi.org/10.1021/jp102851d" @default.
• W2065455332 hasPublicationYear "2010" @default.
• W2065455332 type Work @default.
• W2065455332 sameAs 2065455332 @default.
• W2065455332 citedByCount "53" @default.
• W2065455332 countsByYear W20654553322012 @default.
• W2065455332 countsByYear W20654553322013 @default.
• W2065455332 countsByYear W20654553322014 @default.
• W2065455332 countsByYear W20654553322015 @default.
• W2065455332 countsByYear W20654553322016 @default.
• W2065455332 countsByYear W20654553322017 @default.
• W2065455332 countsByYear W20654553322018 @default.
• W2065455332 countsByYear W20654553322019 @default.
• W2065455332 countsByYear W20654553322020 @default.
• W2065455332 countsByYear W20654553322021 @default.
• W2065455332 countsByYear W20654553322022 @default.
• W2065455332 countsByYear W20654553322023 @default.
• W2065455332 crossrefType "journal-article" @default.
• W2065455332 hasAuthorship W2065455332A5019219285 @default.
• W2065455332 hasAuthorship W2065455332A5042623076 @default.
• W2065455332 hasAuthorship W2065455332A5048924452 @default.
• W2065455332 hasAuthorship W2065455332A5066805209 @default.
• W2065455332 hasAuthorship W2065455332A5087273177 @default.
• W2065455332 hasConcept C118792377 @default.
• W2065455332 hasConcept C145148216 @default.
• W2065455332 hasConcept C147597530 @default.
• W2065455332 hasConcept C147789679 @default.
• W2065455332 hasConcept C149635348 @default.
• W2065455332 hasConcept C159467904 @default.
• W2065455332 hasConcept C159985019 @default.
• W2065455332 hasConcept C161790260 @default.
• W2065455332 hasConcept C164866538 @default.
• W2065455332 hasConcept C171706072 @default.
• W2065455332 hasConcept C175156509 @default.
• W2065455332 hasConcept C178790620 @default.
• W2065455332 hasConcept C185592680 @default.
• W2065455332 hasConcept C192562407 @default.
• W2065455332 hasConcept C199360897 @default.
• W2065455332 hasConcept C33559828 @default.
• W2065455332 hasConcept C41008148 @default.
• W2065455332 hasConcept C43369102 @default.
• W2065455332 hasConcept C43411465 @default.
• W2065455332 hasConcept C45083100 @default.
• W2065455332 hasConcept C55493867 @default.
• W2065455332 hasConcept C58312451 @default.
• W2065455332 hasConcept C8010536 @default.
• W2065455332 hasConcept C86025842 @default.
• W2065455332 hasConceptScore W2065455332C118792377 @default.
• W2065455332 hasConceptScore W2065455332C145148216 @default.
• W2065455332 hasConceptScore W2065455332C147597530 @default.
• W2065455332 hasConceptScore W2065455332C147789679 @default.
• W2065455332 hasConceptScore W2065455332C149635348 @default.
• W2065455332 hasConceptScore W2065455332C159467904 @default.
• W2065455332 hasConceptScore W2065455332C159985019 @default.
• W2065455332 hasConceptScore W2065455332C161790260 @default.
• W2065455332 hasConceptScore W2065455332C164866538 @default.
• W2065455332 hasConceptScore W2065455332C171706072 @default.
• W2065455332 hasConceptScore W2065455332C175156509 @default.
• W2065455332 hasConceptScore W2065455332C178790620 @default.
• W2065455332 hasConceptScore W2065455332C185592680 @default.
• W2065455332 hasConceptScore W2065455332C192562407 @default.
• W2065455332 hasConceptScore W2065455332C199360897 @default.
• W2065455332 hasConceptScore W2065455332C33559828 @default.
• W2065455332 hasConceptScore W2065455332C41008148 @default.
• W2065455332 hasConceptScore W2065455332C43369102 @default.
• W2065455332 hasConceptScore W2065455332C43411465 @default.
• W2065455332 hasConceptScore W2065455332C45083100 @default.

• next