Literature DB >> 18818819

The nature of the active site in heterogeneous metal catalysis.

Jens K Nørskov1, Thomas Bligaard, Britt Hvolbaek, Frank Abild-Pedersen, Ib Chorkendorff, Claus H Christensen.   

Abstract

This tutorial review, of relevance for the surface science and heterogeneous catalysis communities, provides a molecular-level discussion of the nature of the active sites in metal catalysis. Fundamental concepts such as "Brønsted-Evans-Polanyi relations" and "volcano curves" are introduced, and are used to establish a strict partitioning between the so-called "electronic" and "geometrical" effects. This partitioning is subsequently employed as the basis for defining the concept "degree of structure sensitivity" which can be used when analyzing the structure sensitivity of catalytic reactions.

Entities:  

Year:  2008        PMID: 18818819     DOI: 10.1039/b800260f

Source DB:  PubMed          Journal:  Chem Soc Rev        ISSN: 0306-0012            Impact factor:   54.564


  29 in total

Review 1.  Impact of surface chemistry.

Authors:  Gabor A Somorjai; Yimin Li
Journal:  Proc Natl Acad Sci U S A       Date:  2010-09-29       Impact factor: 11.205

2.  Gas-Phase Fragmentation Pathways of Mixed Addenda Keggin Anions: PMo12-nW nO 40 3- (n = 0-12).

Authors:  K Don D Gunaratne; Venkateshkumar Prabhakaran; Grant E Johnson; Julia Laskin
Journal:  J Am Soc Mass Spectrom       Date:  2015-04-02       Impact factor: 3.109

3.  Discovery of a Ni-Ga catalyst for carbon dioxide reduction to methanol.

Authors:  Felix Studt; Irek Sharafutdinov; Frank Abild-Pedersen; Christian F Elkjær; Jens S Hummelshøj; Søren Dahl; Ib Chorkendorff; Jens K Nørskov
Journal:  Nat Chem       Date:  2014-03-02       Impact factor: 24.427

4.  Introducing structural sensitivity into adsorption-energy scaling relations by means of coordination numbers.

Authors:  Federico Calle-Vallejo; David Loffreda; Marc T M Koper; Philippe Sautet
Journal:  Nat Chem       Date:  2015-04-06       Impact factor: 24.427

5.  Confined catalysis under two-dimensional materials.

Authors:  Haobo Li; Jianping Xiao; Qiang Fu; Xinhe Bao
Journal:  Proc Natl Acad Sci U S A       Date:  2017-05-22       Impact factor: 11.205

6.  Computationally generated maps of surface structures and catalytic activities for alloy phase diagrams.

Authors:  Liang Cao; Le Niu; Tim Mueller
Journal:  Proc Natl Acad Sci U S A       Date:  2019-10-14       Impact factor: 11.205

7.  Revealing the structure of a catalytic combustion active-site ensemble combining uniform nanocrystal catalysts and theory insights.

Authors:  An-Chih Yang; Tej Choksi; Verena Streibel; Hassan Aljama; Cody J Wrasman; Luke T Roling; Emmett D Goodman; Dionne Thomas; Simon R Bare; Roel S Sánchez-Carrera; Ansgar Schäfer; Yuejin Li; Frank Abild-Pedersen; Matteo Cargnello
Journal:  Proc Natl Acad Sci U S A       Date:  2020-06-17       Impact factor: 11.205

8.  A density functional theory study of hydrocarbon combustion and synthesis on Ni surfaces.

Authors:  Abas Mohsenzadeh; Tobias Richards; Kim Bolton
Journal:  J Mol Model       Date:  2015-02-18       Impact factor: 1.810

9.  Nanoscale Spatial Distribution of Supported Nanoparticles Controls Activity and Stability in Powder Catalysts for CO Oxidation and Photocatalytic H2 Evolution.

Authors:  Alexander Holm; Emmett D Goodman; Joakim Halldin Stenlid; Aisulu Aitbekova; Rosadriana Zelaya; Benjamin T Diroll; Aaron C Johnston-Peck; Kun-Che Kao; Curtis W Frank; Lars G M Pettersson; Matteo Cargnello
Journal:  J Am Chem Soc       Date:  2020-08-13       Impact factor: 15.419

10.  The Role of Defects in the Local Reaction Kinetics of CO Oxidation on Low-Index Pd Surfaces.

Authors:  D Vogel; C Spiel; M Schmid; M Stöger-Pollach; R Schlögl; Y Suchorski; G Rupprechter
Journal:  J Phys Chem C Nanomater Interfaces       Date:  2013-05-17       Impact factor: 4.126

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