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Volumn 118, Issue 35, 2014, Pages 20346-20356

Mechanistic insight into the styrene-selective oxidation on subnanometer gold clusters (Au16-Au20, Au27, Au28, Au30, and Au32-Au35): A density functional theory study

Author keywords

[No Author keywords available]

Indexed keywords

ADDITIVES; BINARY ALLOYS; CATALYST ACTIVITY; CATALYTIC OXIDATION; GOLD; GOLD ALLOYS; OXIDATION; REACTION INTERMEDIATES; REACTION RATES; STYRENE;

EID: 84914109466     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp505018g     Document Type: Article
Times cited : (20)

References (47)
  • 1
    • 0001547046 scopus 로고
    • Novel Gold Catalysts for the Oxidation of Carbon Monoxide at a Temperature far below 0 °c
    • Haruta, M.; Kobayashi, T.; Samo, H.; Yamada, N. Novel Gold Catalysts for the Oxidation of Carbon Monoxide at a Temperature far Below 0 °C Chem. Lett. 1987, 2, 405-408
    • (1987) Chem. Lett. , vol.2 , pp. 405-408
    • Haruta, M.1    Kobayashi, T.2    Samo, H.3    Yamada, N.4
  • 2
    • 0009746572 scopus 로고
    • Gold Catalysts Prepared by Coprecipitation for Low-Temperature Oxidation of Hydrogen and of Carbon Monoxide
    • Haruta, M.; Yamada, N.; Kobayashi, T.; Iijima, S. Gold Catalysts Prepared by Coprecipitation for Low-Temperature Oxidation of Hydrogen and of Carbon Monoxide J. Catal. 1989, 115, 301-309
    • (1989) J. Catal. , vol.115 , pp. 301-309
    • Haruta, M.1    Yamada, N.2    Kobayashi, T.3    Iijima, S.4
  • 3
    • 0033533966 scopus 로고    scopus 로고
    • Promotion by Sulfur of Gold Catalysts for Crotyl Alcohol Formation from Crotonaldehyde Hydrogenation
    • Bailie, J. E.; Hutchings, G. J. Promotion by Sulfur of Gold Catalysts for Crotyl Alcohol Formation from Crotonaldehyde Hydrogenation Chem. Commun. 1999, 2152-2152
    • (1999) Chem. Commun. , pp. 2152-2152
    • Bailie, J.E.1    Hutchings, G.J.2
  • 6
    • 0042242562 scopus 로고    scopus 로고
    • Active Nonmetallic Au and Pt Species on Ceria-Based Water-Gas Shift Catalysts
    • Fu, Q.; Saltsburg, H.; Flytzani-Stephanopoulos, M. Active Nonmetallic Au and Pt Species on Ceria-Based Water-Gas Shift Catalysts Science 2003, 301, 935-939
    • (2003) Science , vol.301 , pp. 935-939
    • Fu, Q.1    Saltsburg, H.2    Flytzani-Stephanopoulos, M.3
  • 7
    • 0000458041 scopus 로고    scopus 로고
    • Size- and Support-Dependency in the Catalysis of Gold
    • Haruta, M. Size- and Support-Dependency in the Catalysis of Gold Catal. Today 1997, 36, 153-166
    • (1997) Catal. Today , vol.36 , pp. 153-166
    • Haruta, M.1
  • 8
    • 34447107438 scopus 로고    scopus 로고
    • Heterogeneous Gold-Based Catalysis for Green Chemistry: Low-Temperature CO Oxidation and Propene Oxidation
    • Min, B. K.; Friend, C. M. Heterogeneous Gold-Based Catalysis for Green Chemistry: Low-Temperature CO Oxidation and Propene Oxidation Chem. Rev. 2007, 107, 2709-2724
    • (2007) Chem. Rev. , vol.107 , pp. 2709-2724
    • Min, B.K.1    Friend, C.M.2
  • 9
    • 33750623149 scopus 로고    scopus 로고
    • Catalytically Active Gold: From Nanoparticles to Ultrathin Films
    • Chen, M.; Goodman, D. W. Catalytically Active Gold: From Nanoparticles to Ultrathin Films Acc. Chem. Res. 2006, 39, 739-746
    • (2006) Acc. Chem. Res. , vol.39 , pp. 739-746
    • Chen, M.1    Goodman, D.W.2
  • 10
    • 84859702410 scopus 로고    scopus 로고
    • Nano-Gold Catalysis in Fine Chemical Synthesis
    • Zhang, Y.; Cui, X.; Shi, F.; Deng, Y. Nano-Gold Catalysis in Fine Chemical Synthesis Chem. Rev. 2012, 112, 2467-2505
    • (2012) Chem. Rev. , vol.112 , pp. 2467-2505
    • Zhang, Y.1    Cui, X.2    Shi, F.3    Deng, Y.4
  • 12
    • 0742321804 scopus 로고    scopus 로고
    • Gold Nanoparticles: Assembly, Supramolecular Chemistry, Quantum-Size-Related Properties, and Applications toward Biology, Catalysis, and Nanotechnology
    • Daniel, M. C.; Astruc, D. Gold Nanoparticles: Assembly, Supramolecular Chemistry, Quantum-Size-Related Properties, and Applications toward Biology, Catalysis, and Nanotechnology Chem. Rev. 2004, 104, 293-346
    • (2004) Chem. Rev. , vol.104 , pp. 293-346
    • Daniel, M.C.1    Astruc, D.2
  • 13
    • 4544365854 scopus 로고    scopus 로고
    • Theoretical Chemistry of Gold
    • Pyykkö, P. Theoretical Chemistry of Gold Angew. Chem., Int. Ed. 2004, 43, 4412-4456
    • (2004) Angew. Chem., Int. Ed. , vol.43 , pp. 4412-4456
    • Pyykkö, P.1
  • 16
    • 3042801240 scopus 로고    scopus 로고
    • Catalysis by Gold Nanoparticles: Epoxidation of Propene
    • Sinha, A. K.; Seelan, S.; Tsubota, S.; Haruta, M. Catalysis by Gold Nanoparticles: Epoxidation of Propene Top. Catal. 2004, 29, 95-102
    • (2004) Top. Catal. , vol.29 , pp. 95-102
    • Sinha, A.K.1    Seelan, S.2    Tsubota, S.3    Haruta, M.4
  • 17
    • 70349326315 scopus 로고    scopus 로고
    • Sustainable Green Catalysis by Supported Metal Nanoparticles
    • Fukuoka, A.; Dhepe, P. L. Sustainable Green Catalysis by Supported Metal Nanoparticles Chem. Rec. 2009, 9, 224-228
    • (2009) Chem. Rec. , vol.9 , pp. 224-228
    • Fukuoka, A.1    Dhepe, P.L.2
  • 22
    • 5544290671 scopus 로고    scopus 로고
    • Styrene Epoxidation over Gold Supported on Different Transition Metal Oxides Prepared by Homogeneous Deposition-Precipitation
    • Patil, N. S.; Uphade, B. S.; McCulloh, D. G.; Bhargava, S. K.; Choudhary, V. R. Styrene Epoxidation over Gold Supported on Different Transition Metal Oxides Prepared by Homogeneous Deposition-Precipitation Catal. Commun. 2004, 5, 681-685
    • (2004) Catal. Commun. , vol.5 , pp. 681-685
    • Patil, N.S.1    Uphade, B.S.2    McCulloh, D.G.3    Bhargava, S.K.4    Choudhary, V.R.5
  • 23
    • 0347723661 scopus 로고    scopus 로고
    • 2 Catalysts in the Presence of Oxygen and Hydrogen
    • 2 Catalysts in the Presence of Oxygen and Hydrogen J. Catal. 1998, 178, 566-575
    • (1998) J. Catal. , vol.178 , pp. 566-575
    • Hayashi, T.1    Tanaka, K.2    Haruta, M.3
  • 25
  • 32
    • 77952047926 scopus 로고    scopus 로고
    • Probing the Structural Evolution of Medium-Sized Gold Clusters: Au(n)(-) (n = 27-35)
    • Shao, N.; Huang, W.; Gao, Y.; Wang, L. M.; Li, X.; Wang, L. S.; Zeng, X. C. Probing the Structural Evolution of Medium-Sized Gold Clusters: Au(n)(-) (n = 27-35) J. Am. Chem. Soc. 2010, 132, 6596-6605
    • (2010) J. Am. Chem. Soc. , vol.132 , pp. 6596-6605
    • Shao, N.1    Huang, W.2    Gao, Y.3    Wang, L.M.4    Li, X.5    Wang, L.S.6    Zeng, X.C.7
  • 36
    • 4243943295 scopus 로고    scopus 로고
    • Generalized Gradient Approximation Made Simple
    • Perdew, J. P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple Phys. Rev. Lett. 1996, 77, 3865-3868
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 37
    • 34447260582 scopus 로고
    • An All-Electron Numerical Method for Solving the Local Density Functional for Polyatomic Molecules
    • Delley, B. An All-Electron Numerical Method for Solving the Local Density Functional for Polyatomic Molecules J. Chem. Phys. 1990, 92, 508-517
    • (1990) J. Chem. Phys. , vol.92 , pp. 508-517
    • Delley, B.1
  • 38
    • 0034319689 scopus 로고    scopus 로고
    • 3 Approach
    • 3 Approach J. Chem. Phys. 2000, 113, 7756-7764
    • (2000) J. Chem. Phys. , vol.113 , pp. 7756-7764
    • Delley, B.1
  • 40
    • 0034548053 scopus 로고    scopus 로고
    • Low-Temperature Activation of Molecular Oxygen by Gold Clusters: A Stoichiometric Process Correlated to Electron Affinity
    • Salisbury, B. E.; Wallace, W. T.; Whetten, R. L. Low-Temperature Activation of Molecular Oxygen by Gold Clusters: a Stoichiometric Process Correlated to Electron Affinity Chem. Phys. 2000, 262, 131-141
    • (2000) Chem. Phys. , vol.262 , pp. 131-141
    • Salisbury, B.E.1    Wallace, W.T.2    Whetten, R.L.3
  • 41
    • 84861895045 scopus 로고    scopus 로고
    • 2 Activation by Size-Selected Gold Clusters: Transition from Superoxo to Peroxo Chemisorption
    • 2 Activation by Size-Selected Gold Clusters: Transition from Superoxo to Peroxo Chemisorption J. Am. Chem. Soc. 2012, 134, 9438-9445
    • (2012) J. Am. Chem. Soc. , vol.134 , pp. 9438-9445
    • Pal, R.1    Wang, L.2    Pei, Y.3    Wang, L.S.4    Zeng, X.C.5
  • 42
    • 33746352086 scopus 로고    scopus 로고
    • On the Performance of Au(111) for Ethylene Epoxidation: A Density Functional Study
    • Torres, D.; Illas, F. On the Performance of Au(111) for Ethylene Epoxidation: A Density Functional Study J. Phys. Chem. B 2006, 110, 13310-13313
    • (2006) J. Phys. Chem. B , vol.110 , pp. 13310-13313
    • Torres, D.1    Illas, F.2
  • 43
    • 59849095114 scopus 로고    scopus 로고
    • Selective Oxidation of Styrene on an Oxygen-Adsorbed Au(111): A Density Functional Theory Study
    • Xue, L.-Q.; Pang, X.-Y.; Wang, G.-C. Selective Oxidation of Styrene on an Oxygen-Adsorbed Au(111): A Density Functional Theory Study J. Comput. Chem. 2008, 30, 438-446
    • (2008) J. Comput. Chem. , vol.30 , pp. 438-446
    • Xue, L.-Q.1    Pang, X.-Y.2    Wang, G.-C.3
  • 44
    • 29144533289 scopus 로고    scopus 로고
    • Selective Oxidation of Styrene on an Oxygen-Covered Au(111)
    • Deng, X.; Friend, C. M. Selective Oxidation of Styrene on an Oxygen-Covered Au(111) J. Am. Chem. Soc. 2005, 127, 17178-17179
    • (2005) J. Am. Chem. Soc. , vol.127 , pp. 17178-17179
    • Deng, X.1    Friend, C.M.2
  • 45
    • 84889781734 scopus 로고    scopus 로고
    • 18: Fragmentation Pathway and Catalytic Active site
    • 18: Fragmentation Pathway and Catalytic Active site J. Am. Chem. Soc. 2013, 135, 18067-18079
    • (2013) J. Am. Chem. Soc. , vol.135 , pp. 18067-18079
    • Liu, C.1    Lin, S.2    Pei, Y.3    Zeng, X.C.4


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