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Volumn 396, Issue , 2017, Pages 444-454

Computational evaluation of sub-nanometer cluster activity of singly exposed copper atom with various coordinative environment in catalytic CO 2 transformation

Author keywords

Carbon dioxide; Carbon monoxide and DFT; Cluster; Copper

Indexed keywords

BINDING ENERGY; CALCULATIONS; CARBON DIOXIDE; CARBON MONOXIDE; COMPUTATION THEORY; COPPER; DESIGN FOR TESTABILITY; ELECTROLYTIC REDUCTION; FREE ENERGY; MOLECULAR DYNAMICS; MOLECULAR ORBITALS; NANOCATALYSTS;

EID: 85006176725     PISSN: 01694332     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apsusc.2016.10.174     Document Type: Article
Times cited : (4)

References (34)
  • 2
    • 85006605788 scopus 로고    scopus 로고
    • Mod. Aspects Electrochem. 42 (2004) 89–189.
    • [2] Mod. Aspects Electrochem. 42 (2004) 89–189.
  • 11
    • 84939824694 scopus 로고    scopus 로고
    • [11] Pal, J., Pal, T., Nanoscale 7 (2015), 14159–14190.
    • (2015) Nanoscale , vol.7 , pp. 14159-14190
    • Pal, J.1    Pal, T.2
  • 28
    • 85006575626 scopus 로고    scopus 로고
    • J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery Jr., J. E. Peralta, F. Ogliaro, M.J. Bearpark, J. Heyd, E.N. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A.P. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, N.J. Millam, M. Klene, J. E. Knox, J. B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R. L. Martin, K. Morokuma, V. G. Zakrzewski, G. A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, Ö. Farkas, J. B. Foresman, J. V. Ortiz, J. Cioslowski and D. J. Fox, 2009. Gaussian Revision C.01.
    • [28] M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G.A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H.P. Hratchian, A. F. Izmaylov, J. Bloino, G. Zheng, J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery Jr., J. E. Peralta, F. Ogliaro, M.J. Bearpark, J. Heyd, E.N. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A.P. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, N.J. Millam, M. Klene, J. E. Knox, J. B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R. L. Martin, K. Morokuma, V. G. Zakrzewski, G. A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, Ö. Farkas, J. B. Foresman, J. V. Ortiz, J. Cioslowski and D. J. Fox, 2009. Gaussian Revision C.01.
    • Frisch, M.J.1    Trucks, G.W.2    Schlegel, H.B.3    Scuseria, G.E.4    Robb, M.A.5    Cheeseman, J.R.6    Scalmani, G.7    Barone, V.8    Mennucci, B.9    Petersson, G.A.10    Nakatsuji, H.11    Caricato, M.12    Li, X.13    Hratchian, H.P.14    Izmaylov, A.F.15    Bloino, J.16    Zheng, G.17


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.