메뉴 건너뛰기




Volumn 154, Issue 3, 2007, Pages

Theoretical analysis of the nature of hydrogen at the electrochemical interface between water and a Ni(111) single-crystal electrode

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; ELECTROCHEMICAL CORROSION; ELECTROCHEMICAL ELECTRODES; EXTRAPOLATION; INTERFACES (MATERIALS); SINGLE CRYSTALS; WATER;

EID: 33846973696     PISSN: 00134651     EISSN: None     Source Type: Journal    
DOI: 10.1149/1.2431326     Document Type: Article
Times cited : (44)

References (58)
  • 6
    • 0030734326 scopus 로고    scopus 로고
    • 0039-6028 10.1016/S0039-6028(96)00968-5
    • H. Yang and J. L. Whitten, Surf. Sci. 0039-6028 10.1016/S0039-6028(96) 00968-5, 370, 136 (1997); H. Yang and J. L. Whitten, J. Chem. Phys. 0021-9606 10.1063/1.455624, 89, 5329 (1988); S. E. Wonchoba and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.53.11222, 53, 11222 (1996); S. E. Wonchoba, W.-P. Hu, and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.51.9985, 51, 9985 (1995); Z.-X. Wang, X.-M. Zhang, and S.-Q. Yu, Chin. J. Chem., 22, 811 (2004).
    • (1997) Surf. Sci. , vol.370 , pp. 136
    • Yang, H.1    Whitten, J.L.2
  • 7
    • 36549092742 scopus 로고
    • 0021-9606 10.1063/1.455624
    • H. Yang and J. L. Whitten, Surf. Sci. 0039-6028 10.1016/S0039-6028(96) 00968-5, 370, 136 (1997); H. Yang and J. L. Whitten, J. Chem. Phys. 0021-9606 10.1063/1.455624, 89, 5329 (1988); S. E. Wonchoba and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.53.11222, 53, 11222 (1996); S. E. Wonchoba, W.-P. Hu, and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.51.9985, 51, 9985 (1995); Z.-X. Wang, X.-M. Zhang, and S.-Q. Yu, Chin. J. Chem., 22, 811 (2004).
    • (1988) J. Chem. Phys. , vol.89 , pp. 5329
    • Yang, H.1    Whitten, J.L.2
  • 8
    • 0001109707 scopus 로고    scopus 로고
    • 0163-1829 10.1103/PhysRevB.53.11222
    • H. Yang and J. L. Whitten, Surf. Sci. 0039-6028 10.1016/S0039-6028(96) 00968-5, 370, 136 (1997); H. Yang and J. L. Whitten, J. Chem. Phys. 0021-9606 10.1063/1.455624, 89, 5329 (1988); S. E. Wonchoba and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.53.11222, 53, 11222 (1996); S. E. Wonchoba, W.-P. Hu, and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.51.9985, 51, 9985 (1995); Z.-X. Wang, X.-M. Zhang, and S.-Q. Yu, Chin. J. Chem., 22, 811 (2004).
    • (1996) Phys. Rev. B , vol.53 , pp. 11222
    • Wonchoba, S.E.1    Truhlar, D.G.2
  • 9
    • 33846960024 scopus 로고
    • 0163-1829 10.1103/PhysRevB.51.9985
    • H. Yang and J. L. Whitten, Surf. Sci. 0039-6028 10.1016/S0039-6028(96) 00968-5, 370, 136 (1997); H. Yang and J. L. Whitten, J. Chem. Phys. 0021-9606 10.1063/1.455624, 89, 5329 (1988); S. E. Wonchoba and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.53.11222, 53, 11222 (1996); S. E. Wonchoba, W.-P. Hu, and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.51.9985, 51, 9985 (1995); Z.-X. Wang, X.-M. Zhang, and S.-Q. Yu, Chin. J. Chem., 22, 811 (2004).
    • (1995) Phys. Rev. B , vol.51 , pp. 9985
    • Wonchoba, S.E.1    Hu, W.-P.2    Truhlar, D.G.3
  • 10
    • 5044241804 scopus 로고    scopus 로고
    • H. Yang and J. L. Whitten, Surf. Sci. 0039-6028 10.1016/S0039-6028(96) 00968-5, 370, 136 (1997); H. Yang and J. L. Whitten, J. Chem. Phys. 0021-9606 10.1063/1.455624, 89, 5329 (1988); S. E. Wonchoba and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.53.11222, 53, 11222 (1996); S. E. Wonchoba, W.-P. Hu, and D. G. Truhlar, Phys. Rev. B 0163-1829 10.1103/PhysRevB.51.9985, 51, 9985 (1995); Z.-X. Wang, X.-M. Zhang, and S.-Q. Yu, Chin. J. Chem., 22, 811 (2004).
    • (2004) Chin. J. Chem. , vol.22 , pp. 811
    • Wang, Z.-X.1    Zhang, X.-M.2    Yu, S.-Q.3
  • 14
    • 36749119322 scopus 로고
    • 0021-9606 10.1063/1.1680935
    • K. Christmann, O. Schober, and G. Ertl, J. Chem. Phys. 0021-9606 10.1063/1.1680935, 60, 4528 (1974); H. Yanagita, J. Sakai, and T. Aruga, Phys. Rev. B, 56, 14952 (1997).
    • (1974) J. Chem. Phys. , vol.60 , pp. 4528
    • Christmann, K.1    Schober, O.2    Ertl, G.3
  • 15
    • 0001188988 scopus 로고    scopus 로고
    • K. Christmann, O. Schober, and G. Ertl, J. Chem. Phys. 0021-9606 10.1063/1.1680935, 60, 4528 (1974); H. Yanagita, J. Sakai, and T. Aruga, Phys. Rev. B, 56, 14952 (1997).
    • (1997) Phys. Rev. B , vol.56 , pp. 14952
    • Yanagita, H.1    Sakai, J.2    Aruga, T.3
  • 19
    • 4244024430 scopus 로고
    • 0031-9007 10.1103/PhysRevLett.50.1285
    • M. S. Daw and M. I. Baskes, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.50.1285, 50, 1285 (1983); J. E. Angelo, N. R. Moody, and M. I. Baskes, Modell. Simul. Mater. Sci. Eng. 0965-0393 10.1088/0965-0393/3/3/001, 3, 289 (1995); M. Wen, X.-J. Xu, and Y. Omura, Comput. Mater. Sci., 30, 202 (2004).
    • (1983) Phys. Rev. Lett. , vol.50 , pp. 1285
    • Daw, M.S.1    Baskes, M.I.2
  • 20
    • 0029309375 scopus 로고
    • 0965-0393 10.1088/0965-0393/3/3/001
    • M. S. Daw and M. I. Baskes, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.50.1285, 50, 1285 (1983); J. E. Angelo, N. R. Moody, and M. I. Baskes, Modell. Simul. Mater. Sci. Eng. 0965-0393 10.1088/0965-0393/3/3/001, 3, 289 (1995); M. Wen, X.-J. Xu, and Y. Omura, Comput. Mater. Sci., 30, 202 (2004).
    • (1995) Modell. Simul. Mater. Sci. Eng. , vol.3 , pp. 289
    • Angelo, J.E.1    Moody, N.R.2    Baskes, M.I.3
  • 21
    • 3142752082 scopus 로고    scopus 로고
    • M. S. Daw and M. I. Baskes, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.50.1285, 50, 1285 (1983); J. E. Angelo, N. R. Moody, and M. I. Baskes, Modell. Simul. Mater. Sci. Eng. 0965-0393 10.1088/0965-0393/3/3/001, 3, 289 (1995); M. Wen, X.-J. Xu, and Y. Omura, Comput. Mater. Sci., 30, 202 (2004).
    • (2004) Comput. Mater. Sci. , vol.30 , pp. 202
    • Wen, M.1    Xu, X.-J.2    Omura, Y.3
  • 22
    • 0001198525 scopus 로고
    • 0031-9007 10.1103/PhysRevLett.73.3010
    • A. Peremans and A. Tadjeddine, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.73.3010, 73, 3010 (1994); N. Nanbu, F. Kitamura, and T. Ohsaka, J. Electroanal. Chem., 485, 128 (2000).
    • (1994) Phys. Rev. Lett. , vol.73 , pp. 3010
    • Peremans, A.1    Tadjeddine, A.2
  • 23
    • 0033746792 scopus 로고    scopus 로고
    • A. Peremans and A. Tadjeddine, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.73.3010, 73, 3010 (1994); N. Nanbu, F. Kitamura, and T. Ohsaka, J. Electroanal. Chem., 485, 128 (2000).
    • (2000) J. Electroanal. Chem. , vol.485 , pp. 128
    • Nanbu, N.1    Kitamura, F.2    Ohsaka, T.3
  • 28
    • 2442537377 scopus 로고    scopus 로고
    • 0163-1829 10.1103/PhysRevB.54.11169
    • G. Kresse and J. Furthmuller, Phys. Rev. B 0163-1829 10.1103/PhysRevB.54. 11169, 54, 11169 (1996); G. Kresse and J. Furthmuller, Comput. Mater. Sci. 0927-0256 10.1016/0927-0256(96)00008-0, 6, 15 (1996); G. Kresse and J. Hafner, Phys. Rev. B, 47, 558 (1993).
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmuller, J.2
  • 29
    • 0030190741 scopus 로고    scopus 로고
    • 0927-0256 10.1016/0927-0256(96)00008-0
    • G. Kresse and J. Furthmuller, Phys. Rev. B 0163-1829 10.1103/PhysRevB.54. 11169, 54, 11169 (1996); G. Kresse and J. Furthmuller, Comput. Mater. Sci. 0927-0256 10.1016/0927-0256(96)00008-0, 6, 15 (1996); G. Kresse and J. Hafner, Phys. Rev. B, 47, 558 (1993).
    • (1996) Comput. Mater. Sci. , vol.6 , pp. 15
    • Kresse, G.1    Furthmuller, J.2
  • 30
    • 12844286241 scopus 로고
    • G. Kresse and J. Furthmuller, Phys. Rev. B 0163-1829 10.1103/PhysRevB.54. 11169, 54, 11169 (1996); G. Kresse and J. Furthmuller, Comput. Mater. Sci. 0927-0256 10.1016/0927-0256(96)00008-0, 6, 15 (1996); G. Kresse and J. Hafner, Phys. Rev. B, 47, 558 (1993).
    • (1993) Phys. Rev. B , vol.47 , pp. 558
    • Kresse, G.1    Hafner, J.2
  • 34
    • 4243943295 scopus 로고    scopus 로고
    • 0031-9007 10.1103/PhysRevLett.77.3865
    • J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.77.3865, 77, 3865 (1996); J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett., 80, 891 (1998).
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 35
    • 85026334466 scopus 로고    scopus 로고
    • J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.77.3865, 77, 3865 (1996); J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett., 80, 891 (1998).
    • (1998) Phys. Rev. Lett. , vol.80 , pp. 891
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 40
    • 0003213698 scopus 로고
    • 0002-7863 10.1021/ja01078a005
    • J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a005, 86, 5394 (1964); J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a004, 86, 5390 (1964); C. M. Criss and J. W. Cobble, J. Am. Chem. Soc., 86, 5385 (1964).
    • (1964) J. Am. Chem. Soc. , vol.86 , pp. 5394
    • Cobble, J.W.1
  • 41
    • 0000620657 scopus 로고
    • 0002-7863 10.1021/ja01078a004
    • J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a005, 86, 5394 (1964); J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a004, 86, 5390 (1964); C. M. Criss and J. W. Cobble, J. Am. Chem. Soc., 86, 5385 (1964).
    • (1964) J. Am. Chem. Soc. , vol.86 , pp. 5390
    • Cobble, J.W.1
  • 42
    • 33947482929 scopus 로고
    • J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a005, 86, 5394 (1964); J. W. Cobble, J. Am. Chem. Soc. 0002-7863 10.1021/ja01078a004, 86, 5390 (1964); C. M. Criss and J. W. Cobble, J. Am. Chem. Soc., 86, 5385 (1964).
    • (1964) J. Am. Chem. Soc. , vol.86 , pp. 5385
    • Criss, C.M.1    Cobble, J.W.2
  • 43
  • 51
    • 0034319390 scopus 로고    scopus 로고
    • 0021-9606 10.1063/1.1313793
    • J. A. Mejias and S. Lago, J. Chem. Phys. 0021-9606 10.1063/1.1313793, 113, 7306 (2000); M. D. Tissandier, K. A. Cowen, and W. Y. Feng, J. Phys. Chem. A 1089-5639 10.1021/jp982638r, 102, 7787 (1998); G. Hummer, L. R. Pratt, and A. E. Garcia, J. Phys. Chem. 0022-3654 10.1021/jp951011v, 100, 1206 (1996); T. F. Magnera, D. E. David, and J. Michl, Chem. Phys. Lett., 182, 363 (1991).
    • (2000) J. Chem. Phys. , vol.113 , pp. 7306
    • Mejias, J.A.1    Lago, S.2
  • 52
    • 0000301294 scopus 로고    scopus 로고
    • 1089-5639 10.1021/jp982638r
    • J. A. Mejias and S. Lago, J. Chem. Phys. 0021-9606 10.1063/1.1313793, 113, 7306 (2000); M. D. Tissandier, K. A. Cowen, and W. Y. Feng, J. Phys. Chem. A 1089-5639 10.1021/jp982638r, 102, 7787 (1998); G. Hummer, L. R. Pratt, and A. E. Garcia, J. Phys. Chem. 0022-3654 10.1021/jp951011v, 100, 1206 (1996); T. F. Magnera, D. E. David, and J. Michl, Chem. Phys. Lett., 182, 363 (1991).
    • (1998) J. Phys. Chem. A , vol.102 , pp. 7787
    • Tissandier, M.D.1    Cowen, K.A.2    Feng, W.Y.3
  • 53
    • 33751143432 scopus 로고    scopus 로고
    • 0022-3654 10.1021/jp951011v
    • J. A. Mejias and S. Lago, J. Chem. Phys. 0021-9606 10.1063/1.1313793, 113, 7306 (2000); M. D. Tissandier, K. A. Cowen, and W. Y. Feng, J. Phys. Chem. A 1089-5639 10.1021/jp982638r, 102, 7787 (1998); G. Hummer, L. R. Pratt, and A. E. Garcia, J. Phys. Chem. 0022-3654 10.1021/jp951011v, 100, 1206 (1996); T. F. Magnera, D. E. David, and J. Michl, Chem. Phys. Lett., 182, 363 (1991).
    • (1996) J. Phys. Chem. , vol.100 , pp. 1206
    • Hummer, G.1    Pratt, L.R.2    Garcia, A.E.3
  • 54
    • 4243240501 scopus 로고
    • J. A. Mejias and S. Lago, J. Chem. Phys. 0021-9606 10.1063/1.1313793, 113, 7306 (2000); M. D. Tissandier, K. A. Cowen, and W. Y. Feng, J. Phys. Chem. A 1089-5639 10.1021/jp982638r, 102, 7787 (1998); G. Hummer, L. R. Pratt, and A. E. Garcia, J. Phys. Chem. 0022-3654 10.1021/jp951011v, 100, 1206 (1996); T. F. Magnera, D. E. David, and J. Michl, Chem. Phys. Lett., 182, 363 (1991).
    • (1991) Chem. Phys. Lett. , vol.182 , pp. 363
    • Magnera, T.F.1    David, D.E.2    Michl, J.3
  • 56
    • 3643084753 scopus 로고
    • J. O'M. Bockris, A. K. N. Reddy, and M. Gamboa-Aldeco, Modern Electrochemistry, Kluwer Academic/Plenum, New York (2000); H. Reiss and A. Heller, J. Phys. Chem., 89, 4207 (1985).
    • (1985) J. Phys. Chem. , vol.89 , pp. 4207
    • Reiss, H.1    Heller, A.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.