메뉴 건너뛰기




Volumn 136, Issue 20, 2012, Pages

A density functional study of C 1-C 4 alkyl adsorption on Cu(111)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION ENERGIES; C-H BOND; CU(1 1 1); DENSITY-FUNCTIONAL STUDY; DENSITY-OF-STATES ANALYSIS; HOLLOW SITES; LINEAR FUNCTIONS; SITE PREFERENCES;

EID: 84862587306     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4722102     Document Type: Article
Times cited : (11)

References (65)
  • 1
    • 80053207330 scopus 로고    scopus 로고
    • 10.1063/1.3634073
    • B. Jackson and S. Nave, J. Chem. Phys. 135, 114701 (2011). 10.1063/1.3634073
    • (2011) J. Chem. Phys. , vol.135 , pp. 114701
    • Jackson, B.1    Nave, S.2
  • 6
    • 34547187080 scopus 로고    scopus 로고
    • 10.1063/1.2751155
    • M. Yang, X. Bao, and W. Li, J. Chem. Phys. 127, 024705 (2007). 10.1063/1.2751155
    • (2007) J. Chem. Phys. , vol.127 , pp. 024705
    • Yang, M.1    Bao, X.2    Li, W.3
  • 7
    • 33747770258 scopus 로고    scopus 로고
    • 10.1016/j.susc.2006.07.028
    • D. Cao, Y. Li, J. Wang, and H. Jiao, Surf. Sci. 600, 3226 (2006). 10.1016/j.susc.2006.07.028
    • (2006) Surf. Sci. , vol.600 , pp. 3226
    • Cao, D.1    Li, Y.2    Wang, J.3    Jiao, H.4
  • 9
    • 33746840117 scopus 로고    scopus 로고
    • 10.1016/j.jcat.2006.06.015
    • B. Bunnik and G. Kramer, J. Catal. 242, 309 (2006). 10.1016/j.jcat.2006. 06.015
    • (2006) J. Catal. , vol.242 , pp. 309
    • Bunnik, B.1    Kramer, G.2
  • 16
  • 19
    • 0037138549 scopus 로고    scopus 로고
    • 10.1016/S0039-6028(01)01769-1
    • J. Robinson and D. Woodruff, Surf. Sci. 498, 203 (2002). 10.1016/S0039-6028(01)01769-1
    • (2002) Surf. Sci. , vol.498 , pp. 203
    • Robinson, J.1    Woodruff, D.2
  • 23
    • 2442616768 scopus 로고    scopus 로고
    • 10.1016/j.susc.2004.04.014
    • H. Xiao and D. Xie, Surf. Sci. 558, 15 (2004). 10.1016/j.susc.2004.04.014
    • (2004) Surf. Sci. , vol.558 , pp. 15
    • Xiao, H.1    Xie, D.2
  • 27
    • 0001696442 scopus 로고    scopus 로고
    • 10.1016/S0360-0564(08)60629-X
    • N. Sheppard and C. D.L. Cruz, Adv. Catal. 42, 181 (1998). 10.1016/S0360-0564(08)60629-X
    • (1998) Adv. Catal. , vol.42 , pp. 181
    • Sheppard, N.1    Cruz, C.D.L.2
  • 30
    • 0000437646 scopus 로고    scopus 로고
    • 10.1021/jp982527s
    • J. Kua and W. Goodard III, J. Phys. Chem. B 102, 9492 (1998). 10.1021/jp982527s
    • (1998) J. Phys. Chem. B , vol.102 , pp. 9492
    • Kua, J.1    Iii, G.W.2
  • 32
    • 0001722316 scopus 로고
    • 10.1016/0009-2614(92)85536-J
    • J. Lin and B. Bent, Chem. Phys. Lett. 194, 208 (1992). 10.1016/0009-2614(92)85536-J
    • (1992) Chem. Phys. Lett. , vol.194 , pp. 208
    • Lin, J.1    Bent, B.2
  • 34
    • 0348189725 scopus 로고
    • 10.1021/ar00018a003
    • F. Zaera, Acc. Chem. Res. 25, 260 (1992). 10.1021/ar00018a003
    • (1992) Acc. Chem. Res. , vol.25 , pp. 260
    • Zaera, F.1
  • 43
    • 0026221664 scopus 로고
    • 10.1016/0039-6028(91)90021-J
    • H. Yang and J. Whitten, Surf. Sci. 255, 193 (1991). 10.1016/0039-6028(91) 90021-J
    • (1991) Surf. Sci. , vol.255 , pp. 193
    • Yang, H.1    Whitten, J.2
  • 44
    • 0027062187 scopus 로고
    • 10.1016/0039-6028(92)90743-P
    • C. Chao-Ming and B. Bent, Surf. Sci. 279, 79 (1992). 10.1016/0039- 6028(92)90743-P
    • (1992) Surf. Sci. , vol.279 , pp. 79
    • Chao-Ming, C.1    Bent, B.2
  • 46
    • 0032659704 scopus 로고    scopus 로고
    • 10.1016/S0039-6028(99)00700-1
    • A. Michaelides and P. Hu, Surf. Sci. 437, 362 (1999). 10.1016/S0039-6028(99)00700-1
    • (1999) Surf. Sci. , vol.437 , pp. 362
    • Michaelides, A.1    Hu, P.2
  • 48
    • 12844286241 scopus 로고
    • 10.1103/PhysRevB.47.558
    • G. Kresse and J. Hafner, Phys. Rev. B 47, 558 (1993). 10.1103/PhysRevB.47.558
    • (1993) Phys. Rev. B , vol.47 , pp. 558
    • Kresse, G.1    Hafner, J.2
  • 49
    • 25744460922 scopus 로고
    • 10.1103/PhysRevB.50.17953
    • P. E. Blöchl, Phys. Rev. B 50, 17953 (1994). 10.1103/PhysRevB.50. 17953
    • (1994) Phys. Rev. B , vol.50 , pp. 17953
    • Blöchl, P.E.1
  • 54
    • 84862579834 scopus 로고    scopus 로고
    • See supplementary material at E-JCPSA6-136-039221 for tables of geometric parameters, a discussion of coverage effects across different sites, and further DOS plots.
    • See supplementary material at http://dx.doi.org/10.1063/1.4722102 E-JCPSA6-136-039221 for tables of geometric parameters, a discussion of coverage effects across different sites, and further DOS plots.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.