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Volumn 92, Issue 8, 2008, Pages

Adsorption and dissociation of hydrogen molecules on a Pt atom on defective carbon nanotubes

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; ATOMS; CARBON NANOTUBES; DENSITY FUNCTIONAL THEORY; DISSOCIATION; HYDROGEN; MOLECULAR STRUCTURE;

EID: 40049109070     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2838732     Document Type: Article
Times cited : (20)

References (16)
  • 1
    • 32144457196 scopus 로고    scopus 로고
    • SMALBC 1613-6810 10.1002/smll.200500324.
    • G. G. Wildgoose, C. E. Banks, and R. G. Compton, Small SMALBC 1613-6810 10.1002/smll.200500324 2, 182 (2006).
    • (2006) Small , vol.2 , pp. 182
    • Wildgoose, G.G.1    Banks, C.E.2    Compton, R.G.3
  • 4
    • 34548410611 scopus 로고    scopus 로고
    • NANOFJ 1793-2920 10.1142/S1793292006000136.
    • K. H. An and Y. H. Lee, NANO NANOFJ 1793-2920 10.1142/S1793292006000136 1, 115 (2006).
    • (2006) NANO , vol.1 , pp. 115
    • An, K.H.1    Lee, Y.H.2
  • 6
    • 0000875141 scopus 로고
    • CHPLBC 0009-2614 10.1016/0009-2614(86)80661-3.
    • A. J. Stone and D. J. Wales, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(86)80661-3 128, 501 (1986).
    • (1986) Chem. Phys. Lett. , vol.128 , pp. 501
    • Stone, A.J.1    Wales, D.J.2
  • 7
    • 10644250257 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.136.B864.
    • P. Hohenberg and W. Kohn, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.136.B864 136, B864 (1964).
    • (1964) Phys. Rev. , vol.136 , pp. 864
    • Hohenberg, P.1    Kohn, W.2
  • 8
    • 0042113153 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.140.A1133.
    • W. Kohn and L. J. Sham, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.140. A1133 140, A1133 (1965).
    • (1965) Phys. Rev. , vol.140 , pp. 1133
    • Kohn, W.1    Sham, L.J.2
  • 9
    • 18144378706 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.33.8800.
    • J. P. Perdew and W. Yue, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.33.8800 33, 8800 (1986).
    • (1986) Phys. Rev. B , vol.33 , pp. 8800
    • Perdew, J.P.1    Yue, W.2
  • 10
    • 33645898818 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.45.13244.
    • J. P. Perdew and W. Yue, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.45.13244 45, 13244 (1992).
    • (1992) Phys. Rev. B , vol.45 , pp. 13244
    • Perdew, J.P.1    Yue, W.2
  • 11
    • 40049086502 scopus 로고    scopus 로고
    • MATERIALS STUDIO (version 4.1) of Accelrys Inc.
    • MATERIALS STUDIO (version 4.1) of Accelrys Inc.
  • 12
    • 33744691386 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.45.566, ();, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.23.5048 23, 5048 (1981).
    • D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.45.566 45, 566 (1980); J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.23.5048 23, 5048 (1981).
    • (1980) Phys. Rev. Lett. , vol.45 , pp. 566
    • Ceperley, D.M.1    Alder, B.J.2    Perdew, J.P.3    Zunger, A.4
  • 13
    • 0001161603 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.48.1425.
    • L. Kleinman and D. M. Bylander, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.48.1425 48, 1425 (1982).
    • (1982) Phys. Rev. Lett. , vol.48 , pp. 1425
    • Kleinman, L.1    Bylander, D.M.2
  • 14
    • 1842816907 scopus 로고
    • PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188.
    • H. J. Monkhorst and J. D. Pack, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188 13, 5188 (1976).
    • (1976) Phys. Rev. B , vol.13 , pp. 5188
    • Monkhorst, H.J.1    Pack, J.D.2
  • 15
    • 40049092096 scopus 로고    scopus 로고
    • DFT OPENMX code is available on the web site http://www.openmx-square. org/
    • DFT OPENMX code is available on the web site http://www.openmx-square. org/
  • 16
    • 33644957439 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.73.125410.
    • G. Chen and Y. Kawazoe, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.73.125410 73, 125410 (2006).
    • (2006) Phys. Rev. B , vol.73 , pp. 125410
    • Chen, G.1    Kawazoe, Y.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.