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Volumn 67, Issue 3, 2003, Pages

Core-polarization potentials for Si and Ti

Author keywords

[No Author keywords available]

Indexed keywords

SILICON; TITANIUM;

EID: 0037438206     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.67.035121     Document Type: Article
Times cited : (15)

References (33)
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    • R. Maezono, M. D. Towler, Y. Lee, and R. J. Needs (unpublished)
    • R. Maezono, M. D. Towler, Y. Lee, and R. J. Needs (unpublished).
  • 6
    • 85038303932 scopus 로고    scopus 로고
    • D. Alfe, M. J. Gillan, M. D. Towler, and R. J. Needs (unpublished)
    • D. Alfe, M. J. Gillan, M. D. Towler, and R. J. Needs (unpublished).
  • 8
    • 85038322912 scopus 로고    scopus 로고
    • C. Fröse Fischer, T. Brage, and P. Jönsson, (IOP Publishing, Bristol, 1997)
    • C. Fröse Fischer, T. Brage, and P. Jönsson, Computational Atomic Structure, an MCHF Approach (IOP Publishing, Bristol, 1997).
  • 9
    • 85038314009 scopus 로고    scopus 로고
    • We use Hartree atomic units (formula presented) for all equations
    • We use Hartree atomic units (formula presented) for all equations.
  • 15
    • 85038337064 scopus 로고    scopus 로고
    • Y. Lee and R. J. Needs (unpublished)
    • Y. Lee and R. J. Needs (unpublished).
  • 16
    • 85038337395 scopus 로고    scopus 로고
    • G. W. F. Drake, in, edited by F. S. Levin and D. A. Micha (Plenum, New York, 1993)
    • G. W. F. Drake, in Theory and Recent Developments in Atomic Systems, edited by F. S. Levin and D. A. Micha (Plenum, New York, 1993).
  • 17
    • 0000257850 scopus 로고
    • This paper gives the required expressions for the two-electron integrals in the double basis set method, but it contains a significant typographical error: the factor of (formula presented) in Eq. (32) should be replaced by (formula presented)
    • G W F. Drake, Phys. Rev. A18, 820 (1978). This paper gives the required expressions for the two-electron integrals in the double basis set method, but it contains a significant typographical error: the factor of (formula presented) in Eq. (32) should be replaced by (formula presented)
    • (1978) Phys. Rev. A , vol.18 , pp. 820
    • Drake, G.W.F.1
  • 26
    • 85038307916 scopus 로고    scopus 로고
    • R. J. Needs, G. Rajagopal, M. D. Towler, P. R. C. Kent, and A. J. Williamson, computer code, version 1.0, user’s manual (University of Cambridge, Cambridge, England, 2000)
    • R. J. Needs, G. Rajagopal, M. D. Towler, P. R. C. Kent, and A. J. Williamson, computer code CASINO, version 1.0, user’s manual (University of Cambridge, Cambridge, England, 2000).
  • 28
    • 85038267022 scopus 로고    scopus 로고
    • R. J. Needs, A. R. Porter, and M. D. Towler, in, edited by W. A. Lester, Jr., S. M. Rothstein, and S. Tanaka (World Scientific, Singapore, 2002), II, p. 143
    • R. J. Needs, A. R. Porter, and M. D. Towler, in Recent Advances in Quantum Monte Carlo Methods, edited by W. A. Lester, Jr., S. M. Rothstein, and S. Tanaka (World Scientific, Singapore, 2002), Vol. II, p. 143.
  • 33
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    • M. J. Frisch, computer code, 94, user’s manual (Gaussian, Inc., Pittsburgh, PA, 1995)
    • M. J. Frisch et al., computer code GAUSSIAN 94, user’s manual (Gaussian, Inc., Pittsburgh, PA, 1995).


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.