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Volumn 121, Issue 8, 2004, Pages 3417-3424

Calculation of exchange-correlation potentials with auxiliary function densities

Author keywords

[No Author keywords available]

Indexed keywords

COULOMB POTENTIALS; DENSITY FUNCTIONAL THEORY (DFT); EXCHANGE-CORRELATION POTENTIALS; HERMITE AUXILIARY FUNCTIONS;

EID: 4444272510     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1771638     Document Type: Article
Times cited : (210)

References (36)
  • 19
    • 4444344025 scopus 로고    scopus 로고
    • Habilitation thesis, Universität Hannover
    • A. M. Köster, Habilitation thesis, Universität Hannover, 1998.
    • (1998)
    • Köster, A.M.1
  • 20
    • 4444352015 scopus 로고    scopus 로고
    • private communication
    • S. B. Trickey (private communication).
    • Trickey, S.B.1
  • 21
    • 0005714593 scopus 로고
    • edited by G. H. F. Diercksen and S. Wilson (Reidel, Dordrecht)
    • V. R. Saunders, in Methods in Computational Physics, edited by G. H. F. Diercksen and S. Wilson (Reidel, Dordrecht, 1983).
    • (1983) Methods in Computational Physics
    • Saunders, V.R.1
  • 22
    • 4444277953 scopus 로고    scopus 로고
    • A. M. Köster, R. Flores-Moreno, G. Geudtner, A. Goursot, T. Heine, J. U. Reveles, A. Vela, and D. R. Salahub, deMon, NRC, Canada, 2003
    • A. M. Köster, R. Flores-Moreno, G. Geudtner, A. Goursot, T. Heine, J. U. Reveles, A. Vela, and D. R. Salahub, deMon, NRC, Canada, 2003.
  • 34
    • 0001590145 scopus 로고    scopus 로고
    • A. M. Köster, R. Flores-Moreno, and J. U. Reveles, J. Chem. Phys. 121, 681 (2004); M. Krack and A. M. Köster, ibid. 108, 3226 (1998).
    • (1998) J. Chem. Phys. , vol.108 , pp. 3226
    • Krack, M.1    Köster, A.M.2
  • 36
    • 4444238372 scopus 로고    scopus 로고
    • See EPAPS Document No. JCPSA6-121-311430 for optimized and experimental structure parameters of the test set molecules. A direct link to this document may be found in the online article's HTML reference section. The document may also be reached via the EPAPS homepage (http://www.aip.org/pubservs/epaps.html) or from ftp.aip.org in the directory /epaps/. See the EPAPS homepage for more information
    • See EPAPS Document No. JCPSA6-121-311430 for optimized and experimental structure parameters of the test set molecules. A direct link to this document may be found in the online article's HTML reference section. The document may also be reached via the EPAPS homepage (http://www.aip.org/pubservs/epaps.html) or from ftp.aip.org in the directory /epaps/. See the EPAPS homepage for more information.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.