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Volumn 629, Issue , 1996, Pages

Density-Functional Methods in Chemistry: An Overview

Author keywords

[No Author keywords available]

Indexed keywords


EID: 1542789249     PISSN: 00976156     EISSN: None     Source Type: Book Series    
DOI: None     Document Type: Review
Times cited : (30)

References (88)
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    • Also see the erratum, Phys.Rev. B 1986, 34, 7046
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    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 31
    • 1542687100 scopus 로고    scopus 로고
    • DGauss available from Cray Research, Inc., Eagan, MN
    • DGauss available from Cray Research, Inc., Eagan, MN.
  • 32
    • 1542687099 scopus 로고    scopus 로고
    • DMol available from Biosym/Molecular Simularions, Inc., San Diego, CA
    • DMol available from Biosym/Molecular Simularions, Inc., San Diego, CA.
  • 33
    • 1542792413 scopus 로고    scopus 로고
    • DeMon is developed by Salahub, et al. at University of Montreal, Canada
    • DeMon is developed by Salahub, et al. at University of Montreal, Canada.
  • 34
    • 1542582372 scopus 로고    scopus 로고
    • NUMOL is developed by Becke at Queens University, Kingston, Canada
    • NUMOL is developed by Becke at Queens University, Kingston, Canada.
  • 73
    • 0002245425 scopus 로고
    • Henderson, D., Ed.; Marcel Dekker: New York, NY
    • Evans, R. In Fundamentals of Inhomogeneous Fluids; Henderson, D., Ed.; Marcel Dekker: New York, NY, 1992, pp. 85-176.
    • (1992) Fundamentals of Inhomogeneous Fluids , pp. 85-176
    • Evans, R.1
  • 75
    • 0001787412 scopus 로고
    • Henderson, D., Ed.; Marcel Dekker: New York, NY
    • Oxtoby, D.W. In Fundamentals of Inhomogeneous Fluids; Henderson, D., Ed.; Marcel Dekker: New York, NY, 1992, pp. 407-442.
    • (1992) Fundamentals of Inhomogeneous Fluids , pp. 407-442
    • Oxtoby, D.W.1
  • 77
    • 1542792409 scopus 로고
    • Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY
    • Galiatsatos, V. In Computational Methods for Modeling Polymers: An Introduction; Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY, 1995, Vol. 6; PP 149-208.
    • (1995) Computational Methods for Modeling Polymers: An Introduction , vol.6 , pp. 149-208
    • Galiatsatos, V.1
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    • von Ballmoos, R.; Higgins, J.B.; Treacy, M.M.J. Eds.; Proceedings from the Ninth International Zeolite Conference, Butterworth-Heinemann: Stoneham, MA
    • Newsome, J.M. in Zeolite Structural Problems from a Computational Perspective; von Ballmoos, R.; Higgins, J.B.; Treacy, M.M.J. Eds.; Proceedings from the Ninth International Zeolite Conference, Butterworth-Heinemann: Stoneham, MA, 1993, Vol. 1; pp 127-141.
    • (1993) Zeolite Structural Problems from a Computational Perspective , vol.1 , pp. 127-141
    • Newsome, J.M.1
  • 83
    • 0000474420 scopus 로고
    • Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers, Inc.: New York, NY
    • Zerner, M.C. In Semiempirical Molecular Orbital Methods; Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers, Inc.: New York, NY, 1991, Vol. 2; pp 313-366.
    • (1991) Semiempirical Molecular Orbital Methods , vol.2 , pp. 313-366
    • Zerner, M.C.1
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    • Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY
    • Stewart, J.J.P. In Semiempirical Molecular Orbital Methods; Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY, 1989, Vol. 1; pp 45-82.
    • (1989) Semiempirical Molecular Orbital Methods , vol.1 , pp. 45-82
    • Stewart, J.J.P.1
  • 87
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    • A Tutorial; Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY
    • Bartlet, R.J.; Stanton, J.F. In Applications of Post-Hartree-Fock Methods: A Tutorial; Lipkowitz, K.B.; Boyd, D.B., Eds.; Reviews in Computational Chemistry; VCH Publishers: New York, NY, 1995, Vol. 5; pp. 65-170.
    • (1995) Applications of Post-Hartree-Fock Methods , vol.5 , pp. 65-170
    • Bartlet, R.J.1    Stanton, J.F.2
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    • For example the programs DSOLID, ESOCS, and PLANEWAVE from Biosym Technologies, Inc./Molecular Simulations, Inc., San Diego, CA
    • For example the programs DSOLID, ESOCS, and PLANEWAVE from Biosym Technologies, Inc./Molecular Simulations, Inc., San Diego, CA.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.