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Volumn 101, Issue 39, 1997, Pages 7243-7252

Derivation of class II force fields. 4. Van der waals parameters of Alkali metal cations and halide anions

Author keywords

[No Author keywords available]

Indexed keywords

CRYSTAL STRUCTURE; INERT GASES; LATTICE CONSTANTS; SOLUTIONS; VAN DER WAALS FORCES;

EID: 0031236187     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp964080y     Document Type: Article
Times cited : (188)

References (75)
  • 9
    • 0000357781 scopus 로고
    • For earlier basic studies see for example: (a) Warshel, A. J. Phys. Chem. 1979, 83, 1640. (b) Watts, R. O.; McGee, I. J. Liquid State Chemical Physics; Wiley-Interscience: New York, 1976. (c) Finney, J. L. Faraday Trans. Chem. Soc. 1978, 66, 80. (d) Zeiss, G. D.; Meath, W. J.; McDonald J. C. F.; Dawson, D. J. Mol. Phys. 1980, 39, 1055.
    • (1979) J. Phys. Chem. , vol.83 , pp. 1640
    • Warshel, A.1
  • 10
    • 0003669009 scopus 로고
    • Wiley-Interscience: New York
    • For earlier basic studies see for example: (a) Warshel, A. J. Phys. Chem. 1979, 83, 1640. (b) Watts, R. O.; McGee, I. J. Liquid State Chemical Physics; Wiley-Interscience: New York, 1976. (c) Finney, J. L. Faraday Trans. Chem. Soc. 1978, 66, 80. (d) Zeiss, G. D.; Meath, W. J.; McDonald J. C. F.; Dawson, D. J. Mol. Phys. 1980, 39, 1055.
    • (1976) Liquid State Chemical Physics
    • Watts, R.O.1    McGee, I.J.2
  • 11
    • 84913354003 scopus 로고
    • For earlier basic studies see for example: (a) Warshel, A. J. Phys. Chem. 1979, 83, 1640. (b) Watts, R. O.; McGee, I. J. Liquid State Chemical Physics; Wiley-Interscience: New York, 1976. (c) Finney, J. L. Faraday Trans. Chem. Soc. 1978, 66, 80. (d) Zeiss, G. D.; Meath, W. J.; McDonald J. C. F.; Dawson, D. J. Mol. Phys. 1980, 39, 1055.
    • (1978) Faraday Trans. Chem. Soc. , vol.66 , pp. 80
    • Finney, J.L.1
  • 12
    • 84927356259 scopus 로고
    • For earlier basic studies see for example: (a) Warshel, A. J. Phys. Chem. 1979, 83, 1640. (b) Watts, R. O.; McGee, I. J. Liquid State Chemical Physics; Wiley-Interscience: New York, 1976. (c) Finney, J. L. Faraday Trans. Chem. Soc. 1978, 66, 80. (d) Zeiss, G. D.; Meath, W. J.; McDonald J. C. F.; Dawson, D. J. Mol. Phys. 1980, 39, 1055.
    • (1980) Mol. Phys. , vol.39 , pp. 1055
    • Zeiss, G.D.1    Meath, W.J.2    McDonald, J.C.F.3    Dawson, D.J.4
  • 37
    • 0001007591 scopus 로고
    • (b) For a more recent compilation of noble gas van der Waals parameters, see: Barrow, D. A.; Aziz, R. A. J. Chem. Phys. 1988, 89, 6189.
    • (1988) J. Chem. Phys. , vol.89 , pp. 6189
    • Barrow, D.A.1    Aziz, R.A.2
  • 43
    • 63749126177 scopus 로고
    • For alkali halide crystal cell constants, see: Tosi, M. P. Solid State Phys. 1964, 16, 1. For alkali halide crystal lettice energies, see: Tosi, M. P. J. Phys. Chem. Solids 1963, 24, 965.
    • (1964) Solid State Phys. , vol.16 , pp. 1
    • Tosi, M.P.1
  • 44
    • 0010029221 scopus 로고
    • For alkali halide crystal cell constants, see: Tosi, M. P. Solid State Phys. 1964, 16, 1. For alkali halide crystal lettice energies, see: Tosi, M. P. J. Phys. Chem. Solids 1963, 24, 965.
    • (1963) J. Phys. Chem. Solids , vol.24 , pp. 965
    • Tosi, M.P.1
  • 50
    • 85033163166 scopus 로고    scopus 로고
    • note
    • CFF is a second-generation class II force field for organic and biological molecules developed by the Potential Energy Functions Consortium (PEFC).
  • 52
    • 85033162668 scopus 로고    scopus 로고
    • Unpublished results
    • Thacher, T. Unpublished results.
    • Thacher, T.1
  • 59
    • 85033158971 scopus 로고    scopus 로고
    • Private communication
    • Straatsma, T. P. Private communication.
    • Straatsma, T.P.1
  • 72
    • 77949330843 scopus 로고
    • Bates, D. R., Esternmann, I., Eds.; Academic Press: New York
    • See for example: Dalgarno, A.; Davison, W. D. In Advances in Atomic and Molecular Physics; Bates, D. R., Esternmann, I., Eds.; Academic Press: New York, 1966; Vol. 2, p 1.
    • (1966) Advances in Atomic and Molecular Physics , vol.2 , pp. 1
    • Dalgarno, A.1    Davison, W.D.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.