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Volumn 106, Issue 6, 1997, Pages 2400-2410

A quantum model for water: Equilibrium and dynamical properties

Author keywords

[No Author keywords available]

Indexed keywords


EID: 2942639536     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.473151     Document Type: Article
Times cited : (196)

References (62)
  • 31
    • 85033183964 scopus 로고    scopus 로고
    • note
    • H/P.
  • 35
    • 85033187382 scopus 로고
    • Ph.D. thesis, Univ. of California at Berkeley (Dept. of Chemistry)
    • J. S. Bader, Ph.D. thesis, Univ. of California at Berkeley (Dept. of Chemistry), 1991.
    • (1991)
    • Bader, J.S.1
  • 46
    • 85033175246 scopus 로고    scopus 로고
    • note
    • We do this for two reasons. First, the definitiveness of this new data in surplanting the older experimental results has not been established at this time as can be seen from the follow quote from Soper's work (Ref. 45), "This appears to be largely a result of the different ways of performing the Fourier transform in either case, rather than anything intrinsic to the diffraction data themselves... In the future, with much enhanced counting statistics in the large Q region on the SANDALS instrument, it is hoped to resolve the true height of this peak with better precision." Secondly, the SPC model was originally parametrized to match the older Soper data, and thus it seems more appropriate at this point to compare any modifications of the SPC model to the older data.
  • 52
    • 85033171443 scopus 로고
    • Harper & Row, New York, Chap. 21
    • D. A. McQuarrie, in Statistical Mechanics (Harper & Row, New York, 1976), Chap. 21, p. 474.
    • (1976) Statistical Mechanics , pp. 474
    • McQuarrie, D.A.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.