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Volumn 111, Issue 24, 1999, Pages 10998-11014

On the structure and thermodynamics of solvated monoatomic ions using a hybrid solvation model

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0001420456     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.480486     Document Type: Article
Times cited : (133)

References (126)
  • 13
    • 0032478818 scopus 로고    scopus 로고
    • D. A. Doyle et al., Science 280, 69 (1998).
    • (1998) Science , vol.280 , pp. 69
    • Doyle, D.A.1
  • 42
    • 0020208576 scopus 로고
    • Yu. Ya. Gurevich and Yu. V. Pleskov, Electrokhimiya 18, 1477 (1982); Sov. Electrochem. 18, 1315 (1982).
    • (1982) Sov. Electrochem. , vol.18 , pp. 1315
  • 75
    • 0003961579 scopus 로고
    • edited by B. E. Conway and J. O. 'M. Bockris Plenum, New York
    • (a) P. Kabarle, in Modern Aspects of Electrochemistry, edited by B. E. Conway and J. O. 'M. Bockris (Plenum, New York, 1974), Vol. 9;
    • (1974) Modern Aspects of Electrochemistry , vol.9
    • Kabarle, P.1
  • 81
    • 0002360961 scopus 로고    scopus 로고
    • Combined Quantum Mechanical and Molecular Mechanical Models
    • American Chemical Society, Washington, DC
    • (b) Combined Quantum Mechanical and Molecular Mechanical Models, edited by J. Gao and M. A. Thompson ACS Symposium Series Vol. (American Chemical Society, Washington, DC, 1998).
    • (1998) ACS Symposium Series
    • Gao, J.1    Thompson, M.A.2
  • 95
    • 0003527976 scopus 로고
    • Harper and Row, New York
    • The Sackur-Tetrode equation can be found in many places, e.g., D. M. McQuarrie, Statistical Mechanics (Harper and Row, New York, 1973), p. 86. An easy to use form of this equation can be found in E. J. Rosenbaum, Physical Chemistry (Appleton-Century-Crofts, New York, 1970), p. 351: S=4.576(-log P+5/2 log T+3/2 log M-0.5053) cal/mol deg, where P is the pressure in atmospheres, T is the temperature in Kelvin, and M is the mass in grams/mol.
    • (1973) Statistical Mechanics , pp. 86
    • McQuarrie, D.M.1
  • 97
    • 85034152758 scopus 로고    scopus 로고
    • note
    • The basis set was obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory. This is part of the Pacific Northwest Laboratory. P.O. Box 999 Richland, Washington 99352.
  • 110
    • 0003129931 scopus 로고
    • Structure and Reactivity in Aqueous Solution: Characterization of Chemical and Biological Systems, edited by C. J. Cramer and D. G. Truhlar American Chemical Society, Washington, DC
    • G. J. Tawa and L. R. Pratt, in Structure and Reactivity in Aqueous Solution: Characterization of Chemical and Biological Systems, ACS Symposium Series 568, edited by C. J. Cramer and D. G. Truhlar (American Chemical Society, Washington, DC, 1994), p. 60.
    • (1994) ACS Symposium Series , vol.568 , pp. 60
    • Tawa, G.J.1    Pratt, L.R.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.