CALCULATION OF 2ND VIRIAL-COEFFICIENTS FOR WATER USING A RECENT AB-INITIO POTENTIAL

被引：37

作者：

LIE, GC ^{[1
]}

CLEMENTI, E ^{[1
]}

机构：

[1] IST RICERCHE G DONEGANI,I-28100 NOVARA,ITALY

来源：

JOURNAL OF CHEMICAL PHYSICS | 1976年 / 64卷 / 12期

关键词：

D O I：

10.1063/1.432162

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：5308 / 5309

页数：2

共 13 条

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[2]

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[6] THEORETICAL CALCULATIONS OF SECOND VIRIAL-COEFFICIENT OF WATER [J].

LANE, JG ;

LEIDECKER, HW .

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[7] STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .13. MONTE-CARLO SIMULATION OF LIQUID WATER WITH A CONFIGURATION INTERACTION PAIR POTENTIAL [J].

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JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (06) :2314-2323

[8] CL STUDY OF WATER DIMER POTENTIAL SURFACE [J].

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[9]

McCarty M. Jr., 1970, Journal of Physical Chemistry, V74, P1113, DOI 10.1021/j100700a026

[10] STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .4. HARTREE-FOCK POTENTIAL FOR WATER DIMER AND ITS APPLICATION TO LIQUID STATE [J].

POPKIE, H ;

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CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (03) :1325-1336

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