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

[1] THEORY OF MOLECULAR INTERACTIONS .1. MOLECULAR ORBITAL STUDIES OF WATER POLYMERS USING A MINIMAL SLATER-TYPE BASIS
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POPLE, JA
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (09) : 4858 - +
[2] Eisenberg D., 1969, STRUCTURE PROPERTIES
[3] WATER-WATER PAIR INTERACTIONS AND SECOND VIRIAL-COEFFICIENT OF STEAM
EVANS, DJ
WATTS, RO
[J]. MOLECULAR PHYSICS, 1974, 28 (05) : 1233 - 1240
[4] PVT PROPERTIES OF WATER .2. VIRIAL COEFFICIENTS IN RANGE 150 DEGREES - 453 DEGREES C WITHOUT INDEPENDENT MEASUREMENT OF VAPOR VOLUMES
KELL, GS
MCLAURIN, GE
WHALLEY, E
[J]. JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (08) : 3805 - &
[5] STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .6. DIMERS AND SMALL CLUSTERS OF WATER MOLECULES IN HARTREE-FOCK APPROXIMATION
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LIE, GC
POPKIE, H
CLEMENTI, E
[J]. JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (02) : 546 - 561
[6] THEORETICAL CALCULATIONS OF SECOND VIRIAL-COEFFICIENT OF WATER
LANE, JG
LEIDECKER, HW
[J]. JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (02) : 705 - 707
[7] STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .13. MONTE-CARLO SIMULATION OF LIQUID WATER WITH A CONFIGURATION INTERACTION PAIR POTENTIAL
LIE, GC
CLEMENTI, E
YOSHIMINE, M
[J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (06) : 2314 - 2323
[8] CL STUDY OF WATER DIMER POTENTIAL SURFACE
MATSUOKA, O
CLEMENTI, E
YOSHIMINE, M
[J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (04) : 1351 - 1361
[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
POPKIE, H
KISTENMA.H
CLEMENTI, E
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (03) : 1325 - 1336

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