COMPUTER SIMULATIONS OF POLYATOMIC-MOLECULES .1. MONTE-CARLO STUDIES OF HARD DIATOMICS

被引：153

作者：

STREETT, WB ^{[1
]}

TILDESLEY, DJ ^{[1
]}

机构：

[1] UNIV OXFORD, PHYS CHEM LAB, OXFORD OX1 3QZ, ENGLAND

来源：

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES | 1976年 / 348卷 / 1655期

关键词：

D O I：

10.1098/rspa.1976.0051

中图分类号：

O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];

学科分类号：

07 ; 0710 ; 09 ;

摘要：

引用

页码：485 / 510

页数：26

共 30 条

[1] ROLES OF REPULSIVE AND ATTRACTIVE FORCES IN LIQUIDS - OPTIMIZED RANDOM PHASE APPROXIMATION [J].

ANDERSEN, HC ;

CHANDLER, D ;

WEEKS, JD .

JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (08) :3812-+

[2] SIMULATION OF DIATOMIC HOMONUCLEAR LIQUIDS [J].

BAROJAS, J ;

LEVESQUE, D ;

QUENTREC, B .

PHYSICAL REVIEW A, 1973, 7 (03) :1092-1105

[3] INVARIANT EXPANSION .2. ORNSTEIN-ZERNIKE EQUATION FOR NONSPHERICAL MOLECULES AND AN EXTENDED SOLUTION TO MEAN SPHERICAL MODEL [J].

BLUM, L .

JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (05) :1862-&

[4] OPTIMIZED CLUSTER EXPANSIONS FOR CLASSICAL FLUIDS .2. THEORY OF MOLECULAR LIQUIDS [J].

CHANDLER, D ;

ANDERSEN, HC .

JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (05) :1930-+

[5] STATISTICAL MECHANICS OF LINEAR MOLECULES .6. SOLUTIONS OF PERCUS-YEVICK INTEGRAL EQUATION FOR A HARD-CORE MODEL [J].

CHEN, YD ;

STEELE, WA .

JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) :703-&

[6] STATISTICAL MECHANICS OF LINEAR MOLECULES .3. HARD-CORE MODEL [J].

CHEN, YD ;

STEELE, WA .

JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (03) :1428-&

[7]

CHEUNG PYS, IN PRESS

[8]

FEW GA, 1973, CHEM PHYS LETT, V20, P433, DOI 10.1016/0009-2614(73)85191-7

[9] THERMODYNAMIC PROPERTIES FOR A SIMPLE MODEL OF SOLID CARBON-DIOXIDE - MONTE-CARLO, CELL MODEL, AND QUASIHARMONIC CALCULATIONS [J].

GIBBONS, TG ;

KLEIN, ML .

JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (01) :112-126

[10] ANGULAR CORRELATION EFFECTS IN NEUTRON-DIFFRACTION FROM MOLECULAR FLUIDS [J].

GUBBINS, KE ;

GRAY, CG ;

EGELSTAFF, PA ;

ANANTH, MS .

MOLECULAR PHYSICS, 1973, 25 (06) :1353-1375

← 1 2 3 →