MOLECULAR-DYNAMICS WITH STOCHASTIC BOUNDARY-CONDITIONS

被引：167

作者：

BERKOWITZ, M

MCCAMMON, JA

机构：

来源：

CHEMICAL PHYSICS LETTERS | 1982年 / 90卷 / 03期

关键词：

D O I：

10.1016/0009-2614(82)80028-6

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：215 / 217

页数：3

共 17 条

[1] GENERALIZED LANGEVIN EQUATION APPROACH FOR ATOM-SOLID-SURFACE SCATTERING - GENERAL FORMULATION FOR CLASSICAL SCATTERING OFF HARMONIC SOLIDS [J].

ADELMAN, SA ;

DOLL, JD .

JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (06) :2375-2388

[2]

ADELMAN SA, 1980, ADV CHEM PHYS, V44, P143

[3]

BENNETT CH, 1975, DIFFUSION SOLIDS

[4] DYNAMICS OF LIQUID-STATE CHEMICAL-REACTIONS - R-DEPENDENT CORRELATION-FUNCTIONS FOR I.+I. IN CCI4 [J].

BROOKS, CL ;

ADELMAN, SA .

JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (02) :1007-1023

[5] GENERALIZED LANGEVIN THEORY FOR MANY-BODY PROBLEMS IN CHEMICAL-DYNAMICS - GAS-SURFACE COLLISIONS, VIBRATIONAL-ENERGY RELAXATION IN SOLIDS, AND RECOMBINATION REACTIONS IN LIQUIDS [J].

BROOKS, CL ;

BERKOWITZ, M ;

ADELMAN, SA .

JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (09) :4353-4364

[6] ON THE DERIVATION OF THE GENERALIZED LANGEVIN EQUATION FOR INTERACTING BROWNIAN PARTICLES [J].

CICCOTTI, G ;

RYCKAERT, JP .

JOURNAL OF STATISTICAL PHYSICS, 1981, 26 (01) :73-82

[7]

Hansen J. P., 1976, THEORY SIMPLE LIQUID

[8] STOCHASTIC TRAJECTORY SIMULATION OF IODINE RECOMBINATION IN LIQUIDS [J].

HYNES, JT ;

KAPRAL, R ;

TORRIE, GM .

JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (01) :177-188

[9] DYNAMICS OF TYROSINE RING ROTATIONS IN A GLOBULAR PROTEIN [J].

MCCAMMON, JA ;

KARPLUS, M .

BIOPOLYMERS, 1980, 19 (07) :1375-1405

[10] DYNAMICS OF ACTIVATED PROCESSES IN GLOBULAR-PROTEINS [J].

MCCAMMON, JA ;

KARPLUS, M .

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 1979, 76 (08) :3585-3589

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