SURFACE SELF-DIFFUSION CONSTANTS AT LOW-TEMPERATURE - MONTE-CARLO TRANSITION-STATE THEORY WITH IMPORTANCE SAMPLING

被引：37

作者：

VOTER, AF

DOLL, JD

机构：

来源：

关键词：

D O I：

10.1063/1.446606

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：5814 / 5817

页数：4

共 8 条

[1] SURFACE SELF-DIFFUSION ON A FCC CRYSTAL - ATOMIC VIEW
AYRAULT, G
EHRLICH, G
[J]. JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (01) : 281 - 294
[2] THEORETICAL-STUDIES OF SURFACE-DIFFUSION - SELF-DIFFUSION IN THE FCC (111) SYSTEM
DOLL, JD
MCDOWELL, HK
[J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (01) : 479 - 483
[3] Franklin W. M., 1975, DIFFUSION SOLIDS REC
[4] CALCULATION OF POTENTIAL-ENERGY PARAMETERS FROM CRYSTALLINE STATE PROPERTIES
HALICIOGLU, T
POUND, GM
[J]. PHYSICA STATUS SOLIDI A-APPLIED RESEARCH, 1975, 30 (02): : 619 - 623
[5] EQUATION OF STATE CALCULATIONS BY FAST COMPUTING MACHINES
METROPOLIS, N
ROSENBLUTH, AW
ROSENBLUTH, MN
TELLER, AH
TELLER, E
[J]. JOURNAL OF CHEMICAL PHYSICS, 1953, 21 (06) : 1087 - 1092
[6] CHEMISORPTION OF H, CL, NA, O, AND S ATOMS ON NI(100) SURFACES - A THEORETICAL-STUDY USING NI-20 CLUSTERS
UPTON, TH
GODDARD, WA
[J]. CRC CRITICAL REVIEWS IN SOLID STATE AND MATERIALS SCIENCES, 1981, 10 (03): : 261 - 296
[7] Valleau J. P., 1977, MODERN THEORETICAL C, V5
[8] VOTER A, 1984, J CHEM PHYS, V80, P5842