MOLECULAR TRAJECTORY CALCULATIONS

被引:137
作者
PORTER, RN [1 ]
机构
[1] SUNY, DEPT CHEM, STONY BROOK, NY 11790 USA
关键词
D O I
10.1146/annurev.pc.25.100174.001533
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
收藏
页码:317 / 355
页数:39
相关论文
共 243 条
[1]   THEORETICAL STUDIES OF HOT-ATOM REACTIONS .3. SOLUTION OF INTEGRAL REACTION PROBABILITY EQUATION FOR QUANTUM-MECHANICAL NONREACTIVE SCATTERING [J].
ADAMS, JT ;
PORTER, RN .
JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (08) :4105-4124
[2]  
Ahlberg J. H., 1967, The Theory of Splines and Their Applications
[3]   COMPUTER DYNAMICS [J].
ALDER, BJ .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1973, 24 :325-337
[4]   ENERGY REQUIREMENTS FOR CHEMICAL REACTION - H+HF-!H2+F [J].
ANDERSON, JB .
JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (07) :3849-&
[5]   VIBRATIONAL POPULATION INVERSION IN HYDROGEN IODIDE FROM H+I2-]HI+I [J].
ANDERSON, JB ;
KUNG, RTV .
JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (06) :2477-2479
[6]   ENERGY-DISTRIBUTION AMONG REACTION PRODUCTS .5. H+X2(X=CL, BR), D+CL2 [J].
ANLAUF, KG ;
POLANYI, JC ;
WOODALL, KB ;
MACDONAL.RG ;
HORNE, DS .
JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (04) :1561-&
[7]   ENERGY DISTRIBUTION AMONG REACTION PRODUCTS .2. H+X2 AND X+HY [J].
ANLAUF, KG ;
KUNTZ, PJ ;
MAYLOTTE, DH ;
PACEY, PD ;
POLANYI, JC .
DISCUSSIONS OF THE FARADAY SOCIETY, 1967, (44) :183-&
[8]   RATES OF ENDOTHERMIC REACTIONS HCL plus X(X=I,CL) AS A FUNCTION OF REAGENT VIBRATION, ROTATION, AND TRANSLATION [J].
ANLAUF, KG ;
MAYLOTTE, DH ;
POLANYI, JC ;
BERNSTEIN, RB .
JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (12) :5716-+
[9]   TRANSLATIONAL ENERGY-DISTRIBUTION IN PRODUCTS OF SOME EXOTHERMIC REACTIONS [J].
ANLAUF, KG ;
CHARTERS, PE ;
HORNE, DS ;
MACDONALD, RG ;
MAYLOTTE, DH ;
POLANYI, JC ;
SKRLAO, WJ ;
TARDY, DC ;
WOODALL, KB .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (10) :4091-+
[10]   THE THEORY OF SCATTERING BY A RIGID ROTATOR [J].
ARTHURS, AM ;
DALGARNO, A .
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1960, 256 (1287) :540-551