HYPERSPHERICAL COORDINATES FOR MOLECULAR-DYNAMICS BY THE METHOD OF TREES AND THE MAPPING OF POTENTIAL-ENERGY SURFACES FOR TRIATOMIC SYSTEMS

被引:105
作者
AQUILANTI, V
CAVALLI, S
GROSSI, G
机构
关键词
D O I
10.1063/1.451224
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:1362 / 1375
页数:14
相关论文
共 60 条
[1]  
ABRAMOWITZ M, 1964, HDB MATH FUNCTIONS, pCH22
[2]   COORDINATES FOR MOLECULAR-DYNAMICS - ORTHOGONAL LOCAL SYSTEMS [J].
AQUILANTI, V ;
CAVALLI, S .
JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (03) :1355-1361
[3]   ON HYPERSPHERICAL MAPPING AND HARMONIC EXPANSIONS FOR POTENTIAL-ENERGY SURFACES [J].
AQUILANTI, V ;
GROSSI, G ;
LAGANA, A .
JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (03) :1587-1588
[4]   HYPERSPHERICAL DIABATIC AND ADIABATIC REPRESENTATIONS FOR CHEMICAL-REACTIONS [J].
AQUILANTI, V ;
GROSSI, G ;
LAGANA, A .
CHEMICAL PHYSICS LETTERS, 1982, 93 (02) :174-178
[5]   HYPERSPHERICAL ADIABATIC DESCRIPTION OF INTERFERENCE EFFECTS AND RESONANCES IN COLLINEAR CHEMICAL-REACTIONS [J].
AQUILANTI, V ;
CAVALLI, S ;
LAGANA, A .
CHEMICAL PHYSICS LETTERS, 1982, 93 (02) :179-183
[6]   DISCRETE REPRESENTATIONS BY ARTIFICIAL QUANTIZATION IN THE QUANTUM-MECHANICS OF ANISOTROPIC INTERACTIONS [J].
AQUILANTI, V ;
GROSSI, G .
LETTERE AL NUOVO CIMENTO, 1985, 42 (04) :157-162
[7]   A DECOUPLING SCHEME FOR A 3-BODY PROBLEM TREATED BY EXPANSIONS INTO HYPERSPHERICAL HARMONICS - THE HYDROGEN MOLECULAR ION [J].
AQUILANTI, V ;
GROSSI, G ;
LAGANA, A ;
PELIKAN, E ;
KLAR, H .
LETTERE AL NUOVO CIMENTO, 1984, 41 (16) :541-544
[8]  
AQUILANTI V, 1983, J MOL STRUCT, V93, P319
[9]  
AQUILANTI V, 1986, THEORY CHEM REACTION
[10]  
AQUILANTI V, UNPUB