A VECTORIZABLE POTENTIAL-ENERGY FUNCTIONAL FOR REACTIVE SCATTERING

被引:8
作者
GARCIA, E [1 ]
CICCARELLI, L [1 ]
LAGANA, A [1 ]
机构
[1] UNIV PERUGIA, DEPARTIMENTO CHIM, I-06100 PERUGIA, ITALY
来源
THEORETICA CHIMICA ACTA | 1987年 / 72卷 / 04期
关键词
D O I
10.1007/BF00529030
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:253 / 264
页数:12
相关论文
共 15 条
[1]   AN IMPROVEMENT OF THE LI+HF PES BASED ON A 3D QUASI-CLASSICAL TRAJECTORY TEST [J].
ALVARINO, JM ;
HERNANDEZ, ML ;
GARCIA, E ;
LAGANA, A .
JOURNAL OF CHEMICAL PHYSICS, 1986, 84 (06) :3059-3067
[2]  
ALVARINO JM, 1983, CHEM PHYS, V78, P93
[3]   STUDY OF THE REACTION DYNAMICS OF LI+HF, HCL BY THE CROSSED MOLECULAR-BEAMS METHOD [J].
BECKER, CH ;
CASAVECCHIA, P ;
TIEDEMANN, PW ;
VALENTINI, JJ ;
LEE, YT .
JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (06) :2833-2850
[5]   REACTIVE MOLECULAR COLLISION CALCULATIONS [J].
CONNOR, JNL .
COMPUTER PHYSICS COMMUNICATIONS, 1979, 17 (1-2) :117-143
[6]  
DINI M, UNPUB
[7]   A NEW BOND-ORDER FUNCTIONAL FORM FOR TRIATOMIC-MOLECULES A FIT OF THE BEFH POTENTIAL-ENERGY [J].
GARCIA, E ;
LAGANA, A .
MOLECULAR PHYSICS, 1985, 56 (03) :629-639
[8]   DIATOMIC POTENTIAL FUNCTIONS FOR TRIATOMIC SCATTERING [J].
GARCIA, E ;
LAGANA, A .
MOLECULAR PHYSICS, 1985, 56 (03) :621-627
[9]  
JAFFE RL, IN PRESS J CHEM PHYS
[10]  
MURRELL JN, 1985, J MOL STRUCT, V120, P401