THE DETERMINATION OF RADIAL NON-ADIABATIC COUPLING - HENE2+ AS A CASE-STUDY

被引:29
作者
MONTABONEL, MCB [1 ]
CIMIRAGLIA, R [1 ]
PERSICO, M [1 ]
机构
[1] UNIV PISA,IST CHIM FIS,I-56100 PISA,ITALY
关键词
D O I
10.1088/0022-3700/17/10/003
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
引用
收藏
页码:1931 / 1942
页数:12
相关论文
共 33 条
[1]   DETERMINATION OF NON-ADIABATIC POTENTIAL-ENERGY CURVES FROM WAVEFUNCTIONS OBTAINED BY CONFIGURATION-INTERACTION CALCULATIONS [J].
BACCHUSMONTABONEL, MC ;
CHAMBAUD, G ;
LEVY, B ;
MILLIE, P .
JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1983, 80 (05) :425-439
[2]  
Bashkin S., 1975, ATOMIC ENERGY LEVELS, V1
[3]  
BINKLEY JS, 1980, QCPE437 PROGR
[4]   INDIVIDUALIZED CONFIGURATION SELECTION IN CI CALCULATIONS WITH SUBSEQUENT ENERGY EXTRAPOLATION [J].
BUENKER, RJ ;
PEYERIMH.SD .
THEORETICA CHIMICA ACTA, 1974, 35 (01) :33-58
[5]  
CEDERBAUM LS, 1981, INT J QUANTUM CHEM S, V15, P251
[6]   DIABATIC REPRESENTATION - COMMENTS [J].
CIMIRAGLIA, R ;
PERSICO, M .
MOLECULAR PHYSICS, 1979, 38 (05) :1707-1710
[7]   NON-ADIABATIC INTERACTIONS IN THE SYMMETRIC RING-OPENING PROCESS OF DIOXIRANE [J].
CIMIRAGLIA, R ;
HA, TK ;
MEYER, R ;
GUNTHARD, HH .
CHEMICAL PHYSICS, 1982, 66 (1-2) :209-215
[8]   THE EVALUATION OF NON-ADIABATIC MATRIX-ELEMENTS - A COMPARISON OF DIFFERENT APPROXIMATIONS APPLIED TO LIH X-A SIGMA+ [J].
CIMIRAGLIA, R ;
PERSICO, M ;
TOMASI, J .
CHEMICAL PHYSICS, 1980, 53 (03) :357-363
[9]   CALCULATION OF RADIATIVE SINGLE-CHARGE-TRANSFER CROSS-SECTIONS FOR COLLISIONS OF HE2+ WITH HE AT LOW-ENERGY [J].
COHEN, JS ;
BARDSLEY, JN .
PHYSICAL REVIEW A, 1978, 18 (03) :1004-1008
[10]  
DAUDEY JP, 1981, ATELIER CALCUL MOL A