EVALUATION OF 1ST-ORDER AND 2ND-ORDER NONADIABATIC COUPLING ELEMENTS FROM LARGE MULTICONFIGURATIONAL SELF-CONSISTENT-FIELD WAVE-FUNCTIONS

被引:16
作者
AGREN, H [1 ]
FLORESRIVEROS, A [1 ]
JENSEN, HJA [1 ]
机构
[1] AARHUS UNIV,INST CHEM,DIV THEORET,DK-8000 AARHUS C,DENMARK
来源
PHYSICAL REVIEW A | 1986年 / 34卷 / 06期
关键词
D O I
10.1103/PhysRevA.34.4606
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
引用
收藏
页码:4606 / 4614
页数:9
相关论文
共 40 条
[1]   X-RAY-EMISSION OF THE NITROGEN MOLECULE FOLLOWING PHOTON OR ELECTRON-IMPACT - A THEORETICAL-STUDY USING CONFIGURATION-INTERACTION WAVEFUNCTIONS [J].
AGREN, H ;
ARNEBERG, R ;
MULLER, J ;
MANNE, R .
CHEMICAL PHYSICS, 1984, 83 (1-2) :53-67
[2]   SINGLE DETERMINANT WAVE FUNCTIONS [J].
AMOS, AT ;
HALL, GG .
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1961, 263 (1312) :483-+
[3]   ADIABATIC AND DIABATIC REPRESENTATIONS FOR ATOM-DIATOM COLLISIONS - TREATMENT OF 3-DIMENSIONAL CASE [J].
BAER, M .
CHEMICAL PHYSICS, 1976, 15 (01) :49-57
[4]   LOW ENERGY COLLISIONS BETWEEN HYDROGEN ATOMS + PROTONS [J].
BATES, DR ;
WILLIAMS, DA .
PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON, 1964, 83 (5333) :425-&
[5]   RADIAL COUPLINGS FOR CHARGE-TRANSFER [J].
BUTLER, SE .
PHYSICAL REVIEW A, 1981, 23 (01) :1-9
[6]   ABINITIO POTENTIAL CURVES AND COUPLING-MATRIX ELEMENTS FOR CHARGE-TRANSFER FROM H TO N-2+ AND N-3+ [J].
BUTLER, SE .
PHYSICAL REVIEW A, 1979, 20 (06) :2317-2326
[7]   STRONG VIBRONIC COUPLING EFFECTS IN IONIZATION SPECTRA - MYSTERY BAND OF BUTATRIENE [J].
CEDERBAUM, LS ;
DOMCKE, W ;
KOPPEL, H ;
VONNIESSEN, W .
CHEMICAL PHYSICS, 1977, 26 (02) :169-177
[8]   NON-ADIABATIC INTERACTIONS IN UNIMOLECULAR DECAY .1. [J].
DESOUTERLECOMTE, M ;
LECLERC, JC ;
LORQUET, JC .
CHEMICAL PHYSICS, 1975, 9 (1-2) :147-156
[9]   NONADIABATIC INTERACTIONS IN UNIMOLECULAR DECAY .2. SIMPLIFIED FORMALISM [J].
DESOUTERLECOMTE, M ;
LORQUET, JC .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (09) :4006-4017
[10]   VIBRONIC COUPLING AND SYMMETRY BREAKING IN CORE ELECTRON IONIZATION [J].
DOMCKE, W ;
CEDERBAUM, LS .
CHEMICAL PHYSICS, 1977, 25 (02) :189-196