AN EFFECTIVE COMPUTATIONAL APPROACH TO THE CALCULATION OF THE VIBRATION-ROTATION SPECTRA OF TRIATOMIC-MOLECULES

被引:40
作者
SUTCLIFFE, BT [1 ]
MILLER, S [1 ]
TENNYSON, J [1 ]
机构
[1] UNIV LONDON UNIV COLL,DEPT PHYS & ASTRON,LONDON WC1E 6BT,ENGLAND
关键词
D O I
10.1016/0010-4655(88)90063-X
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
引用
收藏
页码:73 / 82
页数:10
相关论文
共 28 条
[1]   OBSERVATION OF THE NU-1 FUNDAMENTAL-BAND OF H2D+ [J].
AMANO, T ;
WATSON, JKG .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (07) :2869-2871
[2]  
[Anonymous], 1978, ADV CHEM PHYS, DOI 10.1002/9780470142561.ch6
[3]  
BRINK DM, 1968, ANGULAR MOMENTUM, P39
[4]   ROTATION ENERGIES FOR DEUTERATED H(3)+ OSCILLATORS IN ZERO-POINT STATES OF VIBRATION [J].
CARNEY, GD .
CHEMICAL PHYSICS, 1980, 54 (01) :103-107
[5]   OBSERVATION OF THE INFRARED-SPECTRUM OF H-3+ AT ITS DISSOCIATION LIMIT [J].
CARRINGTON, A ;
BUTTENSHAW, J ;
KENNEDY, R .
MOLECULAR PHYSICS, 1982, 45 (03) :753-758
[6]   INFRARED PREDISSOCIATION SPECTRUM OF THE H-3+ ION [J].
CARRINGTON, A ;
KENNEDY, RA .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (01) :91-112
[7]   VARIATIONAL CALCULATIONS OF ROTATIONAL-VIBRATIONAL ENERGY-LEVELS OF WATER [J].
CHEN, CL ;
MAESSEN, B ;
WOLFSBERG, M .
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (04) :1795-1807
[8]  
CONDON EU, 1935, THEORY ATOMIC SPECTR, P52
[9]   OBSERVATION AND ANALYSIS OF THE NU-2 AND NU-3 FUNDAMENTAL BANDS OF THE H2D+ ION [J].
FOSTER, SC ;
MCKELLAR, ARW ;
PETERKIN, IR ;
WATSON, JKG ;
PAN, FS ;
CROFTON, MW ;
ALTMAN, RS ;
OKA, T .
JOURNAL OF CHEMICAL PHYSICS, 1986, 84 (01) :91-99