TESTS OF APPROXIMATION SCHEMES FOR VIBRATIONAL ENERGY-LEVELS AND PARTITION-FUNCTIONS FOR TRIATOMICS - H2O AND SO2

被引:84
作者
ISAACSON, AD
TRUHLAR, DG
SCANLON, K
OVEREND, J
机构
关键词
D O I
10.1063/1.442394
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 ;
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页码:3017 / 3024
页数:8
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共 22 条
[1]  
Califano S., 1976, VIBRATIONAL STATES
[2]   IMPROVED POTENTIAL FUNCTIONS FOR BENT AB2 MOLECULES - WATER AND OZONE [J].
CARNEY, GD ;
CURTISS, LA ;
LANGHOFF, SR .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1976, 61 (03) :371-381
[3]  
CARNEY GD, 1975, INT J QUANTUM CHEM, V9, P317
[4]  
Darwent B. deB, 1970, NSRDSNBS31 CIRC, P44
[5]   SEMICLASSICAL METHODS FOR VIBRATIONAL ENERGY-LEVELS OF TRIATOMIC-MOLECULES [J].
HANDY, NC ;
COLWELL, SM ;
MILLER, WH .
FARADAY DISCUSSIONS, 1977, 62 :29-39
[6]  
HERZBERG G, 1945, MOL SPECTRA MOL STRU, V2, P168
[7]   ANHARMONIC FORCE CONSTANT CALCULATIONS [J].
HOY, AR ;
MILLS, IM ;
STREY, G .
MOLECULAR PHYSICS, 1972, 24 (06) :1265-1290
[8]   VIBRATIONAL ANHARMONICITY IN CF4 [J].
JEANNOTTE, AC ;
MARCOTT, C ;
OVEREND, J .
JOURNAL OF CHEMICAL PHYSICS, 1978, 68 (05) :2076-2080
[9]   ANHARMONIC SPLITTINGS AND VIBRATIONAL ENERGY-LEVELS OF OCTAHEDRAL MOLECULES - APPLICATION TO NV3 MANIFOLD OF (SF6)-S-32 [J].
JENSEN, CC ;
PERSON, WB ;
KROHN, BJ ;
OVEREND, J .
OPTICS COMMUNICATIONS, 1977, 20 (02) :275-279
[10]   ESTIMATION OF ANHARMONIC POTENTIAL CONSTANTS .2. BENT XY2 MOLECULES [J].
KUCHITSU, K ;
MORINO, Y .
BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1965, 38 (05) :814-+