MCSCF CALCULATION OF THE DIPOLE-MOMENT FUNCTION OF CO

被引：47

作者：

WERNER, HJ

机构：

来源：

MOLECULAR PHYSICS | 1981年 / 44卷 / 01期

关键词：

D O I：

10.1080/00268978100102311

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：

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页码：111 / 123

页数：13

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[1] PNO-CI (PAIR NATURAL ORBITAL CONFIGURATION INTERACTION) AND CEPA-PNO (COUPLED ELECTRON PAIR APPROXIMATION WITH PAIR NATURAL ORBITALS) CALCULATIONS OF MOLECULAR SYSTEMS .1. OUTLINE OF METHOD FOR CLOSED-SHELL STATES
AHLRICHS, R
LISCHKA, H
STAEMMLER, V
KUTZELNIGG, W
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (04) : 1225 - 1234
[2] BILLINGS.FP, 1974, J CHEM PHYS, V60, P4130, DOI 10.1063/1.1680880
[3] VIBRATION-ROTATION MATRIX-ELEMENTS FOR DIATOMIC-MOLECULES - VIBRATION-ROTATION INTERACTION FUNCTIONS FVV'(M) FOR CO
BOUANICH, JP
BRODBECK, C
[J]. JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER, 1976, 16 (02) : 153 - 163
[4] ABSOLUTE INTENSITY MEASUREMENT OF 4-0 VIBRATION-ROTATION BAND OF CARBON-MONOXIDE
CHACKERIAN, C
VALERO, FPJ
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1976, 62 (03) : 338 - 345
[5] ELECTRIC-DIPOLE MOMENT FUNCTION OF X1SIGMA+ STATE OF CO - VIBRATION-ROTATION MATRIX-ELEMENTS FOR TRANSITIONS OF GAS-LASER AND ASTROPHYSICAL INTEREST
CHACKERIAN, C
[J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 65 (10) : 4228 - 4233
[6] FUNDAMENTAL AND OVERTONE BANDS OF ISOTOPIC-SPECIES OF CARBON-MONOXIDE
CHEN, DW
RAO, KN
MCDOWELL, RS
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1976, 61 (01) : 71 - 78
[7] AB-INITIO STUDY OF X2-PI AND A2-SIGMA+ STATES OF OH .1. POTENTIAL CURVES AND PROPERTIES
CHU, SI
YOSHIMINE, M
LIU, B
[J]. JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (12) : 5389 - 5395
[8] Cooley JW., 1961, MATH COMPUT, V15, P363, DOI [10.2307/2003025, DOI 10.2307/2003025]
[9] COOPER DM, 1981, J CHEM PHYS, V74, P1200, DOI 10.1063/1.441227
[10] MEASUREMENTS OF LINE STRENGTHS IN 2-0 BAND OF CO
CRANCE, M
VERGES, J
[J]. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1975, 8 (18) : 3001 - 3006

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