THE CALCULATION OF MOLECULAR SPIN ROTATION CONSTANTS

被引：7

作者：

BROWN, RD

HEADGORDON, M

机构：

来源：

CHEMICAL PHYSICS | 1986年 / 105卷 / 1-2期

关键词：

D O I：

10.1016/0301-0104(86)80050-7

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：

引用

页码：1 / 6

页数：6

共 33 条

[1]

AHLRICHS R, 1981, J CHIM PHYS, V78, pG316

[2] FEENBERG-GOLDHAMMER PROCEDURE AND GEOMETRIC APPROXIMATION IN HARTREE-FOCK PERTURBATION THEORY [J].

AMOS, AT .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (02) :603-&

[3] A COMMENT ON APPLICATION OF HARTREE-FOCK PERTURBATION THEORY TO PI-ELECTRON SYSTEMS [J].

AMOS, AT ;

MUSHER, JI .

MOLECULAR PHYSICS, 1967, 13 (06) :509-&

[4] HYPERFINE INTERACTIONS IN METHANIMINE [J].

BROWN, RD ;

GODFREY, PD ;

WINKLER, DA .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1982, 35 (04) :667-672

[5]

BROWN RD, UNPUB THIOFORMALDEHY

[6] BEAM MASER MEASUREMENTS OF HYPERFINE-STRUCTURE IN N-14(2)O [J].

CASLETON, KH ;

KUKOLICH, SG .

JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (07) :2696-2699

[7] RADIO-FREQUENCY SPECTRUM OF PHOSPHINE (PH3) [J].

DAVIES, PB ;

NEUMANN, RM ;

WOFSY, SC ;

KLEMPERE.W .

JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (07) :3564-&

[8] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES [J].

DITCHFIELD, R ;

HEHRE, WJ ;

POPLE, JA .

JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) :724-+

[9] SELF-CONSISTENT PERTURBATION-THEORY OF DIAMAGNETISM .1. GAUGE-INVARIANT LCAO METHOD FOR NMR CHEMICAL-SHIFTS [J].

DITCHFIELD, R .

MOLECULAR PHYSICS, 1974, 27 (04) :789-807

[10] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS [J].

DUNNING, TH .

JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (07) :2823-+

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