HYDROGEN-BOND STUDIES .70. AB-INITIO CALCULATIONS OF SOME PROPERTIES OF WATER MOLECULES IN FREE STATE AND IN SOLID HYDRATES

被引：33

作者：

ALMLOF, J

TEGENFELDT, J

LINDGREN, J

机构：

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1972年 / 14卷 / 03期

关键词：

D O I：

10.1016/0022-2860(72)85191-3

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

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页码：427 / +

页数：1

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共 18 条

[1] ALMLOF J, IN PRESS
[2] BERGLUND B, UNPUBLISHED RESULTS
[3] Decius J. C., 1955, MOLECULAR VIBRATIONS
[4] DEVILLEPIN J, TO BE PUBLISHED
[5] ZERO-POINT VIBRATIONAL CORRECTIONS TO ONE-ELECTRON PROPERTIES OF WATER MOLECULE IN NEAR-HARTREE-FOCK LIMIT
ERMLER, WC
KERN, CW
[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (10) : 4851 - &
[6] Ewald PP, 1921, ANN PHYS-BERLIN, V64, P253
[7] GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
HUZINAGA, S
[J]. JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (04) : 1293 - &
[8] ESTIMATION OF ANHARMONIC POTENTIAL CONSTANTS .2. BENT XY2 MOLECULES
KUCHITSU, K
MORINO, Y
[J]. BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1965, 38 (05) : 814 - +
[9] MILLIMETER WAVE ROTATIONAL TRANSITIONS AND STARK EFFECT OF WATER MOLECULE
LICHTENSTEIN, M
DERR, VE
GALLAGHER, JJ
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1966, 20 (04) : 391 - +
[10] LINDGREN J, UNPUBLISHED RESULTS