ABINITIO ROTATION-VIBRATION ENERGIES OF H3O+

被引：70

作者：

BUNKER, PR

KRAEMER, WP

SPIRKO, V

机构：

[1] MAX PLANCK INST PHYS & ASTROPHYS, D-8046 GARCHING, GERMANY

[2] CZECHOSLOVAK ACAD SCI, J HEYROVSKY INST PHYS CHEM & ELECTROCHEM, CS-11142 PRAGUE 1, CZECHOSLOVAKIA

来源：

JOURNAL OF MOLECULAR SPECTROSCOPY | 1983年 / 101卷 / 01期

关键词：

D O I：

10.1016/0022-2852(83)90015-2

中图分类号：

O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];

学科分类号：

070203 ; 070304 ; 081704 ; 1406 ;

摘要：

引用

收藏

页码：180 / 185

页数：6

相关论文

共 6 条

[1] SCF-CI STUDIES OF CORRELATION EFFECTS ON HYDROGEN-BONDING AND ION HYDRATION - SYSTEMS - H2O,H+ . H2O, LI+ . H2O, F- . H2O, AND H2O . H2O
DIERCKSEN, GHF
KRAEMER, WP
ROOS, BO
[J]. THEORETICA CHIMICA ACTA, 1975, 36 (04): : 249 - 274
[2] SCF-CI STUDIES ON ELECTRONIC GROUND-STATE OF WATER - POTENTIAL-ENERGY HYPERSURFACE AND SPECTROSCOPIC CONSTANTS
HENNIG, P
KRAEMER, WP
DIERCKSEN, GHF
STREY, G
[J]. THEORETICA CHIMICA ACTA, 1978, 47 (03): : 233 - 248
[3] MCSCF AND MULTI-REFERENCE CI CALCULATIONS OF THE POTENTIAL-ENERGY SURFACE FOR GROUND-STATE H2O
KRAEMER, WP
ROOS, BO
SIEGBAHN, PEM
[J]. CHEMICAL PHYSICS, 1982, 69 (03) : 305 - 321
[4] SPIRKO V, 1982, J MOL SPECTROSC, V95, P381, DOI 10.1016/0022-2852(82)90137-0
[5] THE INVERSION POTENTIAL AND ROTATION-INVERSION ENERGY-LEVELS OF H3O+ AND CH3-
SPIRKO, V
BUNKER, PR
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1982, 95 (01) : 226 - 235
[6] Spirko V., UNPUB