New assignments for the infrared spectrum H-3(+)

被引:43
作者
Dinelli, BM
Neale, L
Polyansky, OL
Tennyson, J
机构
[1] UNIV LONDON UNIV COLL, DEPT PHYS & ASTRON, LONDON WC1E 6BT, ENGLAND
[2] RUSSIAN ACAD SCI, INST PHYS APPL, NIZHNII NOVGOROD 603024, RUSSIA
基金
英国工程与自然科学研究理事会;
关键词
D O I
10.1006/jmsp.1996.7178
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
Calculations are presented for H-3(+) using two potential energy surfaces, one ab initio, the other spectroscopically determined, both of which include allowance for the adiabatic correction to the Born-Oppenheimer potential. Systematically labeled energy levels for H-+(3) are presented and the spectra calculated for a number of temperatures. Assignments are given for 105 or about 85% of the published unassigned H-3(+) infrared transitions. Forty previously assigned transitions are relabeled or reassigned. Calculations for higher J levels are discussed. (C) 1997 Academic Press, Inc.
引用
收藏
页码:142 / 150
页数:9
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