Quantitative characterization of the water trimer torsional manifold by terahertz laser spectroscopy and theoretical analysis.: II.: (H2O)3

被引:46
作者
Brown, MG
Viant, MR
McLaughlin, RP
Keoshian, CJ
Michael, E
Cruzan, JD
Saykally, RJ [1 ]
van der Avoird, A
机构
[1] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA
[2] Univ Nijmegen, Inst Theoret Phys, NSR Ctr, NL-6525 ED Nijmegen, Netherlands
关键词
D O I
10.1063/1.480114
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
We report the measurement of two new (H2O)(3) bands by terahertz laser vibration-rotation-tunneling (VRT) spectroscopy. Both bands have been assigned to torsional ("pseudorotational") transitions and are highly perturbed by Coriolis interactions. The 42.9 cm(-1) band corresponds to the k=+/- 2 <--+/- 1 transition while the 65.6 cm(-1) band corresponds to the k=+/- 2 <-- 0 transition. A model Hamiltonian is derived which allowed a global fit of 361 VRT transitions of these two new bands and the previously reported torsional band at 87.1 cm(-1). Each of the bifurcation tunneling components is accurately described. This global fit represents a complete description of the VRT transitions of (H2O)(3) up to 150 cm(-1), and complements our similar treatment of the (D2O)(3) torsional dynamics. (C) 1999 American Institute of Physics. [S0021-9606(99)00341-4].
引用
收藏
页码:7789 / 7800
页数:12
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