The ground vibrational states of PH2D and PHD2

被引:45
|
作者
Ulenikov, ON [1 ]
Bürger, H
Jerzembeck, W
Onopenko, GA
Bekhtereva, ES
Petrunina, OL
机构
[1] Tomsk VV Kuibyshev State Univ, Lab Mol Spect, Dept Phys, Tomsk 634050, Russia
[2] Berg Univ Gesamthsch Wuppertal, FB9, D-42097 Wuppertal, Germany
关键词
PH3; species; infrared; rotational;
D O I
10.1016/S0022-2860(01)00826-2
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
The high resolution (2.3-3.1 x 10(-3) cm(-1)) Far infrared Fourier transform spectrum of PH2D and PHD2 was recorded in the 20-160 cm(-1) region. Assignments were made using a specially developed computer-assisted automatic 'two pair transition' method. Altogether, 1300 and 590 infrared transitions of the PHD2 and PH2D species, respectively, were fitted together with appropriately weighted microwave transitions to derive the rotational and centrifugal distortion parameters up to eighth order of the ground vibrational states of both molecules. The parameters obtained from these fits reproduce the microwave transitions with accuracies close to experimental uncertainties. A few of microwave transitions were shown to be blended, or misassigned. The rms deviations for the infrared data are 1.01 x 10(-4) and 1.05 x 10(-4) cm(-1) for PH2D and PHD2, respectively, which is also close to the experimental uncertainty. (C) 2001 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:225 / 237
页数:13
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