II. Program for calculating triply degenerate Raman bands of spherical tops with an adaptation for infrared bands
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资源简介:
Title of program: VIBROT II
Catalogue Id: AAGE_v1_0
Nature of problem
The program VIBROT II calculates the triply degenerate vibration- rotation bands of spherical top molecules in the gas-phase infrared or Raman spectrum. It is thus the analogue of the program VIBROT I (CPC 1 (1970) 349) for symmetric top molecules and will be useful for band analysis in spherical tops in a corresponding way to VIBROT I for symmetric tops.
ADAPTATION SUMMARY:
Vol:Year:Page 2:1971:88
"0001ADAPT VIBROT II FOR INFRARED"
"II. Program for calculating triply degenerate Raman ban ...
Note: adaptation instructions are contained in source code
Versions of this program held in the CPC repository in Mendeley Data
AAGE_v2_0; FORTRAN VIBROT II; 10.1016/0010-4655(71)90006-3
AAGE_v1_0; VIBROT II; 10.1016/0010-4655(71)90018-X
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
创建时间:
2019-11-11



