I. A Fortran program for calculating degenerate Raman bands of symmetric tops with an adaptation for infrared bands
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Abstract Title of program: FORTRAN VIBROT I Catalogue number: AAGF Program obtainable from: CPC Program Library, Queen's University of Belfast, Northern Ireland (see application form in this issue) Computer for which the program is designed and others upon which it is operable Computer: IBM 360/91. Installation: Osk Ridge National Laboratory, Oak Ridge, Tennessee, USA Operating system or monitor under which the program is executed: OS 360 Programming language used: FORTRAN IV High... Title of program: FORTRAN VIBROT I Catalogue Id: AAGC_v2_0 [AAGF] Nature of problem This program solves the same physical problem as program VIBROT I (CPC 1 (1970) 349). the original program has been translated into Fortran IV from Algol. The logic, the test data and the output format are all virtually identical. the total cpu time is 11 seconds. ADAPTATION SUMMARY: Vol:Year:Page 2:1971:298 "0001VIBROT I FOR INFRARED" "I. A FORTRAN program for calculating degenerate Raman bands of symmetric tops with an adaptation for infrared bands." F.N. Masri; I.R. Williams Note: adaptation instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data AAGC_v1_0; VIBROT I; 10.1016/0010-4655(70)90036-6 AAGC_v2_0; FORTRAN VIBROT I; 10.1016/0010-4655(71)90005-1 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
# 摘要 程序标题:FORTRAN VIBROT I 目录号:AAGF 程序获取渠道:北爱尔兰贝尔法斯特女王大学CPC程序库(详见本期申请表) 适用及可运行计算机:IBM 360/91 安装地点:美国田纳西州橡树岭橡树岭国家实验室 程序运行所用操作系统或监控程序:OS 360 所用编程语言:FORTRAN IV …… 程序标题:FORTRAN VIBROT I 目录标识:AAGC_v2_0 [AAGF] ## 程序所解决的物理问题 本程序所解决的物理问题与VIBROT I程序(CPC 1(1970) 349)完全一致。原程序已从Algol语言翻译为FORTRAN IV,其逻辑、测试数据及输出格式均几乎完全相同,总CPU运行时长为11秒。 ## 适配摘要 卷:年份:页码:2:1971:298 "0001VIBROT I FOR INFRARED" "I. 一款用于计算对称陀螺简并拉曼带的FORTRAN程序,附带红外波段适配功能。" 作者:F.N. 马斯里;I.R. 威廉姆斯 注:适配说明已包含于源代码中 本程序在Mendeley数据的CPC库中留存的版本包括: AAGC_v1_0;VIBROT I;10.1016/0010-4655(70)90036-6 AAGC_v2_0;FORTRAN VIBROT I;10.1016/0010-4655(71)90005-1 本程序源自贝尔法斯特女王大学所藏CPC程序库(1969-2019)。




