I. A computer program for generation of a complete set of coordinates and force matrices for normal mode calculations of crystals and molecules
| Main Author: | CPC, Mendeley |
|---|---|
| Other Authors: | Hansen, Flemming Yssing |
| Format: | Dataset |
| Terbitan: |
Mendeley
, 1978
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| Subjects: | |
| Online Access: |
https:/data.mendeley.com/datasets/bfnt9ztbrk |
Daftar Isi:
- Title of program: FYCOOR Catalogue Id: ACXQ_v1_0 Nature of problem In this paper a computer code, FYCOOR, is described for generation of a complete set of coordinates to be used in a normal mode calculation for crystals or for molecules. This program eliminates or reduces time- consuming and error producing complexities, which have handicapped the application of some computer programs for calculating normal modes. CORRECTION SUMMARY: Vol:Year:Page 0:unpublished:unpublished "000ACORRECTION 28/11/77" "Unpublished correction to I. A computer program for generation of a complete set of coordinates and force matrices for normal mode calculations of crystals and molecules." F.Y. Hansen Note: correction instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data ACXQ_v1_0; FYCOOR; 10.1016/0010-4655(78)90015-2 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)