III. A force constant adjuster program to obtain least squares fit to observed frequencies of molecules and crystals

Title of program: FYADJ
Catalogue Id: ACXS_v1_0

Nature of problem
The objective of the present program is to determine the values of a given set of force constants for the internal vibration of molecules or crystals in the harmonic approximation in such a way as to give a least squares fit of calculated frequencies to observed frequencies.

CORRECTION SUMMARY:
Vol:Year:Page 0:unpublished:unpublished
"000ACORRECTION 28/11/77"
"Unpublished correction to III. A force constant adjuster program to
obtain a least squares fit to observed frequencies of molecules and
crystals."
F.Y. Hansen

Note: correction instructions are contained in source code

Versions of this program held in the CPC repository in Mendeley Data
ACXS_v1_0; FYADJ; 10.1016/0010-4655(78)90017-6

This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)