Computer programs for structural chemistry: STATUS. A FORTRAN program for statistical analysis of crystallographic quantities
Abstract
A FORTRAN computer program was described for evaluation of: (1) the results of crystallographic leastsquares refinements by examination of the residuals, (2) differences in sets of data collected by different methods from the same crystal, (3) differences in data sets collected by the same method from different crystals of the same material, and (4) the differences in parameters in different models representing the crystal structure of the same material. Part of the evaluation was accomplished by plots of residuals against the expected normal distribution quantities. Additional plots compared residuals with the independent variable and with the calculated variable.
 Publication:

Final Report National Bureau of Standards
 Pub Date:
 January 1976
 Bibcode:
 1976nbs..reptR....S
 Keywords:

 Computer Programs;
 Crystallography;
 Fortran;
 Statistical Analysis;
 Crystal Structure;
 Distribution Functions;
 Least Squares Method;
 Univac 1108 Computer;
 SolidState Physics