FORTRAN routines for the new SQW and PDF modules of GULP and TOBYFIT
Cope, Elizabeth Ruth;
Publisher: University of Cambridge
Subject: GULP | TOBYFIT | SQW | INS | PDF | neutron scattering | computer simulations | lattice dynamics
This contains the source code for new modules for GULP and TOBYFIT, and is to be used in conjunction with these pre-exisiting codes.
A detailed understanding of fundamental material properties can be obtained through the study of atomic vibrations, performed experime... View more