atat-mirror/glue/vasp

This directory contains what is needed to glue maps and vasp together.

Here are the functions of each file

runstruct_vasp: main script that does everything needed to get the energy of
                a structure. It needs the files below.
cleanvasp: cleanup the results of a vasp run
ezvasp:    user-friendly front-end to vasp (ezvasp -h for help)
ezvasp.txt: help file printed by ezvasp -h must reside where ezvasp is.
vasp.wrap: A file called vasp.wrap residing in the directory where maps is
           started is needed to specify the parameters of the all runs.
           This is an example of such file.