[Pw_forum] Calculating multiple el-ph matrices simultaneously

Paolo Giannozzi giannozz at democritos.it
Wed Jun 9 16:51:59 CEST 2010


Hahnbidt Rhee wrote:

> Is there an option (that I don't know of) to create separate jobs for each 
> q-point so that I can calculate el-ph matrices of multiple inequivalent 
> q-pts SIMULTANEOUSLY?

for sure there is the possibility to run each q-point separately:
see examples/GRID_example. In principle it should work for el-ph
matrices as well, but it is safe to try it for a simple system
first just to be sure that it works

Paolo
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy



More information about the users mailing list