Re: [Wien] Error while running SCF with k-point parallelization

Your machines file is wrong. granularity:1 1:gorina1 # this is a correct line for k-parallel. However, you need at least 2 such lines to run in parallel on 2 cores. lapw0:gorina1:32 # runs lapw0 in mpi-mode !!! on 32 cores !!!??? dstart:

[Wien] Error while running SCF with k-point parallelization

Dear WIEN2k users, I was trying to run SCF with k-point parallelization. My "*.machines" *file contains only > > granularity:1 > 1:gorina1 > lapw0:gorina1:32 > dstart:gorina1:1 > lapw1:gorina1:8 Then with "*testpara_lapw*" the output is: > #