printing out partial magnetization in spin-polarized hybrid calc
Posted: Thu Nov 10, 2011 3:50 pm
I need a hint how to force VASP to print out the partial magetic moments into OUTCAR. when running non-hybrid calculations i have no problem with it. I just set NPAR=1 and the RWIGS and I get it. in case of hybrid calculations, the job won't run unless I set NPAR= number of processors in the node, which in my case is NPAR=16. In that case, however, no moments are printed out in to OUTCAR. Could anyone tell me how to overcome this problem. thank you.