[Wien] DMFT

Sabry Moustafa sabrygad at buffalo.edu
Fri May 18 19:04:16 CEST 2018


Hi;

Was wondering if I need to define the ".machine" file if running DMFT 
with multiple cores using:

run_lapw -qdmft 4 -i 1000

? Here, I ask for 4 nodes and 1000 DMFT charge self-consistency 
iterations, as described here:

https://triqs.ipht.cnrs.fr/1.4/applications/dft_tools/guide/dftdmft_selfcons.html

I actually tried it and it worked; so, does this mean that only the DMFT 
part will run parallel (in run_lapw file: "mpirun -np 4 pytriqs 
case.py"), while the rest DFT codes will run in serial (one node, using 
all its cores - thread)?


Thanks;
Sabry


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