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- Sat Jul 22, 2023 3:13 pm
- Forum: Running the code
- Topic: why does core number used for scf/nscf calculation affect epw?
- Replies: 1
- Views: 11816
why does core number used for scf/nscf calculation affect epw?
Dear experts, I am calculating phonon linewidth recently by using following command: srun -N X1 pw.x < scf.in > scf.out srun -N X2 pw.x -nk X2 < nscf.in > nscf.out srun -N X2 epw.x -nk X2 < epw.in > epw.out The package is the latest version QE7.2 and EPW5.7. The problem is that when X1 changes the ...