lmf

solving the Kohn-Sham equation

• Usage: mpirun lmf [FLAGS] [TARGET] > llmf

Example:

mpirun -np 4 lmf si > llmf

Flags

-quit=band

-tdos

Input

• ctrl.target

[options]

• syml.target for band plot
• sigm.target a part of QSGW calculation

Output

rst.target

• restart file

save.target

• ???

mix.target

• Main Source : SRC/main/lmf