nroisin_2024.zip
nroisin_2024
README.txt
1.3 kB
code
abipy
run_mobility_SOC.py
13.0 kB
run_mobility_woSOC.py
10.4 kB
run_relax.py
2.3 kB
bash
job.sh
523 Bytes
launch.sh
737 Bytes
pseudopotentials
Si_NCFR.psp8
410.9 kB
Si_woNLCC.psp8
155.0 kB
relaxation_input
Straintensor.py
5.1 kB
set_input.py
2.7 kB
data
EphMob_Si_with_SOC.zip
65.9 MB
EphMob_Si_wo_SOC.zip
88.1 MB