# file generated by /usr/lib/cgi-bin/material_modeling.pl on Thu Nov 16 11:48:01 2023
#log="/var/www/html/data/material_modeling/Al.cif-QuantumEspresso-pkwi-20231116-114801/material_modeling-log.txt"
atoms="/var/www/html/data/material_modeling/Al.cif-QuantumEspresso-pkwi-20231116-114801/Al.cif"
calculator="QuantumEspresso"
directory="/var/www/html/data/material_modeling/Al.cif-QuantumEspresso-pkwi-20231116-114801/"
smearing="semiconductor"
compute="electrons_3d_phonons_3d"
user_id="pkwi"
user_ip=" [195.221.0.23]"
mpi="32"
