# file generated by /usr/lib/cgi-bin/material_modeling.pl on Wed Oct 30 09:46:59 2024
#log="/var/www/html/data/material_modeling/optimade_structure_agm003477599.cif-QuantumEspresso-farhie-20241030-094659/material_modeling-log.txt"
atoms="/var/www/html/data/material_modeling/optimade_structure_agm003477599.cif-QuantumEspresso-farhie-20241030-094659/optimade_structure_agm003477599.cif"
calculator="QuantumEspresso"
directory="/var/www/html/data/material_modeling/optimade_structure_agm003477599.cif-QuantumEspresso-farhie-20241030-094659/"
smearing="semiconductor"
compute="electrons_3d_phonons_3d"
user_id="farhie"
user_ip=" [195.221.0.23]"
mpi="32"
