[basic] section

2025 March 6 updated

NameValueDefaultDescription
algoRS, EA, EA-vc, BO, LAQAAlgorithm
calc_codeVASP, QE, OMX, soiap, LAMMPS, ASECaluculation code for structure optimization
tot_strucintThe total number of structures. Not used in the case of EA or EA-vc.
nstageintThe number of stages
njobintThe number of jobs running at the same time.
jobcmdstrCommand to submit jobs such as qsub and sbatch.
jobfilestrFile name of the job file.