bash script for jobs
job.sh: Batch run the mcsqs task (in the first level directory).
job-2circulation.sh: Batch run the mcsqs task (in the secondary directory).
cif.sh: Convert the results of job.sh to .cif files (in the first level directory).
cif-2circulation.sh: Convert the results of job.sh to .cif files (in the secondary directory).
content-change.sh: Batch change the content of rndstr1.in file (in the first level directory).
content-change-2circulation.sh: Batch change the content of rndstr1.in file (in the secondary directory).
copy.sh: Batch copy INCAR, KPOINTS and POTCAR files to each task folder (in the first level directory).
copy-2circulation.sh: Batch copy INCAR, KPOINTS and POTCAR files to each task folder (in the secondary directory).
create-folder+files.sh: Batch create folders and generate specified files in each folder. Note that it needs to be used with create-rndstr.sh and create-sqscell.sh.
create-rndstr.sh: Create the rndstr.in file.
create-sqscell.sh: Create the sqscell.out file.