custodian.cli.converge_kpoints module

This is a master vasp running script to converging kpoints for a calculation

custodian.cli.converge_kpoints.do_run(args)

Perform the run.

custodian.cli.converge_kpoints.get_runs(vasp_command, target=0.001, max_steps=10, mode=’linear’)

Generate the runs using a generator until convergence is achieved.

custodian.cli.converge_kpoints.main()

Main method


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