pyiron.dft.master.convergence_kpoint_parallel module

class pyiron.dft.master.convergence_kpoint_parallel.ConvKpointParallel(project, job_name='encut_conv')[source]

Bases: pyiron.atomistics.master.parallel.AtomisticParallelMaster

collect_output()[source]

Collect the output files of the external executable and store the information in the HDF5 file. This method has to be implemented in the individual meta jobs derived from the ParallelMaster.

plot(plt_show=True)[source]
write_input()[source]

Write the input files - this contains the GenericInput of the ParallelMaster as well as reseting the submission status.

class pyiron.dft.master.convergence_kpoint_parallel.KpointConvergenceJobGenerator(job)[source]

Bases: pyiron.base.master.parallel.JobGenerator

static job_name(parameter)[source]
static modify_job(job, parameter)[source]
property parameter_list

Returns: (list)