pyiron_atomistics.dft.job.generic

pyiron_atomistics.dft.job.generic#

Functions

get_k_mesh_by_density(cell[, k_mesh_spacing])

Get k-mesh density according to the box size.

set_encut(job, parameter)

set_kpoints(job, parameter)

Classes

GenericDFTJob(project, job_name)

MapFunctions()