aiida_yambo.workflows.utils.helpers_aiida_qe#

Classes for calcs e wfls analysis. hybrid AiiDA and not_AiiDA…hopefully

Module Contents#

Classes#

calc_manager_aiida_qe

class aiida_yambo.workflows.utils.helpers_aiida_qe.calc_manager_aiida_qe(calc_info={})[source]#
updater(inp_to_update, k_distance, first)[source]#
take_quantities(start=1)[source]#
get_caller(calc, depth=2)[source]#
get_called(calc, depth=2)[source]#
start_from_converged(node, params)[source]#
set_relaxed_structure(last_ok)[source]#
set_parent(last_ok)[source]#
take_down(node=0, what='CalcJobNode')[source]#
take_super(node=0, what='WorkChainNode')[source]#