N374 WorkGraph<atomization_energy> (374) State: finished Exit Code: 0 N375 PwCalculation (375) State: finished Exit Code: 0 N374->N375 CALL_CALC pw_n N376 PwCalculation (376) State: finished Exit Code: 0 N374->N376 CALL_CALC pw_n2 N387 atomization_energy (387) State: finished Exit Code: 0 N374->N387 CALL_CALC atomization_energy N38 UpfData (38) N38->N374 INPUT_WORK workgraph_data__tasks__pw_n2__inputs__sockets__pseudos__sockets__N__property__value N38->N374 INPUT_WORK workgraph_data__tasks__pw_n__inputs__sockets__pseudos__sockets__N__property__value N298 InstalledCode (298) qe-7.2-pw@localhost N298->N374 INPUT_WORK workgraph_data__tasks__pw_n2__inputs__sockets__code__property__value N298->N374 INPUT_WORK workgraph_data__tasks__pw_n__inputs__sockets__code__property__value N363 StructureData (363) N2 N363->N374 INPUT_WORK workgraph_data__tasks__pw_n2__inputs__sockets__structure__property__value N364 Dict (364) N364->N374 INPUT_WORK workgraph_data__tasks__pw_n2__inputs__sockets__parameters__property__value N364->N374 INPUT_WORK workgraph_data__tasks__pw_n__inputs__sockets__parameters__property__value N365 KpointsData (365) Kpoints mesh: 1x1x1 (+0.0,0.0,0.0) N365->N374 INPUT_WORK workgraph_data__tasks__pw_n__inputs__sockets__kpoints__property__value N365->N374 INPUT_WORK workgraph_data__tasks__pw_n2__inputs__sockets__kpoints__property__value N373 StructureData (373) N N373->N374 INPUT_WORK workgraph_data__tasks__pw_n__inputs__sockets__structure__property__value N377 RemoteData (377) @localhost N375->N377 CREATE remote_folder N379 FolderData (379) N375->N379 CREATE retrieved N380 BandsData (380) (Path of 1 kpts) N375->N380 CREATE output_band N381 TrajectoryData (381) N375->N381 CREATE output_trajectory N382 Dict (382) N375->N382 CREATE output_parameters N378 RemoteData (378) @localhost N376->N378 CREATE remote_folder N383 FolderData (383) N376->N383 CREATE retrieved N384 BandsData (384) (Path of 1 kpts) N376->N384 CREATE output_band N385 TrajectoryData (385) N376->N385 CREATE output_trajectory N386 Dict (386) N376->N386 CREATE output_parameters N382->N387 INPUT_CALC output_atom N386->N387 INPUT_CALC output_mol N388 Float (388) value: 14.45126288059 N387->N388 CREATE result