N111 WorkGraph<atomization_energy_workflow> (111) State: finished Exit Code: 0 N112 calculate_energy (112) State: finished Exit Code: 0 N111->N112 CALL_CALC calculate_energy N114 calculate_energy (114) State: finished Exit Code: 0 N111->N114 CALL_CALC calculate_energy1 N116 compute_atomization_energy (116) State: finished Exit Code: 0 N111->N116 CALL_CALC compute_atomization_energy N117 Float (117) value: 9.6512352233732 N111->N117 RETURN result N109 AtomsData (109) N109->N111 INPUT_WORK graph_inputs__molecule_obj N110 AtomsData (110) N110->N111 INPUT_WORK graph_inputs__atom_obj N113 Float (113) value: 5.1 N112->N113 CREATE result N113->N116 INPUT_CALC function_inputs__energy_atom N115 Float (115) value: 0.54876477662678 N114->N115 CREATE result N115->N116 INPUT_CALC function_inputs__energy_molecule N116->N117 CREATE result