element=lattice type=modelname=Al fcc EAM_Dynamo_Zhou_Johnson_Al__MO_131650261510_004 Attempting to perform relaxation using initial lattice constant guess of 2.5 Angstroms * Error: at line 626 in EAM_Implementation.hpp Message: Particle has density value outside of embedding function interpolation domain KIM_STATUS_MSG: unsuccessful completion Failed to perform relaxation using initial lattice constant guess of 2.5 Angstroms Attempting to perform relaxation using initial lattice constant guess of 3.0 Angstroms Optimization terminated successfully. Current function value: -3.580002 Iterations: 31 Function evaluations: 63 {'basis_atoms': '[[0.0 0.0 0.0] [0.0 0.5 0.5] [0.5 0.0 0.5] [0.5 0.5 0.0]]', 'repeat': 0, 'cohesive_energy': 3.5800024715199394, 'space_group': 'Fm-3m', 'element': 'Al', 'lattice_constant': 4.050180673599245, 'wyckoff_code': '4a', 'crystal_structure': 'fcc', 'iterations': 31, 'warnflag': 0, 'species': 'Al" "Al" "Al" "Al', 'func_calls': 63}