element(s): ['Ag'] AFLOW prototype label: A_cF4_225_a Parameter names: ['a'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['4.1492'] model name: EAM_Dynamo_WilliamsMishinHamilton_2006_CuAg__MO_128703483589_005 ==== Building ASE atoms object with: ==== representative atom symbols = ['Ag'] representative atom coordinates = [[0 0 0]] spacegroup = 225 cell = [[4.1492, 0, 0], [0, 4.1492, 0], [0, 0, 4.1492]] ========================================= Step Time Energy fmax BFGS: 0 16:46:18 -11.360132 0.4541 BFGS: 1 16:46:18 -11.368504 0.4060 BFGS: 2 16:46:18 -11.399996 0.0050 BFGS: 3 16:46:18 -11.400000 0.0003 BFGS: 4 16:46:18 -11.400000 0.0000 BFGS: 5 16:46:18 -11.400000 0.0000 Minimization converged after 5 steps. Maximum force component: 0.0 eV/Angstrom Maximum stress component: 7.001929410811564e-13 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['Ag', 'Ag', 'Ag', 'Ag'] basis = [[0. 0. 0. ] [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ]] cellpar = Cell([[4.090000145455816, -2.209906010505989e-32, 1.213280716905175e-33], [-1.0046854858735428e-32, 4.090000145455816, 2.483853020362057e-20], [-1.4924226696711852e-32, 2.4838530203636645e-20, 4.090000145455816]]) forces = [[0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.]] stress = [7.00192941e-13 7.00192941e-13 7.00192941e-13 8.37400681e-29 9.59428450e-37 4.23867937e-53] energy per atom = -2.849999948568272 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0