Model name: model_name=EAM_Dynamo_ErcolessiAdams_1994_Al__MO_123629422045_005 a1: a1=[1, 0, 0] a2: a2=[0, 1, 0] a3: a3=[0, 0, 1] Species: species=Al Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=4.032082033157349 cohesive_energy=3.360264254236775 mass=26.981538 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=90.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.010444207371371736 Energy: 0.010956958420244417 Energy: 0.010956958420244417 Energy: 0.010956958420244417 Energy: 0.010956958420244417 Energy: 0.4131443937970052 Energy: 0.010956958420244417 Energy: 0.4131443937970052 Energy: 0.4131443937970052 Energy: 0.010956958420244417 Energy: 0.010444207371371736 Energy: 0.010956958420244417 Energy: 0.010956958420244417 Energy: 0.4131443937970052 Energy: 0.010956958420244417 Energy: 0.4131443937970052 minimum gb energy = 0.010444207371371736 eV minimum distance = 2.78872747944009 Angstroms sigma value = 1 ======================================== theta = 14.250032697803595 ======================================== Energy: 0.5223775772560205 Energy: 0.5242933437477931 Energy: 0.5242933437477931 Energy: 0.5242933437477931 Energy: 0.5061078729777031 Energy: 0.5264757754163399 Energy: 0.5083079451685809 Energy: 0.5264757754163399 Energy: 0.4867928436668086 Energy: 0.5135961352947793 Energy: 0.5153131883440055 Energy: 0.5135961352953908 Energy: 0.503609442172497 Energy: 0.53846403693646 Energy: 0.49407406205975674 Energy: 0.53846403693646 Energy: 0.5035100780961562 Energy: 0.5284990856738825 Energy: 0.514999654833203 Energy: 0.5284990856744938 Energy: 0.49228382581879154 Energy: 0.586326118485418 Energy: 0.4838590899398157 Energy: 0.5863261184848066 Energy: 0.5264370771135751 Energy: 0.5137757142541927 Energy: 0.4923749154942406 Energy: 0.5137757142541927 Energy: 0.4785747892864068 Energy: 0.5280825787425262 Energy: 0.4794407848229584 Energy: 0.5280825787406918 Energy: 0.49361194711868855 Energy: 0.5981010995090836 Energy: 0.5567049052969715 Energy: 0.598101099509695 Energy: 0.48579309916564284 Energy: 0.512923891723766 Energy: 0.47121966648652475 Energy: 0.512923891723766 Energy: 0.5054764953669086 Energy: 0.5227145801350456 Energy: 0.49370970766616007 Energy: 0.5227145801350456 Energy: 0.5197046581383813 Energy: 0.5284811560201136 Energy: 0.4979611691164859 Energy: 0.5284811560201136 Energy: 0.5184640310497047 Energy: 0.5117007288233504 Energy: 0.5263812459063884 Energy: 0.511700728822739 Energy: 0.5145241474805398 Energy: 0.5227104186663404 Energy: 0.49303203168668375 Energy: 0.5227104186669519 Energy: 0.4948492240541181 Energy: 0.5247511114906762 Energy: 0.4949898225803404 Energy: 0.5247511114900648 Energy: 0.4992161413510535 Energy: 0.5248742215680627 Energy: 0.5097579624243963 Energy: 0.5248742215692858 Energy: 0.5153711772676588 Energy: 0.5135494972624893 Energy: 0.47810862800764437 Energy: 0.5135494972631008 Energy: 0.5083432575400594 Energy: 0.5149475150097321 Energy: 0.521155148050793 Energy: 0.5149475150097321 Energy: 0.47032333502302937 Energy: 0.5269260589168918 Energy: 0.5033110778330521 Energy: 0.5269260589181147 Energy: 0.569525997997581 Energy: 0.5874559343225645 Energy: 0.4946548672412422 Energy: 0.5874559343237874 Energy: 0.48344197541141704 Energy: 0.5134873433809088 Energy: 0.47287898312714666 Energy: 0.5134873433821318 Energy: 0.49412187652478745 Energy: 0.5816304496319795 Energy: 0.5633545275030215 Energy: 0.5816304496332024 Energy: 0.5620447125274101 Energy: 0.528902503133582 Energy: 0.482649257278126 Energy: 0.5289025031329706 Energy: 0.5353600927582888 Energy: 0.5136286583757467 Energy: 0.49230534290571154 Energy: 0.5136286583757467 Energy: 0.4925403226770098 Energy: 0.586075047251242 Energy: 0.5727122271468021 Energy: 0.5860750472506305 Energy: 0.5038185832419079 Energy: 0.5286941344647005 Energy: 0.49337061715524416 Energy: 0.5286941344659235 Energy: 0.5003145894951649 Energy: 0.595997028417673 Energy: 0.4935299730232689 Energy: 0.5959970284170615 Energy: 0.48814942250965543 Energy: 0.5116464035311428 Energy: 0.5167011677945483 Energy: 0.5116464035305313 Energy: 0.5054397131668539 Energy: 0.5155182143875243 Energy: 0.49411663196068845 Energy: 0.5155182143881357 Energy: 0.5342001789925249 Energy: 0.5250075838872094 Energy: 0.5181287366857102 Energy: 0.5250075838872094 Energy: 0.5023611446944186 Energy: 0.5197505350329112 Energy: 0.5077667519181225 Energy: 0.5197505350341342 Energy: 0.4945421136596805 Energy: 0.5159199976754693 Energy: 0.5143951490342921 Energy: 0.5159199976754693 Energy: 0.5035720940488715 Energy: 0.53884443533637 Energy: 0.49612217024203514 Energy: 0.5388444353351473 minimum gb energy = 0.47032333502302937 eV minimum distance = 2.59862369714654 Angstroms sigma value = 1 ======================================== theta = 16.26020470831196 ======================================== Energy: 0.5683496853741364 Energy: 0.5625630256878645