Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Cu__MO_666348409573_004 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.614999935030937 cohesive_energy=3.5402784116098815 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=120.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4407749620674739e-19, 2.1537259402544999e-19, 2.6952616425464997e-19, 3.13411384436544e-19, 3.50152499007432e-19, 3.8151030008808e-19, 4.0859990261575193e-19, 4.3218714702149993e-19, 4.5282318206742e-19, 4.70926175854986e-19, 4.86816563710998e-19, 5.007555004267979e-19, 5.1294486025827e-19, 5.2356729134169e-19, 5.32760580867582e-19, 5.40652902966666e-19, 5.47348399120152e-19, 5.52938393396178e-19, 5.57502994626444e-19, 5.6111430075948e-19, 5.63833194507378e-19, 5.65717354228962e-19, 5.668132430466179e-19, 5.67170528436e-19, 5.667892103971079e-19, 5.655571365655619e-19, 5.63330111044302e-19, 5.599350987568559e-19, 5.55168623270706e-19, 5.48783949384216e-19, 5.40491083126632e-19, 5.299359434618399e-19, 5.1669395358183e-19, 5.002460082571859e-19, 4.79959247717478e-19, 4.55045401058778e-19, 4.2453354924088197e-19, 3.8719802713878e-19, 3.4149593865393e-19, 2.8544378911344e-19, 2.1649091331598197e-19, 1.3128139208397957e-19, 2.53690250404194e-20, -1.0722503035979639e-19, -2.74335898509918e-19, -4.87744223982084e-19, -7.63919421267834e-19, -1.122786158987592e-18, -1.6020196206898679e-18] 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: 0.015446976282065778 Energy: 0.020227166295825622 Energy: 0.10416581565477427 Energy: 0.10461329584622028 Energy: 0.019508987582954933 Energy: 0.01675883683276743 Energy: 0.01675883683276743 Energy: 0.10491383482208136 Energy: 0.1033554517212581 Energy: 0.018675803109790345 Energy: 0.01612644314887257 Energy: 0.1019758104445398 Energy: 0.10302114523383497 Energy: 0.10460178574240894 Energy: 0.10473171472664554 Energy: 0.10473171472664554 Energy: 0.10760905457190421 Energy: 0.10279818017162073 Energy: 0.1047850034658092 Energy: 0.10415550314798763 Energy: 0.10507579510117349 Energy: 0.018857237195846553 Energy: 0.015924825851176678 Energy: 0.10263026865918783 Energy: 0.10350893833785457 Energy: 0.10454485493355962 Energy: 0.018301554585967744 Energy: 0.015853649233677172 Energy: 0.1022325833432041 Energy: 0.10451003588391379 Energy: 0.10358185951039085 Energy: 0.017178621522555622 Energy: 0.016855769781663744 Energy: 0.10562571783761263 Energy: 0.10279863231158448 Energy: 0.10392038669852509 Energy: 0.017435156497507764 Energy: 0.0162400711861918 Energy: 0.10434535464777349 Energy: 0.10254264256660203 Energy: 0.10368046999840823 Energy: 0.10374429007264362 Energy: 0.10534817142177978 Energy: 0.01749677638304167 Energy: 0.0171124738828532 Energy: 0.10268930775297137 Energy: 0.10370377891106172 Energy: 0.10477186131602431 Energy: 0.018005486273170637 Energy: 0.018005486273170637 Energy: 0.10527623693583399 Energy: 0.10290581854350891 Energy: 0.10346046863122793 Energy: 0.0165602613440286 Energy: 0.019822064857387856 Energy: 0.10553439648389616 Energy: 0.10194771032756686 Energy: 0.10405294189541686 Energy: 0.017017812080186236 Energy: 0.016014858566676927 Energy: 0.01611770192700026 Energy: 0.1053902386639339 Energy: 0.10337898457125587 Energy: 0.10399596083256464 Energy: 0.10583976389406051 Energy: 0.02022993311157126 Energy: 0.1061846749974461 Energy: 0.10362764344540956 Energy: 0.10443063712098404 Energy: 0.10529262961749242 minimum gb energy = 0.015446976282065778 eV minimum distance = 2.51937693812409 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 1.1899478825056633 Energy: 0.8057506012952518 Energy: 0.8394847411410266 Energy: 0.7903977887908085 Energy: 0.8134977949961537 Energy: 0.8075274951253221 Energy: 0.8075274951253221 Energy: 0.8405171800083383 Energy: 0.8404642660044497 Energy: 0.8068305333686064 Energy: 0.7264037139078027 Energy: 0.8989996414407526 Energy: 0.8456662422146958 Energy: 0.7287954535386734 Energy: 0.6304933902278655