Model name: model_name=EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Fe Lattice type: short_name=bcc Lattice constant (meters) and cohesive energy (J): a=2.860342010855675 cohesive_energy=4.301279955555746 mass=55.845 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=60.0 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: 0.016269083781530417 Energy: -2.970962728171629 Energy: 0.016269083781121418 Energy: -2.9709627295794956 Energy: 0.016269083781530417 Energy: -2.970962720000325 Energy: 0.016269083781121418 Energy: -3.4908625492825927 Energy: 8.961807794087727 Energy: -3.4908625492817746 Energy: 8.961583424061773 Energy: -3.4908625492825927 Energy: 8.962595954859161 Energy: -3.4908625492821828 Energy: -2.965571355311069 Energy: -2.74028748511708 Energy: -2.2752362290691455 Energy: -2.7402946500392074 Energy: -4.083803492296875 Energy: -2.7401697291247937 Energy: -4.083589990468975 Energy: -3.4908625492817746 Energy: 8.962581150532898 Energy: -3.490862549283365 Energy: 8.961733339415423 Energy: -3.4908625492817746 Energy: 8.961909557063194 Energy: -3.490862549283365 Energy: 0.016269083781121418 Energy: -2.9709627268836907 Energy: 0.016269083781121418 Energy: -2.970962728353134 Energy: 0.016269083781530417 Energy: -2.9709627270000283 Energy: 0.016269083781121418 Energy: -3.490862549282956 Energy: 8.965073265038736 Energy: -3.4908625492821828 Energy: 8.961788495533904 Energy: -3.4908625492825927 Energy: 8.961760167707089 Energy: -3.490862549282956 minimum gb energy = -4.083803492296875 eV minimum distance = 2.3988536641086 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: -4.3177173964988524 Energy: -4.8485850159463615 Energy: -4.317717396454393 Energy: -4.848612144099741 Energy: -4.317717396463676 Energy: -4.848609463457394 Energy: -4.317717396456348 Energy: -4.741939488790754 Energy: -4.7117619498405094 Energy: -4.741952294441767 Energy: -4.711908701978459 Energy: -4.741939908596105 Energy: -4.712168549632623 Energy: -4.74190205178493 Energy: -4.966245833959273 Energy: -4.7068253437771475 Energy: -4.966262664046995 Energy: -4.706825344006197 Energy: -4.9662735366790045 Energy: -4.706825343807927 Energy: -4.9662692615847694 Energy: -4.95411161680289 Energy: -4.490644921671879 Energy: -4.954111613617869 Energy: -4.490644921673345 Energy: -4.9541116223715465 Energy: -4.490644921742233 Energy: 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