Model name: model_name=EAM_Dynamo_BonnyTerentyevPasianot_2011_FeNiCr__MO_677715648236_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.498696523904801
cohesive_energy=4.116955213616656
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.49596689104324e-19, 3.75287446041624e-19, 4.40725146304086e-19, 4.910206751986139e-19, 5.25843984338604e-19, 5.48620527367548e-19, 5.63839603213914e-19, 5.746206497840999e-19, 5.828382137398859e-19, 5.89687518850236e-19, 5.959696534321499e-19, 6.023799621447839e-19, 6.09703511538798e-19, 6.1834405012596e-19, 6.27513307002342e-19, 6.35953573510254e-19, 6.429230418681539e-19, 6.4829674229859e-19, 6.52292570823786e-19, 6.5518289747152205e-19, 6.5720164003036205e-19, 6.58529844459948e-19, 6.59298889244268e-19, 6.595568396823419e-19, 6.59262039181686e-19, 6.5826228096207e-19, 6.563316581180999e-19, 6.53154541852878e-19, 6.481509442248959e-19, 6.40043930456856e-19, 6.270054170093639e-19, 6.065744605725959e-19, 5.75372070625446e-19, 5.28944196125394e-19, 4.62072547775502e-19, 3.66851986063614e-19, 2.2580917261932595e-19, 4.40707522361112e-21, -3.4876661621902194e-19, -9.05487748648074e-19, -1.7783359549083002e-18, -3.1610143900503002e-18, -5.399207082449279e-18, -9.14637779404848e-18, -1.57775145121467e-17, -2.81471993237754e-17]
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: 0.02076215285209205
Energy: 0.022069570611787378
Energy: 1.0744332607268416
Energy: 1.3888393492510065
Energy: 1.4170057747594258
Energy: 0.4664488681160721
Energy: 0.021778819870981358
Energy: 0.021778819870981358
Energy: 1.1427419169258846
Energy: 0.2950294387288127
Energy: 1.301539618214306
Energy: 1.301539618214306
Energy: 0.023868129433390367
Energy: 0.08579015798944147
Energy: 0.02113229789120557
Energy: 1.05321504368541
Energy: 1.05321504368541
Energy: 1.3014303677492332
Energy: 0.9236950027600233
Energy: 0.9236950027600233
Energy: 0.0860393374272379
Energy: 0.023773689603357847
Energy: 0.023773689603357847
Energy: 1.0738122725304682
Energy: 1.3682336911305064
Energy: 1.1504438607907606
Energy: 0.08766966138461392
Energy: 0.022666023915396575
Energy: 0.022666023915396575
Energy: 1.1432696928455695
Energy: 0.2954140971405831
Energy: 0.2954140971405831
Energy: 0.2954140971405831
Energy: 0.023762502880144636
Energy: 0.3295842946313592
Energy: 0.021396856639574417
Energy: 0.021396856639574417
Energy: 0.021396856639574417
Energy: 1.303428574868994
Energy: 0.9214610063796618
Energy: 0.08891701186674672
Energy: 0.08891701186674672

minimum gb energy = 0.02076215285209205 eV
minimum distance =  2.42710375866044 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.4609656594842078
Energy: 1.2821545933601148