Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003Potential5_Fe__MO_942420706858_005
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=3.6582963466644287
cohesive_energy=4.015220655245625
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=[1.399403557024326e-19, 2.21962346521092e-19, 2.7510173894097e-19, 3.2405784816947395e-19, 3.7376858259259196e-19, 4.21119310833828e-19, 4.62758279374854e-19, 4.97950089140664e-19, 5.26854957794658e-19, 5.4997917315318e-19, 5.685692286374819e-19, 5.836953782390759e-19, 5.961202580357459e-19, 6.063982211428559e-19, 6.1494743566188e-19, 6.220402716205979e-19, 6.278513662721159e-19, 6.32526517690128e-19, 6.36189093475452e-19, 6.38960859052272e-19, 6.409587733148699e-19, 6.422853755678219e-19, 6.43023978996096e-19, 6.432578967846599e-19, 6.42998344169952e-19, 6.42139577494128e-19, 6.40556626979736e-19, 6.38095683669912e-19, 6.34591723371354e-19, 6.29948615486022e-19, 6.24156746954112e-19, 6.172241286587939e-19, 6.09158771483238e-19, 5.998789644191099e-19, 5.89134767911506e-19, 5.76525637801926e-19, 5.61309766308828e-19, 5.420467966382459e-19, 5.16503294562384e-19, 4.819427423903699e-19, 4.34156222104686e-19, 3.65478920688276e-19, 2.6591005159171197e-19, 9.1176667887672e-20, -2.71266128079174e-19, -9.88323484979142e-19, -2.1421902684897e-18, -3.774888367367399e-18, -6.0632452101769195e-18, -9.21911661323208e-18, -1.3452163410858118e-17, -1.8925070618471397e-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: 0.018518889670885663
Energy: -0.32144802926025007
Energy: 0.9397630970270273
Energy: 0.5117010763265513
Energy: 0.5106696092344136
Energy: -0.46806390794301195
Energy: -0.31475959192182335
Energy: 0.019117538876599387
Energy: -1.2329902555626346
Energy: -0.1379523833483846
Energy: -1.3723565923912806
Energy: -1.3075985266914172
Energy: -0.31748806115169304
Energy: -0.6188951433751145
Energy: 0.018893737098316866
Energy: -1.0026166316655396
Energy: -0.8465355087414281
Energy: 0.6417741181323866
Energy: -1.2266074724864322
Energy: -0.6178272085497588
Energy: -0.6304339263472786
Energy: 0.020424226482393802
Energy: -1.1780612539605944
Energy: -0.6586579594096951
Energy: -1.3642311786856385
Energy: -1.3429151415488354
Energy: -0.461034405124319
Energy: -1.3346012213167147
Energy: -0.7156205319509044
Energy: -1.1305900577039298
Energy: -0.1375479029519602
Energy: -1.2173947427907583
Energy: -0.20166948068944002
Energy: -0.31648468050213474
Energy: -0.7171811325590991
Energy: 0.018997685644744224
Energy: -1.2370552259467398
Energy: -0.8543103006586196
Energy: -1.3497937557735171
Energy: -0.1307725028004114
Energy: -0.6122518762285274
Energy: -0.6169716051059364

minimum gb energy = -1.3723565923912806 eV
minimum distance =  2.42478051697965 Angstroms
sigma value = 5


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

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Energy: -3.3700634839313177

minimum gb energy = -4.228237997959351 eV
minimum distance =  2.1502422907719 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

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minimum gb energy = -4.057621644608509 eV
minimum distance =  2.14450110203485 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

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minimum gb energy = -1.8356118101385521 eV
minimum distance =  2.21524932272875 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

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Energy: -2.5631803696596878
Energy: -0.5630040395895198
Energy: -0.5908537707137731
Energy: -0.6768642335779295

minimum gb energy = -3.0421645063320617 eV
minimum distance =  2.17714714029974 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

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Energy: -1.3085241939639836

minimum gb energy = -2.575551671424638 eV
minimum distance =  2.21343017900242 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

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minimum gb energy = -5.717347823570488 eV
minimum distance =  2.25318238963021 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

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Energy: -0.8248167495621093
Energy: -1.7427086197476098
Energy: -1.5031258841870228
Energy: -1.5267307189424937
Energy: -1.193192939624358
Energy: -0.629161284255177
Energy: -2.8044566592941664
Energy: -1.633838279571131
Energy: -1.396382352244458
Energy: -3.2372544450831913
Energy: -1.2296018676877798
Energy: -1.4052729739375953
Energy: -1.2316064275486138
Energy: -1.3501908516711996
Energy: -1.2593184639715993
Energy: -1.4270414446169326
Energy: -1.2087643900494862
Energy: -1.3760127704399823
Energy: -1.57266885350914
Energy: -1.2376545654021307
Energy: -3.0773884402837313
Energy: -0.9807069913707647
Energy: -3.2259335306622594
Energy: -1.4905499886905538
Energy: -1.7165808322297793
Energy: -1.3540446193215914
Energy: -1.2035067819527006
Energy: -2.6059404220540787
Energy: -0.9942122160602596
Energy: -3.214841119416108
Energy: -1.6210720313380416
Energy: -1.7467750684248693
Energy: -1.373932568802251
Energy: -1.4938611184639488
Energy: -1.3552024904475826
Energy: -1.2760649857374102
Energy: -2.1363321901805388
Energy: -1.4904026877411292
Energy: -1.089631091539671
Energy: -1.1639711838090767
Energy: -1.2628205339148766
Energy: -2.768388371665192
Energy: -0.9638481998870468
Energy: -1.6366955421746194
Energy: -1.138420641366949
Energy: -1.231832159080076
Energy: -1.3982323580164635
Energy: -1.6099262924770477
Energy: -0.9829341712764446
Energy: -0.8428285519511928
Energy: -2.1207295854871933
Energy: -1.0768845736156447
Energy: -1.476586186394195
Energy: -1.1889770170595797
Energy: -0.8500470355363108

minimum gb energy = -3.2372544450831913 eV
minimum distance =  2.33290953214467 Angstroms
sigma value = 23