Model name: model_name=EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_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=2.8599988371133813
cohesive_energy=4.2806306056621946
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=[1.014876358334424e-19, 2.31572201971824e-19, 3.16857666376278e-19, 3.77181218823012e-19, 4.2624307170935996e-19, 4.70652203650572e-19, 5.11937091155484e-19, 5.481270569642759e-19, 5.780637273705659e-19, 6.016589826594839e-19, 6.198004286862659e-19, 6.336432348040259e-19, 6.44180750525844e-19, 6.523951101283619e-19, 6.590120996267819e-19, 6.645492220738859e-19, 6.693797846253961e-19, 6.736479831783719e-19, 6.7730575243379395e-19, 6.803178445057139e-19, 6.82668237627792e-19, 6.843537274467599e-19, 6.853951422588599e-19, 6.85778062474386e-19, 6.852942051309179e-19, 6.83581478309172e-19, 6.802040899646999e-19, 6.746445370447199e-19, 6.6630040113484795e-19, 6.5452920940485e-19, 6.38621197605864e-19, 6.175910271079799e-19, 5.899983411172319e-19, 5.540743366296839e-19, 5.07678505662312e-19, 4.48204106831598e-19, 3.72470819519052e-19, 2.7654369791157e-19, 1.550203626169674e-19, 2.46613436211816e-22, -1.9705490856892797e-19, -4.5155746252656e-19, -7.81860595215366e-19, -1.2090201119593738e-18, -1.7621699926712397e-18, -2.4800893206003e-18, -3.4196056987778996e-18, -4.6832103664810194e-18, -6.44757534114084e-18, -8.95110450589656e-18, -1.249776281175066e-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: 0.01615136899002058
Energy: -3.9198385351194696
Energy: -4.42909740543941
Energy: -5.339367707480582
Energy: -5.38637440636665
Energy: -4.182386961750478
Energy: -5.227140380228897
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Energy: -5.07505100716521
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Energy: -5.234816614221705
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Energy: -5.127236107622431
Energy: -5.158465284585538
Energy: -5.204972416070207
Energy: -4.393151011264535
Energy: -4.467654270124528
Energy: -5.244419647511028
Energy: -4.383121136908629
Energy: -4.441309784786313
Energy: -4.225975211847262
Energy: -5.170399620583631
Energy: -5.272143689066
Energy: -4.644616121794367
Energy: -5.169983592922026
Energy: -5.268477625573334
Energy: -5.17946108756937
Energy: -5.177658931640507
Energy: -5.132483815868595
Energy: 0.016769755721263314
Energy: -5.05969348812723
Energy: -5.005145252682342
Energy: -5.348486457952713
Energy: -5.441326653338684
Energy: -5.0281158563379496
Energy: -5.122031026949899

minimum gb energy = -5.441326653338684 eV
minimum distance =  2.4043203385683 Angstroms
sigma value = 5


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

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minimum gb energy = -7.809188316153815 eV
minimum distance =  2.36658148883259 Angstroms
sigma value = 401


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

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minimum gb energy = -6.880450857649536 eV
minimum distance =  2.38106443442241 Angstroms
sigma value = 311


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

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minimum gb energy = -3.7154177734689324 eV
minimum distance =  2.35976474215644 Angstroms
sigma value = 39


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

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minimum gb energy = -5.156899284398833 eV
minimum distance =  2.3578300383045 Angstroms
sigma value = 21


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

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minimum gb energy = -4.038067140344591 eV
minimum distance =  2.37372541331193 Angstroms
sigma value = 113


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

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minimum gb energy = -7.700962788853226 eV
minimum distance =  2.3785853827084 Angstroms
sigma value = 365


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

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Energy: -3.919930560198428
Energy: -3.9649213246665598
Energy: -4.260037181281491
Energy: -4.895495256452668
Energy: -4.832147174640768
Energy: -4.439419643427596
Energy: -4.0867950357191924
Energy: -4.928985654666759
Energy: -4.367794935354525
Energy: -4.736505138090181
Energy: -4.88426199369276
Energy: -5.018383977320896
Energy: -4.862489305241864
Energy: -4.774033139253999
Energy: -4.399065229654247
Energy: -4.227632786796791
Energy: -4.307837364938096
Energy: -4.355303638966198
Energy: -4.339920852420574
Energy: -4.329182656936314
Energy: -4.419299383989556
Energy: -4.213835958501667
Energy: -4.046942207188291
Energy: -4.065928666855653
Energy: -4.239947325406328
Energy: -4.313031900266412
Energy: -4.344406801225141
Energy: -4.387527682079816
Energy: -4.863007739824263
Energy: -4.956908268314385
Energy: -4.481214469214527
Energy: -4.753195976011968
Energy: -4.687876117151187
Energy: -4.383312976244268
Energy: -4.570878154241794
Energy: -4.2032207849356755
Energy: -4.161458599734792
Energy: -4.233562644839683
Energy: -4.422122021815366
Energy: -4.300332732246964
Energy: -4.308587823143378
Energy: -4.248662055517903

minimum gb energy = -5.110413463048027 eV
minimum distance =  2.4085537759561 Angstroms
sigma value = 23