Model name: model_name=EAM_MagneticCubic_MendelevHanSrolovitz_2003_Fe__MO_856295952425_002
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.658364951610565
cohesive_energy=4.002359338941917
mass=55.845
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=[1.0232253007741979e-19, 1.9428314299210798e-19, 2.53898533366614e-19, 3.0887882673895796e-19, 3.6379182869267398e-19, 4.1531142053557793e-19, 4.60053805216662e-19, 4.97378112082326e-19, 5.27651239581756e-19, 5.516999108580959e-19, 5.709148152296579e-19, 5.8641266981034e-19, 5.989897563872399e-19, 6.09229267255134e-19, 6.17571800988372e-19, 6.24308953734342e-19, 6.2962337362931995e-19, 6.33670471806804e-19, 6.365976485171219e-19, 6.38608380192792e-19, 6.3991735850277e-19, 6.4069441417026e-19, 6.410789365624199e-19, 6.41197497633336e-19, 6.41043688676472e-19, 6.404861312078399e-19, 6.39374220623844e-19, 6.375269109648419e-19, 6.34735919268414e-19, 6.308906953468139e-19, 6.2599444355331e-19, 6.200615834776079e-19, 6.1308089988327e-19, 6.04855325044314e-19, 5.949570777994619e-19, 5.82825396326814e-19, 5.675486421216239e-19, 5.47124094391392e-19, 5.17930833943278e-19, 4.751975787612299e-19, 4.1413862723948997e-19, 3.3286821747983995e-19, 2.31748441401564e-19, 1.152609074852868e-19, -8.68060902477834e-21, -1.542844828889712e-19, -3.48524687547288e-19, -6.210036633383999e-19, -1.04629343995053e-18, -1.7621539709049e-18, -2.98863620599824e-18, -5.1358733308850395e-18, -9.088186738701599e-18, -1.69832325380634e-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: 0.017051581772043835
Energy: 0.018211896365458443
Energy: -0.8362322852366036
Energy: -0.718637704244546
Energy: 0.01798354279324173
Energy: 0.017714592891210336
Energy: -0.629616548662164
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Energy: 0.017952832964064636
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Energy: -0.881833902556951
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Energy: -0.8790211686178079
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Energy: -0.9148119727024985
Energy: 0.020077266211958638
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Energy: -0.6577186562574288
Energy: -0.8628357416898117
Energy: 0.01805811767661336
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Energy: -0.7304675389504972
Energy: -0.7642345071271861
Energy: -0.8976056987671553
Energy: -0.6918712350924574
Energy: -0.7308785365203357
Energy: -1.001909670019087
Energy: 0.017818192940279087
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Energy: -0.8106101783242462
Energy: -0.8936455189985769
Energy: -0.931238499971838
Energy: -0.7336745762976588
Energy: -1.2506108327648937
Energy: -0.6935312368430534
Energy: -1.149434018845554
Energy: 0.020362977255821212
Energy: -0.9224958980491279
Energy: -0.8842709892393196
Energy: -1.151958399031755
Energy: -1.0194444245588008
Energy: 0.020310668936824476
Energy: -1.0178825035257764
Energy: -0.9236102044979971
Energy: -0.7392452395005034
Energy: -0.8791432587224862
Energy: -1.3414034213537698
Energy: -1.020094043442646
Energy: -0.9269727615681144
Energy: -1.1234137664797001
Energy: -0.8756281101612094
Energy: -1.2159004956739983
Energy: -1.0175026821717

minimum gb energy = -1.3513346506642565 eV
minimum distance =  2.34612011388575 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: -3.4511452160003087

minimum gb energy = -6.798117610838779 eV
minimum distance =  2.1019515626458 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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minimum distance =  2.23008106660505 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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minimum gb energy = -3.5599587720660937 eV
minimum distance =  2.20964523043132 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

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Energy: -1.7920724931409884

minimum gb energy = -2.1553099415250516 eV
minimum distance =  2.28820582165956 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

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minimum distance =  2.28584639496608 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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minimum gb energy = -4.300784717848473 eV
minimum distance =  2.24848889585883 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

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minimum gb energy = -2.92926590709405 eV
minimum distance =  2.28174904990143 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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minimum gb energy = -1.3657917528371466 eV
minimum distance =  2.26977967698201 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: -6.115319981440608
Energy: -5.664588661543348

minimum gb energy = -6.988578021592575 eV
minimum distance =  2.24226552599564 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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minimum gb energy = -3.5824644411256887 eV
minimum distance =  2.26363194758749 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

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minimum gb energy = -3.771180019749319 eV
minimum distance =  2.25857760443124 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

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minimum gb energy = -3.6926644324482933 eV
minimum distance =  2.20072300014103 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

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minimum gb energy = -4.029219300349729 eV
minimum distance =  2.25321122624573 Angstroms
sigma value = 33