Model name: model_name=EAM_Dynamo_HepburnAckland_2008_FeC__MO_143977152728_005
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=3.658403597772121
cohesive_energy=3.8927084027090397
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.016602373486744766
Energy: 0.10908756954419667
Energy: 0.10908756954419667
Energy: 0.01660237348533335
Energy: 0.10908756954419667
Energy: 0.10908756954419667
Energy: 0.01660237348533335
Energy: 0.10908756954419667
Energy: 0.10908756954419667
Energy: 0.01660237348533335
Energy: 0.10919398510833017
Energy: 0.017773652377420516
Energy: 0.10772057226934462
Energy: 0.10919398510833017
Energy: 0.0177736523760091
Energy: 0.10772057226934462
Energy: 0.10919398510833017
Energy: 0.017773652377420516
Energy: 0.10772057226934462
Energy: 0.1091939851097416
Energy: -2.1879580745111085
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Energy: -3.396825204881389
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Energy: 0.10772057226934462
Energy: 0.0177736523760091
Energy: 0.1091939851097416
Energy: 0.10772057226934462
Energy: 0.017773652377420516
Energy: 0.1091939851097416
Energy: 0.10772057226934462
Energy: 0.0177736523760091
Energy: 0.1091939851097416
Energy: 0.016602373483921937
Energy: 0.10908756954560808
Energy: 0.10908756954560808
Energy: 0.016602373483921937
Energy: 0.10908756954560808
Energy: 0.10908756954560808
Energy: 0.016602373483921937
Energy: 0.10908756954560808
Energy: 0.10908756954560808
Energy: 0.016602373483921937
Energy: 0.1091939851097416
Energy: 0.017773652377420516
Energy: 0.10772057227075603
Energy: 0.1091939851097416
Energy: 0.0177736523760091
Energy: 0.10772057226934462
Energy: 0.1091939851097416
Energy: 0.017773652377420516
Energy: 0.10772057227075603
Energy: 0.1091939851097416
Energy: -2.3350332646028633
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Energy: 0.5135496152411784
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Energy: -0.9297337188690836
Energy: -0.5854474729930856
Energy: -0.030411659156333454
Energy: -2.204280595641817

minimum gb energy = -3.396825204881389 eV
minimum distance =  2.2459759337237 Angstroms
sigma value = 3


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

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Energy: -1.8883204874016815

minimum gb energy = -4.868883341610172 eV
minimum distance =  2.33025180617478 Angstroms
sigma value = 75


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

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minimum distance =  2.19527362459675 Angstroms
sigma value = 105


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

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minimum gb energy = -2.8242018481519104 eV
minimum distance =  2.28454578238646 Angstroms
sigma value = 165


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

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Energy: -0.9243076049456939

minimum gb energy = -4.515779512733281 eV
minimum distance =  2.28579778321505 Angstroms
sigma value = 41


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

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minimum gb energy = -4.373559828102677 eV
minimum distance =  2.29171727829797 Angstroms
sigma value = 185


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

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minimum gb energy = -4.974244094715594 eV
minimum distance =  2.27052215638061 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
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Energy: -1.1996187683719555
Energy: -1.3813648285129314
Energy: -1.090125691597911
Energy: -1.1996388766857091

minimum gb energy = -1.7694704706663702 eV
minimum distance =  2.21443300522271 Angstroms
sigma value = 219


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

Energy: -0.4853985764408947
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Energy: -0.41433244204068764
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Energy: 0.5152975312933594

minimum gb energy = -1.3486024514516801 eV
minimum distance =  2.30842036846841 Angstroms
sigma value = 15


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

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minimum gb energy = -5.483432800013046 eV
minimum distance =  2.21401362349951 Angstroms
sigma value = 293


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

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minimum distance =  2.16862873164367 Angstroms
sigma value = 293


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

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Energy: 0.9043098797270568
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Energy: 0.9041191245116534
Energy: 0.9044491359018693
Energy: 0.9035060685419197
Energy: 0.90411834095138
Energy: 0.9044467539277359

minimum gb energy = 0.7064439915134246 eV
minimum distance =  2.33430291793047 Angstroms
sigma value = 15


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

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minimum gb energy = -2.697354164725802 eV
minimum distance =  2.24660051674563 Angstroms
sigma value = 437


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

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Energy: -1.419459058284186
Energy: -1.2945144927062449
Energy: 0.5838033806989122
Energy: -1.4161258079497
Energy: -1.294515161300576
Energy: 0.5838033803150573
Energy: -1.4161816056406724
Energy: 0.5727981405386546
Energy: -1.3924202738322775
Energy: -1.3184625169104678
Energy: 0.5727949370091197
Energy: -1.3919395386513567
Energy: -1.6015301811348728
Energy: 0.5727937453490107
Energy: -1.392803372889775
Energy: -1.214964995054439
Energy: 0.5728056728765155
Energy: -1.0523722108378482
Energy: -0.41951278974536327
Energy: -0.9427359899996336
Energy: -1.0523678716279465
Energy: -0.4355451650532973
Energy: -0.661492931729436
Energy: -1.0524449641111293
Energy: -0.46113214226800203
Energy: -0.9655644616254115
Energy: -1.052454923861406
Energy: -0.5196219027459387
Energy: -1.1410302407585906
Energy: -0.745462306082992
Energy: -0.4855475680393785
Energy: -1.1778674220991596
Energy: -1.7099452796160688
Energy: -0.5214251314917169
Energy: -1.1778674220984222
Energy: -1.7099184158677385
Energy: -0.6256947650192338
Energy: -0.746620335146822
Energy: -1.531361938569734
Energy: -1.1204641484116462
Energy: -0.748015442711531
Energy: -1.531178363870688
Energy: -1.1204640579095126
Energy: -0.7566440679251152
Energy: -1.5310906059455576
Energy: -1.120464083623174
Energy: -0.7475641012048977
Energy: -1.3011233744094297
Energy: 0.49746031728928314
Energy: -1.2644482105681354
Energy: -1.3228509286737693
Energy: 0.49746030340872177
Energy: -1.2721163790338512
Energy: -1.368201608528261
Energy: 0.4974601968459568
Energy: -1.2702271715568356
Energy: -1.3026610617544072
Energy: -1.0209873707781905
Energy: -1.208426229557467
Energy: -1.3372902381438587
Energy: -1.0189012978554868
Energy: -1.2084261210997507
Energy: -1.3372906482916036
Energy: -1.0221389477878204
Energy: -1.2084263379245548
Energy: -1.3372902295348124
Energy: -1.0188103193794635

minimum gb energy = -2.043355667945731 eV
minimum distance =  2.25891546150248 Angstroms
sigma value = 33