Model name: model_name=EAM_Dynamo_Marinica_2011_Fe__MO_255315407910_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=3.311687663197519
cohesive_energy=3.8792944251854573
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=[1.7961361373120397e-19, 3.02893094834334e-19, 3.8094793608954595e-19, 4.409846989187939e-19, 4.941433174582799e-19, 5.401658412699299e-19, 5.763942593179379e-19, 6.02701999648218e-19, 6.201577140756479e-19, 6.31078150012992e-19, 6.37339456298664e-19, 6.40327515721074e-19, 6.40880266659804e-19, 6.39382231507014e-19, 6.36075338934438e-19, 6.31640514011526e-19, 6.269445342972719e-19, 6.2283014470116e-19, 6.19925398463718e-19, 6.18630839743446e-19, 6.188214987628919e-19, 6.198837418712339e-19, 6.209924481019619e-19, 6.214827141519659e-19, 6.20766541196568e-19, 6.180508518019379e-19, 6.12289424626074e-19, 6.02367144731712e-19, 5.870967992330579e-19, 5.650572574557539e-19, 5.34555018697662e-19, 4.93556920810236e-19, 4.3991764928055e-19, 3.7171619432443796e-19, 2.8688414590740594e-19, 1.8347325724250998e-19, 5.89998341117232e-20, -9.0478919963565e-20, -2.70400952696814e-19, -5.16344679075618e-19]
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: 0.02183319516686286
Energy: -1.370699625250056
Energy: -0.03405107740952916
Energy: 0.6347505247515869
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Energy: -7.228173588419225
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Energy: -0.8581326530970836
Energy: 0.027231704054685765
Energy: -1.408292503501757
Energy: -1.6086621810042427
Energy: -1.2681808686665121
Energy: -6.872890001637344
Energy: -0.8849615443557192
Energy: -0.49516289791954576
Energy: -7.8995905830313475
Energy: -0.8935865749562986
Energy: -1.953147857628448
Energy: -1.3921129192901225
Energy: -7.229246341567845
Energy: -1.316978550578773
Energy: -0.8116081156721638
Energy: -1.306067278118038
Energy: -6.972446677252543
Energy: -1.3920893006825608
Energy: -1.4277319246651818
Energy: -7.665498959986596
Energy: -0.8297768804163448
Energy: -0.8152364906608902

minimum gb energy = -7.8995905830313475 eV
minimum distance =  2.3201098668526 Angstroms
sigma value = 5


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

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Energy: -0.7010906512411679

minimum gb energy = -1.5422817057214349 eV
minimum distance =  2.24669718592169 Angstroms
sigma value = 401


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

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minimum gb energy = -1.8363475458314729 eV
minimum distance =  2.24559019142308 Angstroms
sigma value = 311


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

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minimum gb energy = -5.511621659971859 eV
minimum distance =  2.21995146841513 Angstroms
sigma value = 39


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

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Energy: -0.17053269129455143
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Energy: -0.2949793612879328
Energy: -0.40549781408720176
Energy: -0.3885126742832707
Energy: -0.27455675994001466

minimum gb energy = -0.7157800521765075 eV
minimum distance =  2.26098955419585 Angstroms
sigma value = 21


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

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Energy: -0.018525131085157208

minimum gb energy = -0.3571438687599078 eV
minimum distance =  2.24677429537145 Angstroms
sigma value = 113


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

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minimum gb energy = -1.0152906708071165 eV
minimum distance =  2.23259697037204 Angstroms
sigma value = 365


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

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Energy: -0.2506781943110755
Energy: -5.849312523816779
Energy: -6.185984078885558
Energy: -5.970184249351203
Energy: 0.06573838761218843
Energy: -6.234160565510811
Energy: -6.003743989514364
Energy: 0.03733851080470219
Energy: -6.392083188900647
Energy: 0.16569100239782827
Energy: -5.996205643884965
Energy: 0.07786711802774358
Energy: 0.028524478889903185
Energy: 0.09990752252845234
Energy: 0.07088763696260353
Energy: -6.097431460124875
Energy: 0.09981485288657546
Energy: -6.045225722484282
Energy: -5.936106116760969
Energy: 0.026349989769666043
Energy: 0.05961157704861861
Energy: 0.1448171183180909
Energy: -6.036828745041258
Energy: 0.039797243673598305
Energy: -5.96289379590942
Energy: -6.190839717451679
Energy: -6.4935992794533
Energy: -6.1931685096707065
Energy: -6.273246652304797
Energy: -6.169847321885598
Energy: -0.023238560684103488
Energy: -5.92181575921501
Energy: -0.08082983867981991
Energy: 0.11941505645966177
Energy: 0.01413490151312961
Energy: -6.081801109228427
Energy: -5.862069268195806
Energy: -5.930645163768327
Energy: -6.200338941510094
Energy: -6.187744705934847
Energy: -6.101932024274028
Energy: -6.191206797741331
Energy: 0.12528835514565592
Energy: -6.229492021455573
Energy: -5.900071933680638
Energy: -6.135906223460118
Energy: 0.024550761270193684
Energy: -6.120130449345125
Energy: -6.166228751532239
Energy: 0.11412606691363085
Energy: -6.266483655621952
Energy: -0.014896195624863598
Energy: -6.05671918986781
Energy: 0.08132091339122617
Energy: 0.041454868992764626
Energy: 0.030169097588803977
Energy: 0.07042126362772107
Energy: -6.012586967804512
Energy: 0.14688567701938457
Energy: -6.107894866074886
Energy: -6.257297820597241
Energy: -6.359136938808886
Energy: -6.0024751977387165
Energy: -6.042920231051038
Energy: -6.064844820074127
Energy: 0.11531916861127695
Energy: -6.057689972186258
Energy: 0.06866535974642678
Energy: 0.16267628547825433
Energy: 0.04054973946056075
Energy: -6.413551591354762
Energy: -6.015438604879948

minimum gb energy = -6.4935992794533 eV
minimum distance =  2.36252773606881 Angstroms
sigma value = 23