Model name: model_name=EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_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=2.8169555217027673
cohesive_energy=3.976967959450982
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 0.015473192487946829
Energy: -2.4312742641035627
Energy: 0.015473192487548562
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Energy: -1.3310361666115786
Energy: -2.7146241873855206
Energy: -1.3310361142363158
Energy: -2.6955303357854454

minimum gb energy = -3.169049659474769 eV
minimum distance =  2.34898763478362 Angstroms
sigma value = 5


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

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minimum gb energy = -3.360552640899167 eV
minimum distance =  2.30386612984663 Angstroms
sigma value = 401


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

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Energy: -2.466260225051785
Energy: -2.6271668539936766
Energy: -2.4662602247591847
Energy: -2.627166853995392
Energy: -2.466260225089523

minimum gb energy = -2.903476578753655 eV
minimum distance =  2.31489960126896 Angstroms
sigma value = 311


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

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Energy: -1.2726057397540935
Energy: -1.20753461479162
Energy: -1.2726057399316397
Energy: -1.2075346148318649

minimum gb energy = -1.5690269102300822 eV
minimum distance =  2.16640056311117 Angstroms
sigma value = 39


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

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Energy: -1.726659022453316
Energy: -1.9373192818121727
Energy: -1.726659022354426
Energy: -1.9373192817895752

minimum gb energy = -2.2390609684971627 eV
minimum distance =  2.31878150354262 Angstroms
sigma value = 21


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

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Energy: -1.653898772420879
Energy: -1.7190705389379732
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minimum gb energy = -1.7906064169329194 eV
minimum distance =  2.31566320226642 Angstroms
sigma value = 113


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

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minimum gb energy = -3.391006191925356 eV
minimum distance =  2.29763728782737 Angstroms
sigma value = 365


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

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Energy: 0.277027301618727
Energy: -1.0425758816565716
Energy: -1.030361750443504
Energy: -1.042575881658952
Energy: -1.0303617505482212
Energy: -1.0425758816565716
Energy: -1.0303617504934957
Energy: -1.0425758816577617
Energy: 0.2768128267649103
Energy: -0.4172123987257463
Energy: 0.2770680367875752
Energy: -0.41721239874952465
Energy: 0.27700288826257374
Energy: -0.4172123987174142
Energy: 0.2770852576430888

minimum gb energy = -1.0425758816613326 eV
minimum distance =  2.27028246206734 Angstroms
sigma value = 23