Model name: model_name=Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.607383415102959
cohesive_energy=8.271372594254219
mass=63.546
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: -0.08653224167969677
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Energy: 3.7491016004188262
Energy: -0.08553601661874852
Energy: 5.315564454110478

minimum gb energy = -590.7394277940926 eV
minimum distance =  2.34028969077035 Angstroms
sigma value = 3


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

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minimum gb energy = -306.0349208616011 eV
minimum distance =  2.33237081118542 Angstroms
sigma value = 75


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

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theta = 38.572650822227786
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minimum distance =  1.80373432529125 Angstroms
sigma value = 165


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

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sigma value = 41


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

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minimum distance =  2.35815130979389 Angstroms
sigma value = 185


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

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minimum gb energy = -806.5261469742208 eV
minimum distance =  2.41736285546495 Angstroms
sigma value = 33


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

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sigma value = 219


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

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minimum distance =  2.3240270277543 Angstroms
sigma value = 15


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

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minimum distance =  2.36726262061849 Angstroms
sigma value = 293


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

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minimum distance =  2.33117843028156 Angstroms
sigma value = 293


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

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sigma value = 15


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

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minimum distance =  2.27206142421894 Angstroms
sigma value = 437


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

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minimum gb energy = -325.4901680108127 eV
minimum distance =  2.25583575749736 Angstroms
sigma value = 33