Model name: model_name=Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
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=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: -0.09355317854052377
Energy: 5.673684423734346
Energy: 2.3716765496967698
Energy: 5.672728761266446
Energy: -0.09355317852795234
Energy: 5.673684423729317
Energy: 5.353744549241624
Energy: 2.3707850702268733
Energy: -0.09326823933760554
Energy: 1.159508014500953
Energy: -0.09345466057589753
Energy: 2.3707850702268733
Energy: -0.09326823933760554
Energy: 1.1595080144984389
Energy: -0.09355317854052377
Energy: 5.673684423734346
Energy: 2.3716765496967698
Energy: 5.672728761266446
Energy: -0.09355317852795234
Energy: 5.673684423729317
Energy: 5.353744549239109
Energy: 2.370785070224359
Energy: -0.09326823933760554
Energy: 1.159508014500953
Energy: -0.09345466057589753
Energy: 2.3707850702268733
Energy: -0.09326823933760554
Energy: 1.1595080144984389
Energy: -0.09355317854052377
Energy: 5.673684423734346
Energy: 5.594021668818862
Energy: 5.672728761263932
Energy: -0.09355317852795234
Energy: 5.673684423729317
Energy: 5.353744549241624
Energy: 2.3707850702268733
Energy: -0.09326823933760554
Energy: 1.159508014500953
Energy: -0.09345466057589753
Energy: 2.3707850702268733
Energy: -0.09326823933509125
Energy: 1.1595080144984389

minimum gb energy = -0.09355317854052377 eV
minimum distance =  2.53131377754099 Angstroms
sigma value = 5


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

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minimum gb energy = -127.09908065634897 eV
minimum distance =  2.0888372440908 Angstroms
sigma value = 401


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

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Energy: -139.10645468075475

minimum gb energy = -450.9611769437308 eV
minimum distance =  2.28075734594804 Angstroms
sigma value = 311


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

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minimum gb energy = -169.3846378218077 eV
minimum distance =  2.04582084255993 Angstroms
sigma value = 39


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

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minimum gb energy = -409.7498837805549 eV
minimum distance =  2.31814368719906 Angstroms
sigma value = 21


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

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minimum gb energy = -618.4842411397688 eV
minimum distance =  2.17846766457188 Angstroms
sigma value = 113


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

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minimum gb energy = -133.94857553541488 eV
minimum distance =  2.12586470501547 Angstroms
sigma value = 365


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

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minimum gb energy = -624.3671082300303 eV
minimum distance =  2.16166097328749 Angstroms
sigma value = 23