Model name: model_name=EAM_Dynamo_SchopfBrommerFrigan_2012_AlMnPd__MO_137572817842_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.210718545317654
cohesive_energy=3.6305175345031104
mass=26.981538
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=[4.43008248007536e-19, 4.779020529194219e-19, 4.93827688661382e-19, 5.029969455377639e-19, 5.09421673840104e-19, 5.14846643922828e-19, 5.20167472524342e-19, 5.25805532099388e-19, 5.31829716243228e-19, 5.38087818175632e-19, 5.44344317931402e-19, 5.50360491192072e-19, 5.55952087644732e-19, 5.609957396885639e-19, 5.6543216678811e-19, 5.6924855153029795e-19, 5.72460915681468e-19, 5.751093136574699e-19, 5.772386064040559e-19, 5.7889846139688e-19, 5.801321374050599e-19, 5.80978086667812e-19, 5.81468352717816e-19, 5.81626968204582e-19, 5.814571374813779e-19, 5.809043865426479e-19, 5.79896617439862e-19, 5.78344108281516e-19, 5.76139513233132e-19, 5.73148249457454e-19, 5.6921330364435e-19, 5.64144016774374e-19, 5.5770166452906e-19, 5.495930485843859e-19, 5.394304421949239e-19, 5.26686729248088e-19, 5.10644134611846e-19, 4.90301297889948e-19, 4.64273938470618e-19, 4.3066027268929796e-19, 3.8685516133910393e-19, 3.2931619188226195e-19, 2.5327368447935397e-19, 1.522801599198372e-19, 1.7287165445533197e-20, -1.6553368547161198e-19, -4.1953956467270398e-19, -7.860807284693219e-19, -1.338200409605526e-18, -2.2087927511650796e-18]
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: -0.09604918 eV

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theta = 0.0
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Energy: 0.012639194850736708
Energy: -2049.6969191257663