Model name: model_name=EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Fe Lattice type: short_name=bcc Lattice constant (meters) and cohesive energy (J): a=2.86696694791317 cohesive_energy=4.004851223003315 mass=55.845 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: 0.013911705273433678 Energy: -1.2167727398551036 Energy: -0.6472936806022556 Energy: -0.014274372618056521 Energy: -0.6472936639495783 Energy: -1.2066139036788543 Energy: 0.013911705273224748 Energy: -1.2083965648688806 Energy: -0.647293704021325 Energy: -1.8180950711835635 Energy: 0.19462124540946685 Energy: -1.5067250357172333 Energy: -0.011926222535317487 Energy: 0.18867773137015176 Energy: -0.011926222535317487 Energy: -1.4750698542067995 Energy: 0.19462124540925793 Energy: -1.4876442724319152 Energy: -0.011926222535317487 Energy: 0.18867773137015176 Energy: 0.013911705273224748 Energy: -1.388167116807391 Energy: -0.647293668771411 Energy: -0.014274372618291566 Energy: -0.647293681909136 Energy: -1.1919966706669645 Energy: 0.013911705273224748 Energy: -1.3303170102884143 Energy: -0.6472936874718068 Energy: -1.7318778045200838 Energy: 0.19462124540925793 Energy: -1.4740237729797472 Energy: -0.011926222535526417 Energy: 0.18867773137015176 Energy: -0.011926222535317487 Energy: -1.4688632062127893 Energy: 0.19462124540925793 Energy: -1.5296815447426055 Energy: -0.011926222535526417 Energy: 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======================================== theta = 23.07391806563098 ======================================== Energy: -0.9796946709540388 Energy: -1.8198194286042928 Energy: -1.1707969851135582 Energy: -2.088418047969282 Energy: -1.2082739803706275 Energy: -1.8287212656020144 Energy: -0.9796946718037317 Energy: -1.8198194285182132 Energy: -1.1707969850516853 Energy: -1.8917246599470912 Energy: -1.3115301575110825 Energy: -1.6093960721278238 Energy: -1.2383636076595834 Energy: -1.5425745750254283 Energy: -1.6609640354010489 Energy: -1.3932424191360697 Energy: -1.3115301575324232 Energy: -1.609396072126698 Energy: -1.2383792915204208 Energy: -1.5425745750248654 Energy: -1.3490426867189038 Energy: -1.7255049260950366 Energy: -1.6614717698425991 Energy: -1.739134475267075 Energy: -1.2446435734724197 Energy: -1.490770122045967 Energy: -1.3490426867234075 Energy: -1.7255049175088533 Energy: -1.6614708084169139 Energy: -1.739134475266512 Energy: -1.8593579201288397 Energy: -1.4543903053165876 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