Model name: model_name=EAM_Dynamo_LiuAdams_1998_AlMg__MO_019873715786_000 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Al Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=4.03203821182251 cohesive_energy=3.36023026856906 mass=26.981538 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: 0.011811678028527707 Energy: 0.17840748017847585 Energy: 0.1784074801796378 Energy: 0.011811678028527707 Energy: 0.1784074801796378 Energy: 0.17840748017847585 Energy: 0.011811678028527707 Energy: 0.17840748017847585 Energy: 0.1784074801796378 Energy: 0.01181167802968966 Energy: 0.17851069912646142 Energy: 0.012350529782048003 Energy: 0.7605665540761027 Energy: 0.17851069912529946 Energy: 0.012350529782048003 Energy: 0.7605665540772647 Energy: 0.17851069912529946 Energy: 0.012350529782048003 Energy: 0.7605665540761027 Energy: 0.17851069912529946 Energy: 0.9137079212703674 Energy: 0.01258167364852926 Energy: 0.012581673647367305 Energy: 0.831194147881831 Energy: 0.01258167364852926 Energy: 0.012581673647367305 Energy: 0.8395899325006851 Energy: 0.01258167364852926 Energy: 0.17208410466025348 Energy: 0.8337837107641988 Energy: 0.17851069912529946 Energy: 0.7605665540772647 Energy: 0.012350529782048003 Energy: 0.1785106991241375 Energy: 0.7605665540761027 Energy: 0.012350529780886051 Energy: 0.17851069912529946 Energy: 0.7605665540761027 Energy: 0.012350529782048003 Energy: 0.17851069912529946 Energy: 0.011811678028527707 Energy: 0.17840748017731392 Energy: 0.17840748017847585 Energy: 0.011811678028527707 Energy: 0.17840748017731392 Energy: 0.17840748017731392 Energy: 0.011811678028527707 Energy: 0.17840748017731392 Energy: 0.17840748017847585 Energy: 0.011811678028527707 Energy: 0.1785106991241375 Energy: 0.012350529780886051 Energy: 0.7605665540761027 Energy: 0.1785106991241375 Energy: 0.012350529780886051 Energy: 0.7605665540772647 Energy: 0.1785106991241375 Energy: 0.012350529782048003 Energy: 0.7605665540761027 Energy: 0.1785106991241375 Energy: 0.9137079212692052 Energy: 0.012581673647367305 Energy: 0.01258167364852926 Energy: 0.7966724182792779 Energy: 0.012581673647367305 Energy: 0.01258167364852926 Energy: 0.8532414861612377 Energy: 0.012581673647367305 Energy: 0.17208410465909152 Energy: 0.8337837107665226 minimum gb energy = 0.011811678028527707 eV minimum distance = 2.5428770939302 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 0.51825740306215 Energy: 0.6413623613861861 Energy: 0.6203230750287666 Energy: 0.4850547407301864 Energy: 0.6413623613890322 Energy: 0.6203230750290512 Energy: 0.5182574030578806 Energy: 0.6413623613904553 Energy: 0.6203230750321821 Energy: 0.4850547407301864 Energy: 0.5940218632400445 Energy: 0.5029004074559508 Energy: 0.6152067323490739 Energy: 0.5940218632244163 Energy: 0.5029004074533892 Energy: 0.6152067323496431 Energy: 0.5940218631922543 Energy: 0.5029004074568046 Energy: 0.6152067323465124 Energy: 0.5940218632164469 Energy: 0.5698006850910248 Energy: 0.5953143560812464 Energy: 0.624288398998576 Energy: 0.5859212651488342 Energy: 0.595314356087508 Energy: 0.6242883964250489 Energy: 0.5698006850941555 Energy: 0.5953143560852311 Energy: 0.6242883993720998 Energy: 0.5859212651505419 Energy: 0.6197417893650609 Energy: 0.6423995814179195 Energy: 0.49039543807355 Energy: 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0.5888651408548196 Energy: 0.5418287853495946 Energy: 0.5605037797994524 Energy: 0.5845578352869643 Energy: 0.5418287853412969 Energy: 0.5605037798011179 Energy: 0.5845578352952921 Energy: 0.5418287853429624 Energy: 0.5605037797994524 Energy: 0.5845578352986235 Energy: 0.5418287853446281 Energy: 0.5369282260521159 Energy: 0.5860652848655397 Energy: 0.5975052757409418 Energy: 0.5369282260587784 Energy: 0.586065284863874 Energy: 0.5975052757376106 Energy: 0.5369282260554472 Energy: 0.5860652848672052 Energy: 0.5975052757376106 Energy: 0.5369282260587784 minimum gb energy = 0.5289095236751163 eV minimum distance = 2.57904737261022 Angstroms sigma value = 437 ======================================== theta = 117.03569178941231 ======================================== Energy: 0.5363880058150532 Energy: 0.5464798201265427 Energy: 0.546459225243252 Energy: 0.5363880058144465 Energy: 0.54647982012897 Energy: 0.546459225243252 Energy: 0.5363880058150532 Energy: 0.5464798201265427 Energy: 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0.6171010985050083 Energy: 0.5404463239823676 Energy: 0.619417882560393 Energy: 0.5409037939708181 Energy: 0.5404463239835812 Energy: 0.619417882557359 Energy: 0.5409037939696045 Energy: 0.5404463239823676 Energy: 0.6194178825585726 Energy: 0.5409037939708181 Energy: 0.5404463239835812 Energy: 0.6432675044351234 Energy: 0.5694064194616173 Energy: 0.567224951920903 Energy: 0.6432675044339097 Energy: 0.569406419462831 Energy: 0.5672249519202962 Energy: 0.6432675044351234 Energy: 0.5694064194616173 Energy: 0.5672249519202962 Energy: 0.6432675044345164 minimum gb energy = 0.5243148355848304 eV minimum distance = 2.55841554913628 Angstroms sigma value = 33