Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Pt__MO_757342646688_000 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Pt Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.9200000882148758 cohesive_energy=5.7704537908209055 mass=195.084 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=120.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4434970601686398e-19, 2.43348200231724e-19, 3.27387171214926e-19, 4.00798904584806e-19, 4.6584887810184e-19, 5.23958222440386e-19, 5.76112276230354e-19, 6.230352233103119e-19, 6.652894276787939e-19, 7.0331548791015e-19, 7.374787002769319e-19, 7.6807706963306395e-19, 7.9539097688949595e-19, 8.19571026649824e-19, 8.408735671754879e-19, 8.59442794363548e-19, 8.75426108464332e-19, 8.889564901384619e-19, 9.00147693926952e-19, 9.09110270017548e-19, 9.159371446550219e-19, 9.20718039730878e-19, 9.23533064076816e-19, 9.24455917818e-19, 9.2345455742175e-19, 9.2019412797156e-19, 9.14237235246348e-19, 9.050599674867958e-19, 8.92024658392572e-19, 8.74368671885892e-19, 8.511531324592319e-19, 8.212404947024519e-19, 7.832240475308999e-19, 7.35368633649954e-19, 6.755065080738119e-19, 6.00917174877942e-19, 5.08159158652512e-19, 3.9283929106709396e-19, 2.4928426466069395e-19, 7.010147622637259e-20, -1.54468252548891e-19, -4.37483942973504e-19, -7.966871377864019e-19, -1.25657912316303e-18, -1.8516996229791598e-18, -2.6318635131391197e-18, -3.6706988208583795e-18, -5.0805982370120394e-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: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.021412159229536626 Energy: 0.026969255888284874 Energy: 0.10688520185894691 Energy: 0.10544702660191334 Energy: 0.026049605302734362 Energy: 0.022802349419188007 Energy: 0.022802349419188007 Energy: 0.10802805374846729 Energy: 0.10585879529463375 Energy: 0.025941921451441585 Energy: 0.02714064782459338 Energy: 0.1101464324200626 Energy: 0.10735670084752309 Energy: 0.10677400809476514 Energy: 0.10682091766080408 Energy: 0.10682091766080408 Energy: 0.11001264183042322 Energy: 0.10743732805110742 Energy: 0.10685693616397489 Energy: 0.10589657588912402 Energy: 0.10671357489699969 Energy: 0.028756406687662415 Energy: 0.02184413975883725 Energy: 0.10413211725345176 Energy: 0.10580438835602604 Energy: 0.10673068198146385 Energy: 0.027596265203514752 Energy: 0.02194774809632836 Energy: 0.10395182933882825 Energy: 0.10620743530116473 Energy: 0.10587698709018868 Energy: 0.023447745456905908 Energy: 0.032701440373976716 Energy: 0.10891585164865385 Energy: 0.10443941571538798 Energy: 0.10689791092126022 Energy: 0.023582481445076547 Energy: 0.03458382752591194 Energy: 0.1081833454290845 Energy: 0.10419065247072153 Energy: 0.10546320037778412 Energy: 0.10525880065089627 Energy: 0.10707136560469221 Energy: 0.029749668192361578 Energy: 0.023463290889320865 Energy: 0.10468773319672134 Energy: 0.10569529531804232 Energy: 0.10687167327154276 Energy: 0.028441565277876772 Energy: 0.028441565277876772 Energy: 0.1074346866103975 Energy: 0.10432942204928276 Energy: 0.10517718839369279 Energy: 0.022546586903739004 Energy: 0.025878984719795647 Energy: 0.10836842089300473 Energy: 0.10343393550889568 Energy: 0.1053757802714854 Energy: 0.023102517960592955 Energy: 0.026515632499093323 Energy: 0.02657066240158656 Energy: 0.10842793884885625 Energy: 0.10551392039701568 Energy: 0.10845938555259524 Energy: 0.10845938555259524 Energy: 0.026319177754884755 Energy: 0.10812088537426034 Energy: 0.10524340547083592 Energy: 0.1090497155949728 Energy: 0.1090497155949728 minimum gb energy = 0.021412159229536626 eV minimum distance = 2.72588460339631 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 0.8052988805532677 Energy: 0.7729855960899599 Energy: 0.7374640106370651 Energy: 0.7382735486283318 Energy: 0.7375922797585418 Energy: 0.7958671080887221 Energy: 0.7383924085540229 Energy: 0.7392115557623911 Energy: 0.7378884782880447 Energy: 0.7720081542535606 Energy: 0.7664808141175613 Energy: 0.8593816289090931 Energy: 0.7387506512239712 Energy: 0.7396843163808996 Energy: 0.7211326880945282 Energy: 0.717439181626888 Energy: 0.8245275758224943 Energy: 0.7379894262701282 Energy: 0.7400294556723324 Energy: 0.7214280177812922 Energy: 0.8083255509963265 Energy: 0.8378615985959917 Energy: 0.6937432958836398 Energy: 0.7217564399985588 Energy: 0.7217564399985588 Energy: 0.7215505178413523 Energy: 0.8381032212896569 Energy: 0.6945515063151321 Energy: 0.749562566915802 Energy: 0.749562566915802 Energy: 0.7482089134166763 Energy: 0.7482089134166763 Energy: 0.8351462144253312 Energy: 0.7194331102802983 Energy: 0.7194331102802983 Energy: 0.7226930557665121 Energy: 0.7226930557665121 Energy: 0.7753974089218001 Energy: 0.7507783633110363 Energy: 0.7507783633110363 Energy: 0.9027764867685312 Energy: 0.7798078544249841 Energy: 0.8797748317669184 Energy: 0.8797748317669184 Energy: 0.7668364148368683 Energy: 0.7783690970282698 Energy: 0.778757031258472 Energy: 0.8234849407724052 Energy: 0.8234849407724052 Energy: 0.874316134228145 Energy: 0.851430613631076 Energy: 0.7775738922710871 Energy: 0.8719599244524986 Energy: 0.8719599244524986 Energy: 0.8548249124107479 Energy: 0.8896845467960932 Energy: 0.7938736327078562 Energy: 0.8717692668908519 Energy: 0.8717692668908519 Energy: 0.8740559135650239 Energy: 0.8179874951410963 Energy: 0.8118860097377566 Energy: 0.8736236364941513 Energy: 0.7656962076088194 Energy: 0.8181515836770428 Energy: 0.8195418173517123 Energy: 0.7378542959117427 Energy: 0.8258274183794438 Energy: 0.7672366741315528 Energy: 0.8128864368885992 Energy: 0.8102987044146243 Energy: 0.8200110266903782 Energy: 0.8200110266903782 Energy: 0.8200110266903782 Energy: 0.8180463350283778 Energy: 0.8158014260145326 Energy: 0.8122752844196095 Energy: 0.8617519531667809 Energy: 0.8106504210213893 Energy: 0.8118645651635111 Energy: 0.8145549255424385 Energy: 0.7469958471651834 Energy: 0.7660945996911083 Energy: 0.8749369584293045 Energy: 0.7395710609426993 Energy: 0.8173334591671753 Energy: 0.7434474460120396 Energy: 0.767282020403892 Energy: 0.7978001605245554 Energy: 0.8104467301450764 Energy: 0.8935381305186019 Energy: 0.798912339048708 Energy: 0.7676957121136929 Energy: 0.8032879150822392 Energy: 0.8481119985332644 Energy: 0.8481119985332644 Energy: 0.7979160330886336 Energy: 0.7688175526301121 Energy: 0.7688175526301121 Energy: 0.6921148006553172