Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Cu__MO_759493141826_000 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.614958965778353 cohesive_energy=3.5402732499842564 mass=63.546 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=[1.4503143217463098e-19, 2.16689583218598e-19, 2.71517669810712e-19, 3.14797267224954e-19, 3.5145987514077595e-19, 3.8389113456620394e-19, 4.1236982423555394e-19, 4.36995279100134e-19, 4.58172849848346e-19, 4.763799851171219e-19, 4.920412617144719e-19, 5.05497943263438e-19, 5.1704002373477395e-19, 5.26912636153482e-19, 5.35336880895054e-19, 5.42503416978936e-19, 5.485740642451619e-19, 5.536769968244519e-19, 5.579019366083099e-19, 5.61300153249024e-19, 5.639020881026399e-19, 5.65733375995302e-19, 5.668132430466179e-19, 5.671673240827319e-19, 5.667908125737419e-19, 5.65577964861804e-19, 5.63434252525512e-19, 5.60266749320094e-19, 5.557069546197299e-19, 5.4941040044811e-19, 5.410550493017999e-19, 5.30285217968052e-19, 5.16698760111732e-19, 4.998310445089799e-19, 4.7913893328087e-19, 4.53949512241122e-19, 4.23389595124206e-19, 3.8624953857145196e-19, 3.40834239704088e-19, 2.84828553285984e-19, 2.15207569832148e-19, 1.281053973424014e-19, 1.8459798523957798e-20, -1.210232959671312e-19, -3.02069576044458e-19, -5.43419862013584e-19, -8.715424323035158e-19, -1.322185051972062e-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: 0.015465009545388816 Energy: 0.10206032847489432 Energy: 0.10370466718199385 Energy: 0.10339201518931787 Energy: 0.019586598221239107 Energy: 0.017131805302552844 Energy: 0.10196230247137861 Energy: 0.1038069732344232 Energy: 0.1029628117871734 Energy: 0.018938163958421707 Energy: 0.10193530463120583 Energy: 0.10144733438920225 Energy: 0.10265479880327605 Energy: 0.103490298080472 Energy: 0.10343644025527174 Energy: 0.10221936797574097 Energy: 0.1016883538450336 Energy: 0.10228584250088624 Energy: 0.1034613388497377 Energy: 0.10294049122828529 Energy: 0.10365616797139734 Energy: 0.0196404016328629 Energy: 0.016107311198709378 Energy: 0.10176755588976144 Energy: 0.10389971711062408 Energy: 0.10379097093030615 Energy: 0.018947835637956108 Energy: 0.016206109373630716 Energy: 0.10167190621932048 Energy: 0.10345394929424975 Energy: 0.10290569860557648 Energy: 0.017373856325741913 Energy: 0.017134611014192714 Energy: 0.10135270082425694 Energy: 0.10233989028298994 Energy: 0.10329107566716883 Energy: 0.017958275017416033 Energy: 0.016464049225572996 Energy: 0.1012976170187105 Energy: 0.10227826671057229 Energy: 0.10252299349964589 Energy: 0.10294595974933737 Energy: 0.10401598054541643 Energy: 0.01758870835244058 Energy: 0.016421976844028914 Energy: 0.10227209882961634 Energy: 0.103500541426706 Energy: 0.10348368246202252 Energy: 0.01863889382207075 Energy: 0.10148013899617905 Energy: 0.10418338497403128 Energy: 0.1027852941040798 Energy: 0.10229982376891764 Energy: 0.01686216534139677 Energy: 0.020597004436257598 Energy: 0.1014683287739028 Energy: 0.10185405289078357 Energy: 0.10287058122383967 Energy: 0.01751607301770829 Energy: 0.016476604297562345 Energy: 0.016430548605125557 Energy: 0.10435886158603595 Energy: 0.10297429432592284 Energy: 0.103596515541145 Energy: 0.10412128432106497 Energy: 0.021061130123736838 Energy: 0.10454936885921541 Energy: 0.102623283464775 Energy: 0.10416630753009652 Energy: 0.10372164562124392 minimum gb energy = 0.015465009545388816 eV minimum distance = 2.52305190909577 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 1.3150598008333831 Energy: 0.6505751715205358 Energy: 0.6848752735963598 Energy: 0.6523562067277909 Energy: 0.6512282139682376 Energy: 0.702048225502461 Energy: 0.6510715368538438 Energy: 0.6858636890261106 Energy: 0.6513599212709763 Energy: 0.6709250133314816 Energy: 0.7031635174368375 Energy: 0.7856176413637437 Energy: 0.6530230758380405 Energy: 0.7404898162064429 Energy: 0.6703383497964112 Energy: 0.6125922178391183 Energy: 0.8245500932473048 Energy: 0.6843798483563714 Energy: 0.579670433782105 Energy: 0.6967710706841665 Energy: 0.6446260408603449 Energy: 0.7467174582506735 Energy: 0.5832400668171922 Energy: 0.6136188546531538 Energy: 0.6162740951152935 Energy: 0.615687204897126 Energy: 0.7451810441273756 Energy: 0.5819058084117462 Energy: 0.6149281476876138 Energy: 0.6964717319058812 Energy: 0.617341676479808 Energy: 0.7717425634411652 Energy: 0.5825079018962698 Energy: 0.6143153675083084 Energy: 0.6162743827990215 Energy: 0.6148559450291134 Energy: 0.6886983069881474 Energy: 0.582378049970892 Energy: 0.6508193191228284 Energy: 0.6167138830562453 Energy: 0.7066787934021321 Energy: 0.6736143335144389 Energy: 0.7262201702122618 Energy: 0.6694106979529749 Energy: 0.6631848729650309 Energy: 0.6909354187154435 Energy: 0.6716095879181461 Energy: 0.7759479682020269 Energy: 0.6695671366907308 Energy: 0.6627003586157683 Energy: 0.7880921422100885 Energy: 0.6724120709017422 Energy: 0.7264897324383679 Energy: 0.6639776064728362 Energy: 0.8402508688539004 Energy: 0.6740477340533106 Energy: 0.6721657329845737 Energy: 0.7755599195954287 Energy: 0.6651501800185324 Energy: 0.77853951432459 Energy: 0.7074925910634279 Energy: 0.705044395388473 Energy: 0.7776872284737719 Energy: 0.660812197365484 Energy: 0.70487295189367 Energy: 0.7076422925201281 Energy: 0.7880547880296901 Energy: 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0.6721041242830595 minimum gb energy = 0.576630670237782 eV minimum distance = 2.27230416933188 Angstroms sigma value = 75 ======================================== theta = 34.04773236999154 ======================================== Energy: 1.6014600718955523 Energy: 0.8177403008446836 Energy: 0.7354355171701009 Energy: 0.7269503169012095 Energy: 0.81618346715988 Energy: 0.8127657559343472 Energy: 0.8155863726237218 Energy: 0.7366503805794601 Energy: 0.7518016011862034 Energy: 0.8145021419236507 Energy: 0.7751650383515486 Energy: 0.7134719351256096 Energy: 0.7517426526303351 Energy: 0.751239667080453 Energy: 0.6959100745033515 Energy: 0.7312434626702701 Energy: 0.6736322373343475 Energy: 0.7379267844081387 Energy: 0.7504610622995088 Energy: 0.6930540637549077 Energy: 0.7507135287035682 Energy: 0.8480781508131465 Energy: 0.8433199694280904 Energy: 0.7828760623847708 Energy: 0.7688895532097119 Energy: 0.7227603924665527 Energy: 0.847563669307574 Energy: 0.8434731799521318 Energy: 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0.8495914776197193 Energy: 0.8430702665036832 Energy: 0.8487907363336761 Energy: 0.8518323846442056 Energy: 0.9051686291335015 Energy: 0.9161508767880295 Energy: 0.842315365851287 Energy: 0.8454613325652839 Energy: 0.9262986854706587 Energy: 0.9078210148814296 Energy: 0.8910970036368006 Energy: 0.8417770104174255 Energy: 0.8455368070724798 Energy: 0.9045357924460484 Energy: 0.839124079537801 Energy: 0.8472071314102716 Energy: 0.897690308697408 Energy: 0.9070277930926985 Energy: 0.9003425746781774 Energy: 0.8384670659821147 Energy: 0.8553624084178183 Energy: 0.9143491809698632 Energy: 0.9195134480004747 Energy: 0.8501275687448275 Energy: 0.8460083461900941 Energy: 0.8922854558877331 Energy: 1.032976150448611 Energy: 0.8471781312499496 Energy: 0.8336487661184646 Energy: 0.8321424671566537 Energy: 0.9000216000728558 Energy: 1.0565315511190831 Energy: 0.8485915379953247 Energy: 0.8531461033824591 Energy: 0.8450642270287032 Energy: 0.8560782363074787 Energy: 0.8426455154104306 Energy: 0.8344401133278653 Energy: 0.8651982377949323 Energy: 0.864841837366653 Energy: 0.8406944990441995 Energy: 0.8444701202521094 Energy: 0.8458139017747174 Energy: 0.8497369429500705 Energy: 0.8373608782148022 Energy: 0.8691686937698436 Energy: 0.9955799506694607 Energy: 0.9077561161024325 Energy: 0.8351688083317278 Energy: 0.8380293109858462 Energy: 0.8701315344291317 Energy: 0.9173448257985458 Energy: 0.9289724969589795 Energy: 0.8516037449392053 Energy: 0.9420877511838212 Energy: 0.89388069605089 Energy: 0.8998833251552707 Energy: 0.8256670993080827 Energy: 0.8463292107962415 Energy: 0.9387299784810336 Energy: 0.8424499154299344 Energy: 0.8831971395676994 Energy: 0.8308412660150097 minimum gb energy = 0.8256670993080827 eV minimum distance = 2.29830250634136 Angstroms sigma value = 437 ======================================== theta = 117.03569178941231 ======================================== Energy: 1.22370685068424 Energy: 0.8019232913708614 Energy: 0.8762608530857139 Energy: 0.8578548605437778 Energy: 0.9454997044285237 Energy: 1.2230518240227368 Energy: 0.8031925838425922 Energy: 0.904416013349941 Energy: 0.7607266061486556 Energy: 0.8986546039516794 Energy: 0.7623185658020422 Energy: 0.8149577771665343 Energy: 0.7594383979246987 Energy: 0.9442571476229791 Energy: 0.7889096143683644 Energy: 0.7610159720431325 Energy: 0.8175795018289017 Energy: 0.7588261067823135 Energy: 0.88122413477631 Energy: 0.7880504862222185 Energy: 0.8565972499552151 Energy: 0.8685813617867133 Energy: 0.7869253872545157 Energy: 0.7867664655297879 Energy: 0.761592423312261 Energy: 0.8560532103508571 Energy: 0.8696988574685739 Energy: 0.7879391787904997 Energy: 0.7881118751693066 Energy: 0.8554953124220536 Energy: 0.7888091388292104 Energy: 0.7925521647110628 Energy: 0.9077930594411059 Energy: 0.8553574268681675 Energy: 0.7619031698714402 Energy: 0.7898763295291884 Energy: 0.7870098050182749 Energy: 0.88100816116066 Energy: 0.8560863441027079 Energy: 0.7620166527324792 Energy: 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0.788519635173418 Energy: 0.7922108396818822 Energy: 0.8807033751902 Energy: 0.7880696739116625 Energy: 0.7846721372412385 Energy: 0.8016763631231292 Energy: 0.7919532953501104 Energy: 0.7887478573796598 Energy: 0.7870662158629241 Energy: 0.8798433645950797 Energy: 0.8003135049026235 Energy: 0.8496566903329961 Energy: 0.7873606241328156 Energy: 0.8061292292887551 Energy: 0.7849482515396897 Energy: 0.7615331896496038 Energy: 0.7591695463209792 Energy: 0.8010662628735818 Energy: 0.8595039292920809 Energy: 0.7856919655126302 Energy: 0.7618697113835549 Energy: 0.9098090387373713 Energy: 0.801475687688169 Energy: 0.7624337116263595 Energy: 0.7589612686375952 Energy: 0.8047668610268407 Energy: 0.8135923499627596 Energy: 0.7661037639345151 Energy: 0.7601342381015431 Energy: 0.7583757730799111 Energy: 0.8090698398999772 Energy: 0.814031452782469 Energy: 0.7895686898094302 Energy: 0.7618300140472883 Energy: 0.7577202857841083 Energy: 0.7586622723140616 Energy: 0.884118394910069 Energy: 0.7610565783664966 Energy: 0.7605512693379739 Energy: 0.7581807945626194 Energy: 0.7584586216580148 Energy: 0.8850380471777479 Energy: 0.7601015141187754 Energy: 0.7620129051876958 Energy: 0.762888007266373 Energy: 0.7802758533407025 Energy: 0.8800852302390563 Energy: 0.8082764117233449 Energy: 0.7626512270660032 Energy: 0.7641850814652543 Energy: 0.7851088662822264 Energy: 0.8790557298113768 Energy: 0.7613675317487075 Energy: 0.7580417412328312 Energy: 0.8068615864691985 Energy: 0.9012476822005537 Energy: 0.7869469033534189 Energy: 0.7681187422980563 Energy: 0.7596090950836066 Energy: 0.8053313344525131 Energy: 0.9374527245907985 Energy: 0.7875159428524509 Energy: 0.8058830322467355 minimum gb energy = 0.7577202857841083 eV minimum distance = 2.37535210589338 Angstroms sigma value = 33