Model name: model_name=EAM_Dynamo_MendelevFangYe_2015_AlSm__MO_338600200739_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=4.040926471352577 cohesive_energy=3.905455928316686 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=[2.96918578166148e-19, 3.6131165926324195e-19, 4.0193484781831197e-19, 4.33433640442752e-19, 4.596692828245019e-19, 4.818321922026239e-19, 5.00662574182026e-19, 5.1677406241352995e-19, 5.307322252489379e-19, 5.4316191157551e-19, 5.5460465709553795e-19, 5.654401776712799e-19, 5.75812669199796e-19, 5.855138487186659e-19, 5.942473135506e-19, 6.01819200322884e-19, 6.081686263234259e-19, 6.133404524979779e-19, 6.17440422504384e-19, 6.20590301766828e-19, 6.229054470029579e-19, 6.244771822809119e-19, 6.25382412079122e-19, 6.256740082265099e-19, 6.2536158378288e-19, 6.243490081501919e-19, 6.225033006678239e-19, 6.1964982408267e-19, 6.1557228454914e-19, 6.10051183868376e-19, 6.02894260844298e-19, 5.93920469517264e-19, 5.82923129101488e-19, 5.69623460862654e-19, 5.5358407057967995e-19, 5.34091989650436e-19, 5.099455855994219e-19, 4.79092470158484e-19, 4.37951778550632e-19, 3.80162869538886e-19, 2.9442238697037597e-19, 1.64384924825034e-19, -4.05220912094646e-20, -3.78152137863216e-19, -9.60506494259634e-19, -2.0149774437500997e-18, -4.02237659202138e-18, -8.052619871315699e-18, -1.6665841346867998e-17, -3.65563836049878e-17, -8.72309874911202e-17, -2.34419269850442e-16, -7.497898255325879e-16, -3.1512731561155797e-15] 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: 0.014762949629979141 Energy: 0.3546011960985041 Energy: 0.26132492644919114 Energy: 0.5308967054479939 Energy: 0.5327216391790345 Energy: 0.19508043638705175 Energy: 0.01645726918688373 Energy: 0.07582359015713451 Energy: 0.4978723109796868 Energy: 0.15418637664657792 Energy: 0.46786452565028996 Energy: 0.44272086107490344 Energy: 0.015338661001011975 Energy: 0.07618351854140101 Energy: 0.01514577088053237 Energy: 0.4949222376680151 Energy: 0.35502139934295834 Energy: 0.46634277467629737 Energy: 0.4421344423511076 Energy: 0.07572750293568359 Energy: 0.07753131796650645 Energy: 0.01675780484720373 Energy: 0.35440156372546167 Energy: 0.3552861558278697 Energy: 0.5309027118058491 Energy: 0.5328499273739641 Energy: 0.07585291133623642 Energy: 0.01642147474792379 Energy: 0.19517905979321096 Energy: 0.49669424737455004 Energy: 0.15433355462920997 Energy: 0.35663900473223353 Energy: 0.3662689000137416 Energy: 0.015725519450169236 Energy: 0.07583382296227521 Energy: 0.014992839911489265 Energy: 0.5309643522222284 Energy: 0.3550122614247613 Energy: 0.46628259815759804 Energy: 0.4416230245729639 Energy: 0.0757352427559393 Energy: 0.07744498431553547 minimum gb energy = 0.014762949629979141 eV minimum distance = 2.83168657988201 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 0.6458494467098748 Energy: 0.779184154084422 Energy: 0.6596447385590305 Energy: 0.6186393174152219 Energy: 0.6949641294972663 Energy: 0.6496055499265412 Energy: 0.6881467213763434 Energy: 0.5787633756360029 Energy: 0.5743982919972878 Energy: 0.5963144897607923 Energy: 0.684373052280277 Energy: 0.5842584262432567 Energy: 0.5971050520751077 Energy: 0.6567534084608426 Energy: 0.7023065256225398 Energy: 0.7081210930093894 Energy: 0.6755168009610737 Energy: 0.6196747994950973 Energy: 0.632338026821438 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0.6805551475905468 Energy: 0.546701806745096 Energy: 0.640682121517833 Energy: 0.6481341337159285 Energy: 0.6212368145963564 Energy: 0.5562499150605982 Energy: 0.6017688530860875 Energy: 0.6166153319963446 minimum gb energy = 0.5312413759159521 eV minimum distance = 2.54077156724868 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 0.6813993456663608 Energy: 0.7931383641262285 Energy: 0.7593456560276748 Energy: 0.7455259275707711 Energy: 0.7232524283393121 Energy: 0.6902337962851246 Energy: 0.730626071248374 Energy: 0.72830732846342 Energy: 0.7481264063427413 Energy: 0.74226121506682 Energy: 0.7584502130702342 Energy: 0.7533463967424068 Energy: 0.7411791494748209 Energy: 0.7956649059383554 Energy: 0.7178803423187629 Energy: 0.6954807258457189 Energy: 0.6971407207530447 Energy: 0.7423995468662751 Energy: 0.7298740757674532 Energy: 0.6889437688128789 Energy: 0.6856602117651621 Energy: 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0.7516488313560402 Energy: 0.6969960710655527 Energy: 0.716155969199193 Energy: 0.7036942802051863 Energy: 0.747398882933052 Energy: 0.7016922215194343 Energy: 0.6919473605372148 Energy: 0.7491836782714878 Energy: 0.7227196551043841 Energy: 0.6956125790042736 Energy: 0.6898785814303751 Energy: 0.7219118545651353 Energy: 0.6333413369311115 Energy: 0.6573636883079245 Energy: 0.745036230616499 Energy: 0.7221409090261056 Energy: 0.760355147665507 Energy: 0.7024230709980273 Energy: 0.7093101231269378 Energy: 0.6335176359774926 Energy: 0.6570508773622539 Energy: 0.7696287740724779 Energy: 0.6800446430623399 Energy: 0.7772848917458638 Energy: 0.706362728200205 Energy: 0.7485138099386826 Energy: 0.7334147267122113 Energy: 0.6876305150882009 Energy: 0.7372791088975467 Energy: 0.7486355814102204 Energy: 0.7473912803070007 Energy: 0.7478994874135128 Energy: 0.7563846998680976 Energy: 0.6961187852847769 Energy: 0.7466175992312655 Energy: 0.7965769433535632 Energy: 0.6570798319625498 Energy: 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0.6570378227809915 Energy: 0.6493858380212911 Energy: 0.6401899187173881 Energy: 0.622697821316951 Energy: 0.7352554314245615 Energy: 0.6879019553718138 Energy: 0.6406824062083276 Energy: 0.6346699747497575 Energy: 0.703898185987011 Energy: 0.6200416148379654 Energy: 0.6888702490905648 Energy: 0.6422622765260979 Energy: 0.6270299378194601 Energy: 0.6309994888134496 Energy: 0.6235010150573831 Energy: 0.6849926995212461 Energy: 0.6764375923824281 Energy: 0.685057017580485 Energy: 0.6524788447070317 Energy: 0.6638967624426309 Energy: 0.6862541469503028 Energy: 0.6805921537204945 Energy: 0.6944815647932975 Energy: 0.6386190258709804 Energy: 0.684215441993443 Energy: 0.6590173557390133 Energy: 0.6849823229225971 Energy: 0.6906987626952851 Energy: 0.6549940675749235 Energy: 0.6827580360105417 Energy: 0.6564953461968583 Energy: 0.6968984997406187 Energy: 0.6654705426943502 Energy: 0.7030257469504165 Energy: 0.7317077614010612 Energy: 0.6893559843969606 Energy: 0.6946380141654469 Energy: 0.7223382734095307 Energy: 0.7437374389378195 Energy: 0.6916617671016214 Energy: 0.7521044265879658 Energy: 0.6885652531810503 Energy: 0.7680241851904003 Energy: 0.7507281935593297 Energy: 0.6972306224460564 Energy: 0.7795308185584571 Energy: 0.7030655330239635 Energy: 0.7521365027870442 Energy: 0.7011721228122451 Energy: 0.6921026745931073 Energy: 0.7480057529669032 Energy: 0.7245453674730963 Energy: 0.7176013237345938 Energy: 0.6872857999075896 Energy: 0.702568959040164 Energy: 0.6334671838088715 Energy: 0.6565797411156046 Energy: 0.7699462893608953 Energy: 0.7206720821563292 Energy: 0.7339923206563186 Energy: 0.7058445019881819 Energy: 0.7192841628578378 Energy: 0.6656710327265468 Energy: 0.6582724014468124 Energy: 0.7969384242228136 Energy: 0.6792221947182707 Energy: 0.6953718226949029 Energy: 0.7073315448020726 Energy: 0.7396064540958315 Energy: 0.7330143019802429 Energy: 0.6881419745689782 Energy: 0.7357782611914452 minimum gb energy = 0.6047800781015805 eV minimum distance = 2.48502161211002 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 0.6215249160099896 Energy: 0.7272830652538733 Energy: 0.6254088419486683 Energy: 0.6220161765752805 Energy: 0.6192991211134594 Energy: 0.6199299974792157 Energy: 0.6258017268516387 Energy: 0.6145665294645523 Energy: 0.721518957118721 Energy: 0.6180086766053597 Energy: 0.6172121216738166 Energy: 0.616238815825114 Energy: 0.6148455131533529 Energy: 0.7218269284869687 Energy: 0.6142553073544931 Energy: 0.7222894644040161 Energy: 0.6159666446626931 Energy: 0.629586691672789 Energy: 0.6227990951445679 Energy: 0.616927983174531 Energy: 0.622230272319512 Energy: 0.6151140463941445 Energy: 0.7221963803967465 Energy: 0.6165450892024081 Energy: 0.6199364273435553 Energy: 0.6273760992802475 Energy: 0.6174296472666847 Energy: 0.6227654564171554 Energy: 0.6196659169100115 Energy: 0.7279823758088119 Energy: 0.6054775806922155 Energy: 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0.605274319425926 Energy: 0.7199971404433102 Energy: 0.6177310096192289 Energy: 0.722627718386985 Energy: 0.6171084980473318 Energy: 0.6205150902892488 Energy: 0.6193020543560964 Energy: 0.6177788380764226 Energy: 0.6260935460387161 Energy: 0.6139415586502498 Energy: 0.722327314248235 Energy: 0.6160376189826972 Energy: 0.6230331217861936 Energy: 0.6231255961512346 Energy: 0.6174975857656694 Energy: 0.7220998508147111 Energy: 0.6140285574031483 Energy: 0.722327038021506 Energy: 0.6167031543715 Energy: 0.6178419877953902 Energy: 0.6239077345346881 Energy: 0.6182430575134998 Energy: 0.7211670674574818 Energy: 0.6199732908924068 Energy: 0.7216043843043518 Energy: 0.6174027064267164 Energy: 0.6211773777316829 Energy: 0.61871562391955 Energy: 0.620134973885457 Energy: 0.6251970659103454 Energy: 0.6200460307074264 Energy: 0.7212692795752456 Energy: 0.605592531094148 Energy: 0.6163778511634554 Energy: 0.6160720840284618 Energy: 0.6136933025772912 Energy: 0.7225800662741443 Energy: 0.6147696974285867 Energy: 0.722229923209769 Energy: 0.6161500265792033 Energy: 0.6203297918948536 Energy: 0.6282105735967277 Energy: 0.6169916759927687 Energy: 0.6222683165705714 Energy: 0.6144373702978633 Energy: 0.7224133474324724 Energy: 0.6159686955765092 Energy: 0.6194872767672388 Energy: 0.6276404117003088 Energy: 0.6171265859321896 Energy: 0.6214614434530765 Energy: 0.6204289062412444 Energy: 0.7216860318770182 Energy: 0.6166063575717362 Energy: 0.6176115187385568 Energy: 0.6165834871250468 Energy: 0.6137188666320977 Energy: 0.7279648601079155 Energy: 0.6204675354061596 Energy: 0.7218035542274632 Energy: 0.6180280142284419 Energy: 0.6202667083505462 Energy: 0.6221063991811793 Energy: 0.6263746369368332 Energy: 0.6257175327906174 Energy: 0.6141358204741462 Energy: 0.7216562167558412 Energy: 0.6178324825478271 Energy: 0.6167783379107393 Energy: 0.6160815878253911 Energy: 0.6151043618483765 Energy: 0.7216940018864191 minimum gb energy = 0.6050558131199254 eV minimum distance = 2.5871925190258 Angstroms sigma value = 23