Model name: model_name=EAM_Dynamo_FoilesHoyt_2006_Ni__MO_776437554506_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Ni Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.5200000628829002 cohesive_energy=4.4503500197622685 mass=58.6934 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=[1.8683782817391e-19, 2.7765240414229795e-19, 3.4593557010674395e-19, 4.0089984171274793e-19, 4.46683641205932e-19, 4.85598909469158e-19, 5.1910362723936595e-19, 5.48191144029636e-19, 5.73574428442098e-19, 5.957886074725079e-19, 6.15255053575608e-19, 6.32284589018394e-19, 6.47162401241718e-19, 6.601015797379019e-19, 6.71286374819856e-19, 6.808737997977119e-19, 6.889968353320919e-19, 6.957692359640099e-19, 7.012951431746759e-19, 7.056594723256919e-19, 7.08943934425392e-19, 7.112158208924039e-19, 7.1253921879208805e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.11028366226226e-19, 7.083543334240799e-19, 7.04281600420452e-19, 6.98568238543608e-19, 6.90924253822794e-19, 6.81003576105066e-19, 6.683944459954859e-19, 6.525921778543439e-19, 6.32989546737354e-19, 6.088383361564379e-19, 5.7921889672368e-19, 5.4299368302894e-19, 4.98730349161422e-19, 4.4462804858451e-19, 3.783828512985119e-19, 2.9701791311745597e-19, 1.9665436441042797e-19, 7.213656098687939e-20, -8.337871399233059e-20, -2.7846791204900397e-19, -5.26335852565242e-19, -8.460309737603339e-19, -1.2569940869112359e-18, -1.8008946019150197e-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: 0.022172650719185415 Energy: 0.5214608758033935 Energy: 0.521001759708722 Energy: 1.147977736477438 Energy: 1.1449679456866246 Energy: 0.41946219405447654 Energy: 0.02276077416341936 Energy: 0.13356887455145694 Energy: 0.9183697048410756 Energy: 0.342722084649507 Energy: 0.520112962605725 Energy: 0.9212914978048758 Energy: 0.023563016293959467 Energy: 0.1352466138442447 Energy: 0.022667765849556185 Energy: 0.9207463180817809 Energy: 0.3490918382056563 Energy: 0.5201232975655178 Energy: 0.9217714529788903 Energy: 0.13361810334372848 Energy: 0.13528003728216922 Energy: 0.025793849353995323 Energy: 0.8429840321721411 Energy: 0.5213685943369524 Energy: 1.1469787163046303 Energy: 0.9213205136871374 Energy: 0.13411809534993477 Energy: 0.023197205759533088 Energy: 0.13383845263518446 Energy: 1.1438947343281294 Energy: 0.3428050700918133 Energy: 0.520887385367345 Energy: 0.8355662089037096 Energy: 0.02299119907406254 Energy: 0.13509721021910082 Energy: 0.02270501690716199 Energy: 0.9201113948852189 Energy: 0.3490398393166976 Energy: 0.520677203464884 Energy: 0.922119430131694 Energy: 0.1332676388050226 Energy: 0.1352223963075817 minimum gb energy = 0.022172650719185415 eV minimum distance = 2.46668526433167 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.453444059198063 Energy: 1.7488259624149005 Energy: 1.482727122555403 Energy: 1.3767665734219663 Energy: 1.3804315647910608 Energy: 1.57032103377053 Energy: 1.5490792789826449 Energy: 1.2817994372037347 Energy: 1.3544426612380378 Energy: 1.2832242166355265 Energy: 1.3996249593139476 Energy: 1.3617827574899044 Energy: 1.288833543390999 Energy: 1.3775823631496937 Energy: 1.5952158426623713 Energy: 1.4034080918826 Energy: 1.4420521266216906 Energy: 1.3449729157672614 Energy: 1.3610869702102153 Energy: 1.4437168152056923 Energy: 1.3935108450035254 Energy: 1.3095623010549153 Energy: 1.3600837750127885 Energy: 1.2899503840030333 Energy: 1.3267428979237743 Energy: 1.3948186921435257 Energy: 1.2883805166472724 Energy: 1.4026541580434608 Energy: 1.4200731988944653 Energy: 1.3270149383799992 Energy: 1.3904848160600327 Energy: 1.3283106463522112 Energy: 1.3835873421262384 Energy: 1.3963511567894624 Energy: 1.3503770944127642 Energy: 1.3345921798689884 Energy: 1.3840845618437578 Energy: 1.292070098426744 Energy: 1.291730866483659 Energy: 1.380788876428088 Energy: 1.3427836380771572 Energy: 1.3530673631871395 Energy: 1.315938233898409 Energy: 1.49005036121232 Energy: 1.432716650771505 Energy: 1.3325167578497077 Energy: 1.3386808847129794 Energy: 1.4377666526124262 Energy: 1.4614712731049904 Energy: 1.3340822129173453 Energy: 1.3898811791527919 Energy: 1.348006079142734 Energy: 1.3868309624041186 Energy: 1.3464107238518412 Energy: 1.3905587803129873 Energy: 1.4026508336071397 Energy: 1.352233470875224 Energy: 1.345013926607106 Energy: 1.2935834593233526 Energy: 1.3388543398338408 Energy: 1.4499320986616917 Energy: 1.3319301969576807 Energy: 1.357188919608118 Energy: 1.2902965970643931 Energy: 1.3509802914635571 Energy: 1.3492102755904345 Energy: 1.4291394353981612 Energy: 1.4212568016911955 Energy: 1.3223980516493044 Energy: 1.3500766880123647 Energy: 1.3153442327758031 Energy: 1.3910073711414483 Energy: 1.3340080718234937 Energy: 1.4828155912379322 Energy: 1.446454303703134 Energy: 1.3083152788643568 Energy: 1.3161088845396252 Energy: 1.533399936885518 Energy: 1.4009373124030013 Energy: 1.2807508994445913 Energy: 1.3985420258600574 Energy: 1.2990204416516786 Energy: 1.3590941722575245 Energy: 1.3624712760607434 Energy: 1.3070624065395529 Energy: 1.3695504997281227 Energy: 1.3262203035450661 Energy: 1.4002655913928976 Energy: 1.4824977145570803 Energy: 1.3157686396170674 Energy: 1.3588083876907353 Energy: 1.408385315077787 Energy: 1.4383029789205302 Energy: 1.3287805587154768 Energy: 1.4391741085474639 Energy: 1.432055047359889 Energy: 1.3979484343900601 Energy: 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1.397633737024086 Energy: 1.3586113273836713 Energy: 1.3121157969196313 Energy: 1.3557719901659735 Energy: 1.3331924791042693 Energy: 1.4268067227160515 Energy: 1.4389855932248843 Energy: 1.3476318687272015 Energy: 1.376631898448786 Energy: 1.4397084531606186 Energy: 1.4771638171138501 Energy: 1.315632460160458 Energy: 1.4889740821645703 Energy: 1.3122150255442537 Energy: 1.3281230880791153 Energy: 1.423379655403748 Energy: 1.29980661926595 Energy: 1.4052319128371509 Energy: 1.3325143205330794 Energy: 1.3093184665080524 Energy: 1.390318180244357 Energy: 1.329015976978526 Energy: 1.3572544008899177 Energy: 1.4364174223754596 Energy: 1.3493419610622492 Energy: 1.3303550134233892 Energy: 1.3613228634162597 Energy: 1.3909361117102097 Energy: 1.2862870749158843 Energy: 1.3563534343339907 Energy: 1.4049261017585573 Energy: 1.3569150836233381 Energy: 1.2761047936580092 Energy: 1.4111110438675307 Energy: 1.4015429160112869 Energy: 1.336955837723918 Energy: 1.4190585241487166 Energy: 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1.344240287141055 Energy: 1.4023337153083242 Energy: 1.3235285891405018 Energy: 1.3228578337127725 Energy: 1.3577225282329264 Energy: 1.3389926235700738 Energy: 1.3240641933938375 Energy: 1.3523488794016567 Energy: 1.322568785591516 minimum gb energy = 1.28552998938519 eV minimum distance = 2.22785857930321 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.3726820194082632 Energy: 1.3174877189164178 Energy: 1.4477659602312836 Energy: 1.3246169972172268 Energy: 1.4304193626597839 Energy: 1.3714667439493162 Energy: 1.4228119502462022 Energy: 1.3359250484483904 Energy: 1.3571945541190686 Energy: 1.3387117892583489 Energy: 1.4055889913167956 Energy: 1.3463631144026622 Energy: 1.336071618537357 Energy: 1.368075137442758 Energy: 1.369218543147803 Energy: 1.3935312134991427 Energy: 1.3326027402085525 Energy: 1.3195399642476124 Energy: 1.348245247404336 Energy: 1.318534027108194 Energy: 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1.3778050572974339 Energy: 1.3793988573949358 Energy: 1.3883463936328204 Energy: 1.4386668439866126 Energy: 1.3921827282052317 Energy: 1.3880455825870939 Energy: 1.4253088482446568 Energy: 1.3888767327971767 Energy: 1.5329495798269328 Energy: 1.3447015707583152 Energy: 1.380399433226318 Energy: 1.3075316778382762 Energy: 1.3764226194073712 Energy: 1.3169586873512653 Energy: 1.3098637419812371 Energy: 1.358774397596463 Energy: 1.332945504394328 Energy: 1.3697537936751414 Energy: 1.3391839483052241 Energy: 1.3173949978610044 Energy: 1.3518355505848443 Energy: 1.3029221079767106 Energy: 1.3593388160127606 Energy: 1.3367590390098856 Energy: 1.3681483663311387 Energy: 1.3376081287371815 Energy: 1.3737164851260442 Energy: 1.3373321022368017 Energy: 1.3776942084089183 Energy: 1.3221955948318953 Energy: 1.4154289643878368 Energy: 1.419744518751483 Energy: 1.3417781931536714 Energy: 1.3253880533157207 Energy: 1.3445276554397718 Energy: 1.3239618623450191 Energy: 1.3601314698880875 Energy: 1.450746973082639 Energy: 1.3886741719138638 Energy: 1.4541716382793393 Energy: 1.3221082378135964 Energy: 1.3430740283412206 Energy: 1.375107990442634 Energy: 1.401568961690613 Energy: 1.3878133611012549 Energy: 1.4039613792376118 Energy: 1.3344853090443758 Energy: 1.5114289169321127 Energy: 1.425977732067904 Energy: 1.3320675472760075 Energy: 1.420668531030538 Energy: 1.4013792106839813 Energy: 1.380517750166586 Energy: 1.334951881923664 Energy: 1.3191907909005658 Energy: 1.355627299112408 Energy: 1.3278799783620165 Energy: 1.3572605281326249 Energy: 1.3181147607701404 Energy: 1.3702322029864353 Energy: 1.336236203597945 Energy: 1.3179808463240184 Energy: 1.3541331253701612 Energy: 1.3021519317401318 Energy: 1.3202592907180464 Energy: 1.338657389626364 Energy: 1.3375127770714785 Energy: 1.339344360715876 Energy: 1.481667949082784 Energy: 1.3404573996088063 Energy: 1.3680159907984182 Energy: 1.3260251666809342 Energy: 1.412067485553262 Energy: 1.420643813935764 Energy: 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1.340557998668143 Energy: 1.3210810208830985 Energy: 1.466077948451654 Energy: 1.4077197006787334 Energy: 1.4131802089083632 Energy: 1.4104956204101537 Energy: 1.4390102507515365 Energy: 1.3830448563332405 Energy: 1.3897750460918434 Energy: 1.340876570618942 minimum gb energy = 1.3021519317401318 eV minimum distance = 2.22008349605306 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 1.2553213889151558 Energy: 1.427299957900492 Energy: 1.7011864554867822 Energy: 1.5223869431457955 Energy: 1.4035224945861426 Energy: 1.4099134596970428 Energy: 1.232345124395564 Energy: 1.321393211850962 Energy: 1.358962465975825 Energy: 1.4076934411092696 Energy: 1.3889489198983591 Energy: 1.3225133724699845 Energy: 1.3235453782415654 Energy: 1.3446660795211272 Energy: 1.3236972603791102 Energy: 1.301606314199219 Energy: 1.3252624093201124 Energy: 1.3639389590194935 Energy: 1.3232862042924163 Energy: 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1.2318837972588934 Energy: 1.3576353031872075 Energy: 1.409460507551727 Energy: 1.3009956384783754 Energy: 1.319098214272187 Energy: 1.4192888792879488 Energy: 1.3226416268579448 Energy: 1.322373632398596 Energy: 1.3607897916595415 Energy: 1.4150962409004544 Energy: 1.3613447371763585 Energy: 1.3213987114186592 Energy: 1.323559923852269 Energy: 1.3228340955320883 Energy: 1.3203851846102215 Energy: 1.302372651963328 Energy: 1.4178779510916342 Energy: 1.3045588438810005 Energy: 1.3201300841270522 Energy: 1.3485377976915889 Energy: 1.4158165715419355 Energy: 1.34747492033515 Energy: 1.3196848369130738 Energy: 1.3961222388912924 Energy: 1.318037893116401 Energy: 1.3884947958112133 Energy: 1.4183276815903911 Energy: 1.3295779123289404 Energy: 1.2341607561221157 Energy: 1.3202745540565854 Energy: 1.426786333607611 Energy: 1.3235097320378808 Energy: 1.405801697481832 Energy: 1.4186166069747508 Energy: 1.3222004800970495 Energy: 1.319568493067277 Energy: 1.3012137800337327 Energy: 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1.3856173853150002 Energy: 1.4151284359927119 Energy: 1.4903148183929753 Energy: 1.3246439771381069 Energy: 1.3208285351469522 Energy: 1.4239970171086513 Energy: 1.3275729045948155 Energy: 1.402045014009786 Energy: 1.4109840276668109 Energy: 1.3274482499363032 Energy: 1.2311384559652558 Energy: 1.3233643010763583 Energy: 1.3231639783894307 Energy: 1.3128186782112474 Energy: 1.3594900186551557 Energy: 1.2314869011119949 Energy: 1.3233811160833049 Energy: 1.3213186291916952 Energy: 1.3551307398422499 Energy: 1.3214590054863744 Energy: 1.3783764866844759 Energy: 1.232719802918871 Energy: 1.2373707556412052 Energy: 1.3434214325116234 Energy: 1.2325881825027158 Energy: 1.3574074049475937 Energy: 1.435075418936335 Energy: 1.3163504297951736 Energy: 1.4276147591397843 Energy: 1.4259064087566393 Energy: 1.3222504231119516 Energy: 1.2312146392553458 Energy: 1.35750037798411 Energy: 1.4083054967337811 Energy: 1.3009938861534118 Energy: 1.3190656518674735 Energy: 1.4190522109619534 Energy: 1.4380526442826547 Energy: 1.3224888588637747 Energy: 1.3567057609571211 Energy: 1.415200303202602 Energy: 1.3616799713200016 Energy: 1.3216633985307247 Energy: 1.3238492777240103 Energy: 1.3228390433527146 Energy: 1.32284277228141 Energy: 1.3029320451797486 Energy: 1.4175772008529968 Energy: 1.3034565859012137 Energy: 1.3195773644992446 Energy: 1.325267302690359 Energy: 1.4146819654946274 Energy: 1.3480723678406912 Energy: 1.3197304273657826 Energy: 1.3956736375518717 Energy: 1.3178147472658464 Energy: 1.387267013410059 Energy: 1.3237762344296795 Energy: 1.3301878525514637 Energy: 1.2351495250810351 Energy: 1.320455093998788 Energy: 1.4263577559674685 Energy: 1.323907077854401 Energy: 1.4059164529534218 Energy: 1.4187123856454122 Energy: 1.3223699117472278 Energy: 1.3193594581163066 Energy: 1.30124963870512 Energy: 1.3245504028350048 Energy: 1.3800015896126412 Energy: 1.2318611585628634 Energy: 1.2327521005993667 Energy: 1.3444299858872741 Energy: 1.2309477795269643 Energy: 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1.3003271128846012 Energy: 1.3169476320559255 Energy: 1.3517154932190654 Energy: 1.4465030231953664 Energy: 1.4741939159380533 Energy: 1.3042071909404738 Energy: 1.5311707276405147 Energy: 1.3430682677539267 Energy: 1.5583599074221233 Energy: 1.3535244622697062 Energy: 1.2928497145638798 Energy: 1.3197357458180614 Energy: 1.3486202449216305 Energy: 1.3090502801134087 Energy: 1.3673296442552882 Energy: 1.239360816917644 Energy: 1.3650655819831243 Energy: 1.2989048182407452 Energy: 1.2699543227211483 Energy: 1.2811889620501236 Energy: 1.2873594658066303 Energy: 1.3713860000578573 Energy: 1.3065230934169048 Energy: 1.28787329797849 Energy: 1.5305346823579475 Energy: 1.2755787292867753 Energy: 1.2755328692707029 Energy: 1.3389635571760747 Energy: 1.246154443203752 Energy: 1.2647059548024766 Energy: 1.3500683757568148 Energy: 1.3121594436643962 Energy: 1.3230357666079635 Energy: 1.2719969176525732 Energy: 1.2751946202853148 Energy: 1.3346580341571772 Energy: 1.3059134094912133 Energy: 1.3205661457801694 Energy: 1.2948869864422685 Energy: 1.3664184870585814 Energy: 1.347614352866655 Energy: 1.3138933448239305 Energy: 1.333212352032983 Energy: 1.304189569068271 Energy: 1.3411707447779213 Energy: 1.4078810310058167 Energy: 1.28847713050807 Energy: 1.5308199778788323 Energy: 1.4979885631339913 Energy: 1.3477608733120918 Energy: 1.5101533253862887 Energy: 1.2756828516108942 Energy: 1.320628582170695 Energy: 1.3482477521922405 Energy: 1.369487288814111 Energy: 1.3099887374371917 Energy: 1.3217232033171535 Energy: 1.5194597476625655 Energy: 1.3531729938041248 Energy: 1.4878595550759675 Energy: 1.5211116378484193 Energy: 1.407881616768495 Energy: 1.5513694341496103 Energy: 1.3634467814871996 Energy: 1.3051204978028674 Energy: 1.369525676247465 Energy: 1.4167222264135675 Energy: 1.4744988194258284 Energy: 1.5770031381857208 Energy: 1.5164638846715888 Energy: 1.4261911109364251 Energy: 1.424775255407244 Energy: 1.3140936022473175 Energy: 1.3560623714303308 Energy: 1.4996437096561246 Energy: 1.3745211426762367 Energy: 1.5030510380874353 Energy: 1.3520020385626081 minimum gb energy = 1.2126093987578979 eV minimum distance = 2.22810172030132 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 1.5466635905209267 Energy: 1.7168611211758278 Energy: 1.4563226165157575 Energy: 1.6661475801104766 Energy: 1.5638574400527503 Energy: 1.5347419321579587 Energy: 1.3820085372089534 Energy: 1.3524672146561647 Energy: 1.6010755040369955 Energy: 1.6529191324583428 Energy: 1.3610677527748685 Energy: 1.4539991137635249 Energy: 1.6603201919352137 Energy: 1.392603990541334 Energy: 1.555167841229647 Energy: 1.5254001856979194 Energy: 1.4765014025256087 Energy: 1.6019017877656967 Energy: 1.597962859047649 Energy: 1.4658084387693444 Energy: 1.4194888249427606 Energy: 1.491606228452317 Energy: 1.5113853235739654 Energy: 1.5382587872707338 Energy: 1.5606111841880397 Energy: 1.5654027725810422 Energy: 1.5334261699509915 Energy: 1.5140528422412856 Energy: 1.252440161363676 Energy: 1.4793065834483277 Energy: 1.5073809974450405 Energy: 1.4775247805012985 Energy: 1.4205985425905276 Energy: 1.4259885914033827 Energy: 1.5504146036255637 Energy: 1.3740687899235078 Energy: 1.458895929575389 Energy: 1.462493931003925 Energy: 1.5000757776326783 Energy: 1.4090480773688383 Energy: 1.4541892555583091 Energy: 1.46119837375347 Energy: 1.4124726766391085 Energy: 1.3934111620003744 Energy: 1.4029537779768906 Energy: 1.3656072131488708 Energy: 1.4908903886248768 Energy: 1.4872165385424787 Energy: 1.4732364525734654 Energy: 1.3862580288624788 Energy: 1.3392310460558987 Energy: 1.351749935516011 Energy: 1.3500451739055768 Energy: 1.4608106302864123 Energy: 1.4417218508800078 Energy: 1.3926494744044564 Energy: 1.2585635320642332 Energy: 1.4016751479805378 Energy: 1.3917926780840932 Energy: 1.365171856019561 Energy: 1.4438264262480167 Energy: 1.4482278022295771 Energy: 1.4437838117267667 Energy: 1.507365712598581 Energy: 1.4539835789776152 Energy: 1.431775390314334 Energy: 1.34165810366215 Energy: 1.3500496192466735 Energy: 1.3927424764811192 Energy: 1.3106267065599868 Energy: 1.3724250882716444 Energy: 1.367184369035426 Energy: 1.3164987379926965 Energy: 1.3857107447593966 Energy: 1.3699831799228968 Energy: 1.3449402183255967 Energy: 1.413652970675926 Energy: 1.2901937838413997 Energy: 1.3134252275553042 Energy: 1.4489441551277524 Energy: 1.3285241714481268 Energy: 1.47816056153596 Energy: 1.5049076480465455 Energy: 1.4002349633704416 Energy: 1.3875984000980275 Energy: 1.3541776628635136 Energy: 1.3785960762894027 Energy: 1.4733869940065616 Energy: 1.2772873290116484 Energy: 1.3723215306590781 Energy: 1.3856413706280784 Energy: 1.451589088712269 Energy: 1.3493636171496668 Energy: 1.4119936142093947 Energy: 1.311479075754859 Energy: 1.3184773075419212 Energy: 1.4234249708363955 Energy: 1.3295157165200608 Energy: 1.3121219358208172 Energy: 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1.6657150342501368 Energy: 1.569696065924038 Energy: 1.5336969564431289 Energy: 1.7101084804611868 Energy: 1.612095596339328 Energy: 1.5145812614896386 Energy: 1.3936629240795642 Energy: 1.4558816694185293 Energy: 1.512260933092171 Energy: 1.5340966456061493 Energy: 1.3615311396269218 Energy: 1.6079349916658616 Energy: 1.5894136636872067 Energy: 1.5181449408350955 Energy: 1.5335052473741915 Energy: 1.5665193064473755 Energy: 1.5345812552611804 Energy: 1.3588572421907987 Energy: 1.5372010314084066 Energy: 1.4318744208334364 Energy: 1.5658547860349292 Energy: 1.6664956089870822 Energy: 1.5633492248543646 Energy: 1.535181658845965 Energy: 1.4014779162951607 Energy: 1.6795733768138512 Energy: 1.6029767371387071 Energy: 1.4272688223913066 Energy: 1.43983655288559 Energy: 1.394260865194196 Energy: 1.341884761320293 Energy: 1.3694930860114816 Energy: 1.3910696773639974 Energy: 1.4792033660861805 Energy: 1.4731773506150854 Energy: 1.5993323056548763 Energy: 1.5774235174069533 Energy: 1.4661535792351008 Energy: 1.4536856890646488 Energy: 1.49291088748948 Energy: 1.508547174009751 Energy: 1.4772040586905133 Energy: 1.5615625227655963 Energy: 1.5665594848038855 Energy: 1.5343847275448217 Energy: 1.4958580818644434 Energy: 1.2853796793306191 Energy: 1.4482392651884937 Energy: 1.5129236456591553 Energy: 1.4773249383480092 Energy: 1.3785070537693687 Energy: 1.4830480781894004 Energy: 1.5432901656486642 Energy: 1.3734822601801866 Energy: 1.4854095462520485 Energy: 1.4005576080522069 Energy: 1.4966626549459299 Energy: 1.4229438983820566 Energy: 1.309012293126404 Energy: 1.4904743203655295 Energy: 1.3892857282760571 Energy: 1.4084752579098714 Energy: 1.4187995075090398 Energy: 1.5065511702651784 Energy: 1.3744970044137588 Energy: 1.413126983504839 Energy: 1.4733275473123115 Energy: 1.3836987730839938 Energy: 1.3378639234141219 Energy: 1.3780518530390569 Energy: 1.3700636506973516 Energy: 1.4689650970805457 Energy: 1.3551930926400761 Energy: 1.3521350274278436 Energy: 1.2612827925354464 Energy: 1.4096599833751782 Energy: 1.3931635548319916 Energy: 1.3669320190687828 Energy: 1.4585726070119729 Energy: 1.4490272858716335 Energy: 1.4426559391277243 Energy: 1.3195112826317517 Energy: 1.395086942253242 Energy: 1.4299829506290969 Energy: 1.3240273617782352 Energy: 1.3154017165408574 Energy: 1.4285182154587168 Energy: 1.3222664133920194 Energy: 1.3725650427942233 Energy: 1.3671420575610953 Energy: 1.5006366071298376 Energy: 1.3858253508813632 Energy: 1.355864910088512 Energy: 1.2669738657368517 Energy: 1.4113000543428122 Energy: 1.2576748069259285 Energy: 1.3131097566565648 Energy: 1.4478622193324653 Energy: 1.4667622147079702 Energy: 1.50980067689322 Energy: 1.5061011750405557 Energy: 1.3877407941580717 Energy: 1.3879359672923353 Energy: 1.337567368517509 Energy: 1.375057448694229 Energy: 1.5533467599792874 Energy: 1.4468158010394672 Energy: 1.3999423643678983 Energy: 1.319921385220817 Energy: 1.4507789008361873 Energy: 1.3304940491806714 Energy: 1.4142787486025086 Energy: 1.4080596561472813 Energy: 1.3897308214762174 Energy: 1.4186209277912174 Energy: 1.2911943880613919 Energy: 1.3118091079863212 Energy: 1.6013728743414937 Energy: 1.3886107937422432 Energy: 1.3584785328801905 Energy: 1.3370751846972095 Energy: 1.4043732873057218 Energy: 1.3868930853594452 Energy: 1.252705496617467 Energy: 1.383090884627651 Energy: 1.369182366248363 Energy: 1.4416624037126602 Energy: 1.3274425524450977 Energy: 1.456973699782781 Energy: 1.5028846839035102 Energy: 1.4091604737828263 Energy: 1.4768919896789579 Energy: 1.4027135841000944 Energy: 1.5455646398286267 Energy: 1.542066928491925 Energy: 1.4617047092162896 Energy: 1.3636162561214138 Energy: 1.3888165182006988 Energy: 1.5293340114247156 Energy: 1.4824759804395022 Energy: 1.5034170772572972 Energy: 1.5246037561909347 Energy: 1.3143904380598042 Energy: 1.470143641435231 Energy: 1.6094907952714563 Energy: 1.6044465708427351 Energy: 1.4511378414258294 Energy: 1.5009999379946954 Energy: 1.417340256850158 Energy: 1.4052685744278282 Energy: 1.5240842568365793 Energy: 1.563392652172919 Energy: 1.5338348323790747 Energy: 1.5717809062734374 Energy: 1.6644205025759673 Energy: 1.5668470497903455 Energy: 1.5340287498100968 Energy: 1.5731782741460518 Energy: 1.611835018893148 Energy: 1.545593730876209 Energy: 1.5718615279444172 Energy: 1.356095048364861 Energy: 1.565966355639296 Energy: 1.3971627046678294 Energy: 1.4790479372273315 Energy: 1.6091477358788615 Energy: 1.5883014217105584 Energy: 1.507787551833897 Energy: 1.602769713490276 Energy: 1.5653242093539663 Energy: 1.5355696048183014 Energy: 1.6242298651824074 Energy: 1.5367070603897612 Energy: 1.5538372002512473 Energy: 1.5685050439263353 Energy: 1.6661172463387282 Energy: 1.5640366814948004 Energy: 1.5372724117158838 Energy: 1.3566663243600767 minimum gb energy = 1.252440161363676 eV minimum distance = 2.19427556771918 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 1.3876363971357308 Energy: 1.6347653314845345 Energy: 1.3648515535075654 Energy: 1.356908058830565 Energy: 1.3567841870896438 Energy: 1.3626621736246436 Energy: 1.3616046010976512 Energy: 1.3404065409813162 Energy: 1.6141783347129428 Energy: 1.3417673446314502 Energy: 1.3394885048736118 Energy: 1.3385541946319242 Energy: 1.3407536224010186 Energy: 1.6151530279298458 Energy: 1.3369115493532184 Energy: 1.6143091397135112 Energy: 1.3379918750484066 Energy: 1.3208907985663136 Energy: 1.3396045386383928 Energy: 1.3382110337729742 Energy: 1.322349004655057 Energy: 1.3386083889266018 Energy: 1.6149771420316341 Energy: 1.3385351609939005 Energy: 1.3210587566919376 Energy: 1.3203871795100914 Energy: 1.3393944018395474 Energy: 1.3679209519915658 Energy: 1.3825323418711033 Energy: 1.614660874200834 Energy: 1.3583870380077674 Energy: 1.6672768174060115 Energy: 1.3396513243395445 Energy: 1.3568545150922209 Energy: 1.614075859387425 Energy: 1.343474283029267 Energy: 1.6145973576867867 Energy: 1.3454915718939098 Energy: 1.319958711370026 Energy: 1.3196097735466081 Energy: 1.3450661183728536 Energy: 1.3627347350434582 Energy: 1.3377059455480627 Energy: 1.6143439217893951 Energy: 1.3395697347035163 Energy: 1.342694990437522 Energy: 1.3420867821735707 Energy: 1.3398856178259149 Energy: 1.6146869511881576 Energy: 1.3371578868157188 Energy: 1.6139953608818622 Energy: 1.3383789294304302 Energy: 1.3410752461143962 Energy: 1.3406636650635182 Energy: 1.3388227024343538 Energy: 1.6146885606747887 Energy: 1.3415050869847311 Energy: 1.6137159441147795 Energy: 1.3417591397713544 Energy: 1.3212062761271304 Energy: 1.3208588001667834 Energy: 1.3414783381528677 Energy: 1.3640434752925856 Energy: 1.3820642239941117 Energy: 1.6158801134103995 Energy: 1.3579715326442983 Energy: 1.668710080875012 Energy: 1.667115364809311 Energy: 1.356738746801916 Energy: 1.6340356657012234 Energy: 1.3409927624818436 Energy: 1.6140343126787717 Energy: 1.3406793080352817 Energy: 1.3207431322763683 Energy: 1.3210059161632108 Energy: 1.3407518838764243 Energy: 1.3657516660270548 Energy: 1.337196858191079 Energy: 1.6144703765609092 Energy: 1.338013354743266 Energy: 1.3214850308331982 Energy: 1.3403041960592035 Energy: 1.3384302268495651 Energy: 1.6149700930286068 Energy: 1.3385507052649632 Energy: 1.614560333473223 Energy: 1.3402356112132323 Energy: 1.3436514426347355 Energy: 1.3428484776125855 Energy: 1.3408084982025918 Energy: 1.615971485419974 Energy: 1.3455959181094341 Energy: 1.6134979502802576 Energy: 1.3503397666823975 Energy: 1.3206866333483662 Energy: 1.3527415480717453 Energy: 1.3200368130227953 Energy: 1.362026483065662 Energy: 1.3830049907412747 Energy: 1.6141451828557343 Energy: 1.3587834440168398 Energy: 1.3395288058685282 Energy: 1.339214701093559 Energy: 1.3376826326868467 Energy: 1.6134454207787992 Energy: 1.3377598400101423 Energy: 1.615838534387959 Energy: 1.3381456103886373 Energy: 1.321274220473161 Energy: 1.3205964686895908 Energy: 1.3386995991668968 Energy: 1.3229049693627422 Energy: 1.337556198996369 Energy: 1.6157305377219466 Energy: 1.3373254882927454 Energy: 1.3203280864201659 Energy: 1.3213294169498742 Energy: 1.3384757446975675 Energy: 1.3240306207010895 Energy: 1.38349184587841 Energy: 1.613355181910863 Energy: 1.3404698012054224 Energy: 1.3394480318039612 Energy: 1.3389369915126048 Energy: 1.3371468114216742 Energy: 1.6145085080378192 Energy: 1.339023962387608 Energy: 1.6143500431479232 Energy: 1.3589299741896355 Energy: 1.3563909268367635 Energy: 1.3558905697510042 Energy: 1.3583456212406733 Energy: 1.3618143221208665 Energy: 1.3393145256887264 Energy: 1.6142476700349608 Energy: 1.3411756114916258 Energy: 1.3437260959206372 Energy: 1.3435598502142214 Energy: 1.3413504167652406 Energy: 1.6149509538703637 minimum gb energy = 1.3196097735466081 eV minimum distance = 2.28622575091328 Angstroms sigma value = 23