Model name: model_name=EAM_Dynamo_HoytGarvinWebb_2003_PbCu__MO_119135752160_005 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.615034341812134 cohesive_energy=3.5403314649062034 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=60.0 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: 0.016766664870740935 Energy: 0.4108536914797875 Energy: 0.6260593760067397 Energy: 0.4107873881382929 Energy: 0.016766664870228824 Energy: 0.4108536914767717 Energy: 1.0111093409519376 Energy: 0.42381986472093236 Energy: 0.017221324698751008 Energy: 0.22606747781481995 Energy: 0.017151873008715124 Energy: 0.4238198647219281 Energy: 0.01722132469900706 Energy: 0.2260674778153321 Energy: 0.016766664871736708 Energy: 0.4108536914800435 Energy: 0.6260593760072518 Energy: 0.4107873881385489 Energy: 0.01676666487148065 Energy: 0.4108536914772838 Energy: 1.0111093409529333 Energy: 0.42381986472170047 Energy: 0.01722132469926312 Energy: 0.2260674778153321 Energy: 0.017151873008203016 Energy: 0.42381986472144445 Energy: 0.01722132469849495 Energy: 0.2260674778153321 Energy: 0.01676666487048488 Energy: 0.41085369148027107 Energy: 0.6260593760064836 Energy: 0.4107873881387765 Energy: 0.01676666487048488 Energy: 0.4108536914767717 Energy: 1.0111093409526772 Energy: 0.4238198647207047 Energy: 0.017221324699490722 Energy: 0.22606747781481995 Energy: 0.01715187300845907 Energy: 0.42381986472170047 Energy: 0.017221324697755235 Energy: 0.22606747781507602 minimum gb energy = 0.016766664870228824 eV minimum distance = 2.5340414018769 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 0.9843077890559291 Energy: 0.9369679840159812 Energy: 0.9718506039526199 Energy: 0.932757418449962 Energy: 0.9843077890742813 Energy: 0.9369679840220986 Energy: 1.0004691735484565 Energy: 0.9200955029614198 Energy: 0.9200366434967566 Energy: 0.9160300915644966 Energy: 0.9427469110639506 Energy: 0.9200955029644786 Energy: 0.9200366434967566 Energy: 0.9160300915461443 Energy: 0.9155792870258775 Energy: 0.9227035058054226 Energy: 0.9217451087287755 Energy: 0.9381187692180649 Energy: 0.9155792869891732 Energy: 0.9227035058237748 Energy: 0.9217451087043058 Energy: 0.9990185164795965 Energy: 0.9291382642973929 Energy: 0.8996433272568791 Energy: 0.9363281850401584 Energy: 0.999018516482655 Energy: 0.9291382643188036 Energy: 0.8996433272568791 Energy: 0.9267551029893482 Energy: 0.911305089063999 Energy: 0.9762539844708388 Energy: 0.9103097348915592 Energy: 0.9267551030046417 Energy: 0.9113050890701165 Energy: 0.9762539844647213 Energy: 0.9490543365729706 Energy: 0.9307434456113229 Energy: 0.9464903043134224 Energy: 0.919769458592837 Energy: 0.9490543365638501 Energy: 0.9307434456021468 Energy: 0.946490304307305 Energy: 0.9122022061163263 Energy: 0.9338164339261065 Energy: 0.9700474439890531 Energy: 0.9318782333772502 Energy: 0.9122022061132676 Energy: 0.9338164339444587 Energy: 0.9700474439859944 Energy: 0.9126157145301951 Energy: 0.9191109930745273 Energy: 0.9228685866416187 Energy: 0.9183574945421447 Energy: 0.9126157145454885 Energy: 0.9191109930837034 Energy: 0.92286858663856 Energy: 0.9012747452922141 Energy: 0.9364651919516481 Energy: 0.9150325692408163 Energy: 0.9274586459282946 Energy: 0.9012747452952728 Energy: 0.9364651919485893 Energy: 0.9150325692530512 Energy: 0.9268920697339333 Energy: 0.9310141426389573 Energy: 0.9529140912028001 Energy: 0.9293068006144284 Energy: 0.9268920697492268 Energy: 0.9310141426297813 Energy: 0.9529140911966828 Energy: 0.9215123120731945 Energy: 0.931733027297582 Energy: 0.9065602071923473 Energy: 0.9769305263127346 Energy: 0.9215123120640184 Energy: 0.931733027309761 Energy: 0.9065602071984648 Energy: 0.9435503908817016 Energy: 0.965191486254104 Energy: 0.9527747657721372 Energy: 0.9142059823886859 Energy: 0.9435503908755841 Energy: 0.9651914862296345 Energy: 0.9527747657751959 Energy: 0.993693798949237 Energy: 0.9604814952337952 Energy: 0.9232525372954365 Energy: 0.942663950801647 Energy: 0.9936937989370024 Energy: 0.9604814952307364 Energy: 0.9232525372954365 Energy: 0.9108296576199372 Energy: 0.9600099744786409 Energy: 0.9190110321684437 Energy: 0.9168306606227649 Energy: 0.9108296576229958 Energy: 0.9600099744755821 Energy: 0.9190110321837371 Energy: 0.9247109773172735 Energy: 0.9270488464344068 Energy: 0.932634571232107 Energy: 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0.9264915797434985 Energy: 0.932421457710544 Energy: 0.9157219959733305 Energy: 0.9666619754204733 Energy: 0.9264915797373812 Energy: 0.9324214577227788 Energy: 0.9157219959916827 Energy: 0.9748749171112129 Energy: 0.9117118255051614 Energy: 0.9553316880313271 Energy: 0.9184544053642617 Energy: 0.9748749171112129 Energy: 0.9117118254959854 Energy: 0.9553316880405033 Energy: 0.9600280533534016 Energy: 0.9630491735716958 Energy: 0.9385751885090918 Energy: 0.9480561843796815 Energy: 0.9600280533564602 Energy: 0.9630491735839307 Energy: 0.9385751885029744 Energy: 0.9677617938860725 Energy: 0.9333110326112279 Energy: 0.9127903282898324 Energy: 0.9142968985478546 Energy: 0.9677617938921899 Energy: 0.9333110325989931 Energy: 0.9127903282775977 Energy: 0.9128568449579254 Energy: 0.9204793105818351 Energy: 0.954750016479886 Energy: 0.9328291955582587 Energy: 0.912856845000747 Energy: 0.9204793105848936 Energy: 0.9547500164860033 Energy: 0.926073044533522 Energy: 0.9679844787335031 Energy: 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0.9257088830074309 Energy: 0.930984508337324 Energy: 0.9455024924676947 Energy: 0.9014450547635164 Energy: 0.9367836524469757 Energy: 0.922616769271602 Energy: 0.9272014029209721 Energy: 0.9014450547543402 Energy: 0.936783652462269 Energy: 0.9226167692624259 Energy: 0.9161800935685226 Energy: 0.9280670572567208 Energy: 0.9597069687633998 Energy: 0.9110795397963272 Energy: 0.9161800935838161 Energy: 0.9280670572597794 Energy: 0.959706968784755 Energy: 0.9162514230981955 Energy: 0.9540491301041705 Energy: 0.9486473301180948 Energy: 0.9424556295837246 Energy: 0.9162514231196065 Energy: 0.9540491300980529 Energy: 0.9486473301119774 Energy: 0.9519138543517686 Energy: 0.9451932476572221 Energy: 0.9225327815840892 Energy: 0.9372177281502038 Energy: 0.9519138543548272 Energy: 0.9451932476296939 Energy: 0.9225327816085032 Energy: 0.9718020588967765 Energy: 0.928559006119731 Energy: 0.9331243933692956 Energy: 0.9734837713913931 Energy: 0.9718020588692481 Energy: 0.9285590061350244 Energy: 0.9331243933540022 Energy: 0.9518888411642994 Energy: 0.9174666564262858 Energy: 0.9189537599792678 Energy: 0.9332577447729187 Energy: 0.9518888411734755 Energy: 0.9174666564262858 Energy: 0.9189537599884438 Energy: 0.9937906089674736 Energy: 0.9422988431548747 Energy: 0.9545777104641927 Energy: 0.9613824305746658 Energy: 0.9937906089950018 Energy: 0.9422988431640507 Energy: 0.9545777104519578 Energy: 0.9732390102599838 Energy: 0.9238391237914847 Energy: 0.9526204202361527 Energy: 0.9294145272272825 Energy: 0.9732390102630426 Energy: 0.9238391237914847 Energy: 0.9526204202361527 Energy: 0.901522236168487 Energy: 0.9329409529592108 Energy: 0.9694513748537996 Energy: 0.9334641616595662 Energy: 0.901522236168487 Energy: 0.9329409529745041 Energy: 0.969451374850741 Energy: 0.9257487160988488 Energy: 0.9567900429368336 Energy: 0.9428443572041594 Energy: 0.9566581546784246 Energy: 0.9257487160744347 Energy: 0.9567900429368336 Energy: 0.9428443571858072 Energy: 0.9012623864259794 Energy: 0.9427088297024705 Energy: 0.9277631240827359 Energy: 0.9287807606812373 Energy: 0.9012623864168033 Energy: 0.9427088296994119 Energy: 0.927763124070501 minimum gb energy = 0.8996433272568791 eV minimum distance = 2.29832642399881 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 0.9279730417284632 Energy: 0.9546067246176764 Energy: 0.9580695320138867 Energy: 0.9509084661247914 Energy: 0.9279730417284632 Energy: 0.9546067246038517 Energy: 0.939062829527782 Energy: 0.9127869169988099 Energy: 0.9353571432209102 Energy: 1.023132356212199 Energy: 0.9550896591438721 Energy: 0.9127869169852376 Energy: 0.9353571432198371 Energy: 1.0092200159824798 Energy: 0.9145984587107729 Energy: 0.9414626047917747 Energy: 0.9696469983459133 Energy: 0.9447957661331724 Energy: 0.9145984587100785 Energy: 0.9414626047910803 Energy: 0.9834162715098708 Energy: 0.9259691482434553 Energy: 0.9546369816607068 Energy: 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0.9258770631591947 Energy: 0.98032852150176 Energy: 1.020792413011602 Energy: 0.9352146047596711 Energy: 0.9258770631504833 Energy: 0.9803285214982882 Energy: 1.0207924130206287 Energy: 0.9256074581181095 Energy: 0.9771943336848671 Energy: 0.9693154475549107 Energy: 0.9355517866949677 Energy: 0.9256074581240434 Energy: 0.9771943336931997 Energy: 0.9770050174004644 Energy: 0.9146497102405714 Energy: 0.9426765507022684 Energy: 1.046404093067351 Energy: 0.9525858312303318 Energy: 0.9146497102447376 Energy: 0.942676550698102 Energy: 0.9526672946333676 Energy: 0.923030628578612 Energy: 0.93584035898138 Energy: 0.9611835075649897 Energy: 0.951668927094315 Energy: 0.9230306285834727 Energy: 0.9358403589952679 Energy: 0.9611835075514176 Energy: 0.9978919128755118 Energy: 0.9546067246131943 Energy: 0.9580695320166642 Energy: 0.950908466127569 Energy: 0.9978919128869377 Energy: 0.9546067246024629 Energy: 0.9580695320187473 Energy: 0.9127869169984311 Energy: 0.935357143223309 Energy: 0.9849070131705101 Energy: 0.9479551619054584 Energy: 0.9127869169852376 Energy: 0.9353571432205314 Energy: 0.9594668346550934 minimum gb energy = 0.9070124525072603 eV minimum distance = 2.2577946753818 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.0104629427346168 Energy: 0.9532254354922428 Energy: 1.0101600454162087 Energy: 0.9430072017339539 Energy: 1.0104629427354186 Energy: 0.9532254354882338 Energy: 0.9938448321144705 Energy: 1.009840807263934 Energy: 0.9970353035356785 Energy: 0.984544649929686 Energy: 0.9725698150452674 Energy: 1.0098408072631322 Energy: 0.9970353035348766 Energy: 0.9845446499312898 Energy: 0.9545875234865017 Energy: 0.9391844663593251 Energy: 1.0196549038518785 Energy: 0.9560186042616775 Energy: 0.9545875234917135 Energy: 0.939184466354915 Energy: 1.026380104047511 Energy: 0.9668357315827093 Energy: 0.9450444612815587 Energy: 1.03199571066138 Energy: 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0.9925552189921887 Energy: 0.9528649023739593 Energy: 1.0166507937968579 Energy: 0.9633576100104535 Energy: 0.9925552189905851 Energy: 0.9528649023703512 Energy: 1.0166507937912452 Energy: 0.968277848882795 Energy: 0.9602940138339336 Energy: 0.9971468005615253 Energy: 0.9559961223118734 Energy: 0.9682778488847997 Energy: 0.9602940138331317 Energy: 0.9971468005623272 Energy: 0.9990300414198731 Energy: 0.956533613055889 Energy: 0.9552447971585519 Energy: 0.9723954370020049 Energy: 0.9990300414182695 Energy: 0.9565336130562898 Energy: 0.9552447971553447 Energy: 0.9473923259299224 Energy: 0.9453116016090718 Energy: 0.9375042135340663 Energy: 0.9618646955921696 Energy: 0.9473923259331296 Energy: 0.9453116016118417 Energy: 0.9375042135356698 Energy: 0.9520677031001583 Energy: 0.9901166097735077 Energy: 0.9486147501468734 Energy: 0.9461927866376404 Energy: 0.9520677031017618 Energy: 0.9901166097715031 Energy: 0.9486147501500806 Energy: 0.9386247834388524 Energy: 0.9625788314207061 Energy: 0.9483031895783852 Energy: 0.9458538830377864 Energy: 0.9386247834376497 Energy: 0.9625788314239132 Energy: 0.9483031895791871 Energy: 0.9465427939015869 Energy: 0.9584633426867226 Energy: 0.9649995885620614 Energy: 0.9549832624452637 Energy: 0.9465427939027895 Energy: 0.9584633426863217 Energy: 0.964999588564066 Energy: 0.9485720540653312 Energy: 0.9494307580120548 Energy: 0.9628526423770416 Energy: 0.9387347173131283 Energy: 0.9485720540657321 Energy: 0.9494307580128567 Energy: 0.9628526423798479 Energy: 0.9818197661333643 Energy: 0.9172287368680031 Energy: 0.9195609517661906 Energy: 0.9586268354212355 Energy: 0.9818197661285534 Energy: 0.9172287368672012 Energy: 0.919560951764988 Energy: 0.966820270819732 Energy: 0.9734868217092278 Energy: 1.0321275779939545 Energy: 0.9583908855442191 Energy: 0.966820270824543 Energy: 0.9734868217092278 Energy: 1.032127577991148 Energy: 0.9578850702902549 Energy: 0.954479924389796 Energy: 0.9965695700214557 Energy: 0.9603754904927152 Energy: 0.957885070294665 Energy: 0.9544799243926023 Energy: 0.9965695700206539 Energy: 0.9825246999077449 Energy: 0.9493392469898532 Energy: 0.9536804732394756 Energy: 0.9689097497371769 Energy: 0.9825246999093485 Energy: 0.9493392469878488 Energy: 0.9536804732386738 Energy: 1.0122496661956455 Energy: 0.9536911431858562 Energy: 0.9992042703962993 Energy: 0.9425745358366996 Energy: 1.012249666198051 Energy: 0.9536911431906671 Energy: 0.999204270397903 Energy: 1.0045490623246665 Energy: 0.9763710968140988 Energy: 0.9804455707821028 Energy: 0.9729788955218254 Energy: 1.0045490623262703 Energy: 0.9763710968088872 Energy: 0.9804455707809001 Energy: 0.9560944237891504 Energy: 0.93708239842127 Energy: 1.0151697841683067 Energy: 0.9511869484304105 Energy: 0.9560944237939613 Energy: 0.9370823984236754 Energy: 1.0151697841687075 Energy: 0.9667596231554249 Energy: 0.9416690108105364 Energy: 1.0035564921704678 Energy: 0.9461495110803281 Energy: 0.9667596231610376 Energy: 0.9416690108105364 Energy: 1.0035564921740394 Energy: 0.9565156330169655 Energy: 0.96929725440964 Energy: 1.003530332138086 Energy: 0.9584904920711357 Energy: 0.9565156330201728 Energy: 0.9692972544060318 Energy: 1.0035303321384865 Energy: 0.9472107279888676 Energy: 0.9573600009813404 Energy: 0.9457449087224016 Energy: 0.9396569137274285 Energy: 0.9472107279864622 Energy: 0.9573600009801377 Energy: 0.9457449087248069 Energy: 0.9531649897859028 Energy: 0.9543661129766217 Energy: 0.9684023102305249 Energy: 0.9556810022966278 Energy: 0.9531649897863037 Energy: 0.954366112975419 Energy: 0.9684023102285204 Energy: 0.938881709579704 Energy: 0.9637537422173981 Energy: 0.9891786279425149 Energy: 0.9458966815104086 Energy: 0.9388817095833122 Energy: 0.9637537422149927 Energy: 0.9891786279393077 Energy: 0.9621226329694313 Energy: 0.9777476811640091 Energy: 0.9815449488974071 Energy: 0.9502699555933692 Energy: 0.9621226329642197 Energy: 0.9777476811640091 Energy: 0.9815449488989744 Energy: 0.9417375314593237 Energy: 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0.9434342627703549 Energy: 1.0110838299765113 Energy: 0.9514093499816262 Energy: 0.9372744417949594 Energy: 0.9434342627656235 Energy: 1.0110838299703604 Energy: 1.0635593355253312 Energy: 0.9398091313468495 Energy: 0.9669972412873009 Energy: 0.9395804621750942 Energy: 1.063559335533848 Energy: 0.9398091313383329 Energy: 0.9669972412825695 Energy: 0.943907695442632 Energy: 0.8766710400931735 Energy: 0.9998225758312319 Energy: 0.876690968712797 Energy: 0.9439076954431052 Energy: 0.8766710400856031 Energy: 0.9998225758421142 Energy: 1.0635530242346958 Energy: 0.939626560034724 Energy: 0.913748208303663 Energy: 0.9398615662280982 Energy: 1.0635530242370614 Energy: 0.9396265600418212 Energy: 0.9446495347444075 Energy: 0.9371009543789584 Energy: 0.9512525127852886 Energy: 1.012914641967365 Energy: 0.9436097646735475 Energy: 0.9371009543836898 Energy: 0.9512525127810302 Energy: 1.0129146419744623 Energy: 0.9914937968547122 Energy: 0.9398945141219714 Energy: 0.9222273123110352 Energy: 0.9400202427472437 Energy: 0.9914937968433566 Energy: 0.9398945141149172 Energy: 0.9222273123148204 Energy: 0.9371464337563973 Energy: 0.9523188368184244 Energy: 0.8754528715996331 Energy: 0.9716044324442029 Energy: 0.9371464337535583 Energy: 0.9523188368339953 Energy: 0.8754528716034182 Energy: 0.9420707825308602 Energy: 0.9400584154601436 Energy: 0.9396267345457368 Energy: 0.8771379400019652 Energy: 0.9420707825370112 Energy: 0.9400584154662944 Energy: 0.9396267345476293 Energy: 0.931257704482187 Energy: 0.940069225785839 Energy: 0.875155436526203 Energy: 0.9413084628705448 Energy: 0.9312577044826602 Energy: 0.9400692257943556 Energy: 0.8751554365233641 Energy: 0.9419145075539981 Energy: 0.9657777332974249 Energy: 1.024695390136992 Energy: 0.9656881752925516 Energy: 0.9419145075530518 Energy: 0.9657777333097265 Energy: 1.02469539013368 Energy: 0.9306454589009334 Energy: 0.9413667091700616 Energy: 0.875219190396686 Energy: 0.9395151037764077 Energy: 0.9306454589099233 Energy: 0.9413667091568134 Energy: 0.8752191904014175 minimum gb energy = 0.8751554365233641 eV minimum distance = 2.32528827841919 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 0.9872308943958003 Energy: 1.0007548456793922 Energy: 1.0136955203863516 Energy: 1.000798621226358 Energy: 0.9872308943906308 Energy: 1.0007548456799666 Energy: 0.9283824551267208 Energy: 0.9954699220927279 Energy: 0.9323892863900298 Energy: 0.9264807095499301 Energy: 0.9321921290685217 Energy: 0.9954699220881328 Energy: 0.9323892863877324 Energy: 0.9264807095493558 Energy: 0.9784062011426156 Energy: 0.9182675180648343 Energy: 0.9177956277236279 Energy: 0.934028309281563 Energy: 0.9784062011466361 Energy: 0.9182675180654087 Energy: 0.9396142347713516 Energy: 0.9932164249387919 Energy: 0.9317980108859458 Energy: 0.9219877692070862 Energy: 0.9317015060601532 Energy: 0.993216424940515 Energy: 0.9317980108911155 Energy: 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0.9663329781419248 Energy: 0.94136571433169 Energy: 0.9706254378390498 Energy: 0.9311752940515635 Energy: 0.9862252087755136 Energy: 0.899912865566666 Energy: 0.9706254378344548 Energy: 0.9311752940567332 Energy: 0.986225208776088 Energy: 0.8854778738426561 Energy: 0.9317331419158431 Energy: 0.9444613318597488 Energy: 0.9479985400428601 Energy: 0.8854778738495487 Energy: 0.9317331419169919 Energy: 0.9444613318603232 Energy: 0.9884549573692785 Energy: 0.9308755599520457 Energy: 0.9709193623416212 Energy: 0.8999047205599743 Energy: 0.9884549573664065 Energy: 0.9308755599491738 Energy: 0.9709193623364519 Energy: 0.8855043174347164 Energy: 0.9477941788056156 Energy: 0.9436802895236907 Energy: 0.9801742312637309 Energy: 0.8855043174306958 Energy: 0.9477941788067644 Energy: 0.943680289525962 Energy: 0.9886257841915337 Energy: 0.930687875882323 Energy: 0.9108538915506471 Energy: 0.8998332304083251 Energy: 0.9886257841869388 Energy: 0.9306878758788769 Energy: 0.9108538915592627 minimum gb energy = 0.8852569702680655 eV minimum distance = 2.34079442314227 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 0.9131345875272341 Energy: 0.9453640329239343 Energy: 0.9026799890970234 Energy: 0.9455046195632889 Energy: 0.9131345875208228 Energy: 0.9453640329143175 Energy: 0.9018487784261394 Energy: 0.9778464794838291 Energy: 0.955700890546062 Energy: 0.8741670076884935 Energy: 0.9558964849673277 Energy: 0.977846479477418 Energy: 0.9557008905588844 Energy: 0.8741670076884935 Energy: 0.9132066913903135 Energy: 0.9356174143686783 Energy: 0.8847215617686294 Energy: 0.9308335701900667 Energy: 0.9132066913710799 Energy: 0.9356174143686783 Energy: 0.8847215617718348 Energy: 0.884024373620924 Energy: 0.9561742515088033 Energy: 0.8784398562393189 Energy: 0.9586733869558439 Energy: 0.8840243736016905 Energy: 0.9561742514895697 Energy: 0.8784398562297022 Energy: 0.9506908117337592 Energy: 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0.8997083207808414 Energy: 0.8954559116475597 Energy: 0.8913190187329456 Energy: 0.9086001773784556 Energy: 0.8997083207744301 Energy: 0.8954559116379428 Energy: 0.8913190187361514 Energy: 0.8783343257767595 Energy: 0.8955950067958293 Energy: 0.8935043215822122 Energy: 0.9059215145204944 Energy: 0.8783343257447035 Energy: 0.8955950068022404 Energy: 0.8935043215822122 Energy: 0.8979895784471574 Energy: 0.8924164626690171 Energy: 0.9154415739119612 Energy: 0.9541331964727797 Energy: 0.8979895784695966 Energy: 0.8924164626594586 Energy: 0.9154415739119612 Energy: 0.8868545670017206 Energy: 0.9074507662861344 Energy: 0.9613968208127166 Energy: 0.9058532657481143 Energy: 0.8868545670145431 Energy: 0.9074507662765178 Energy: 0.961396820815922 Energy: 0.9002516988699926 Energy: 0.9513143234840659 Energy: 0.9246700121114412 Energy: 1.0076220912147917 Energy: 0.9002516988731983 Energy: 0.9513143235097106 Energy: 0.9246700121178525 Energy: 0.8972012427724616 Energy: 0.9486280829852549 Energy: 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0.9842812937639568 Energy: 0.9025935761300674 Energy: 0.889667940685203 Energy: 0.9301393995532288 Energy: 0.9534420685626672 Energy: 0.902593576117245 Energy: 0.8896679406819974 Energy: 0.930139399527584 Energy: 0.9208309723861976 Energy: 0.8992582316025416 Energy: 0.9591721700044475 Energy: 0.9001368893263947 Energy: 0.9208309723990201 Energy: 0.8992582316185697 Energy: 0.9591721700172698 Energy: 0.9026087267529872 Energy: 0.9405080046277023 Energy: 0.9607802655291257 Energy: 0.9436284884922989 Energy: 0.9026087267497815 Energy: 0.9405080046244968 Energy: 0.9607802655195088 Energy: 0.9191875915338685 Energy: 0.9365113378717623 Energy: 0.9248677899894894 Energy: 0.9110670335161264 Energy: 0.9191875915146349 Energy: 0.9365113378845846 Energy: 0.9248677899959006 Energy: 0.9528586204802099 Energy: 0.939629422084165 Energy: 0.9239543935385935 Energy: 0.9436390872418602 Energy: 0.9528586204705931 Energy: 0.9396294221066042 Energy: 0.9239543935354463 Energy: 0.9192707015666722 Energy: 0.9200753296999895 Energy: 0.9439945255460364 Energy: 0.9316533830699885 Energy: 0.919270701576289 Energy: 0.9200753296711974 Energy: 0.9439945255524477 Energy: 0.9031540880391682 Energy: 0.9395698285704592 Energy: 0.9100870745248182 Energy: 0.9433597338979581 Energy: 0.9031540880391682 Energy: 0.9395698285640481 Energy: 0.9100870745120541 Energy: 0.9200911553488393 Energy: 0.9177971286275232 Energy: 0.9519467767402283 Energy: 0.8982993147312768 Energy: 0.9200911553328114 Energy: 0.9177971286243757 Energy: 0.9519467766345019 Energy: 0.878416230281294 Energy: 0.9381698529072585 Energy: 0.9086908729028466 Energy: 0.9623367937279153 Energy: 0.8784162302844996 Energy: 0.9381698529072585 Energy: 0.9086908728868185 minimum gb energy = 0.8741670076884935 eV minimum distance = 2.32982118253803 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 0.8708663950919072 Energy: 0.7752984816606747 Energy: 1.0801933543523894 Energy: 0.7752984816628431 Energy: 0.8708663950861252 Energy: 0.7752984816635656 Energy: 0.8763814994590051 Energy: 0.8708663950940754 Energy: 0.7752984816621202 Energy: 1.0801933543531121 Energy: 0.7752984816585065 Energy: 0.8708663950933525 Energy: 0.7752984816628431 Energy: 1.0801933543552804 Energy: 0.8708663950947981 Energy: 0.7752984816635656 Energy: 1.0801933543552804 Energy: 0.7752984816635656 Energy: 0.8708663950947981 Energy: 0.7752984816585065 Energy: 0.8933157210329421 Energy: 0.8708663950926299 Energy: 0.7752984816577838 Energy: 1.0801933543538347 Energy: 0.7752984816628431 Energy: 0.870866395086848 Energy: 0.7752984816628431 Energy: 0.9483627052070427 Energy: 0.8708663950940754 Energy: 0.7752984816621202 Energy: 1.0801933543523894 Energy: 0.7752984816592293 Energy: 0.8708663950940754 Energy: 0.7752984816628431 Energy: 1.080193354356003 Energy: 0.8708663950940754 Energy: 0.7752984816628431 Energy: 1.0801933543545577 Energy: 0.7752984816621202 Energy: 0.8708663950940754 Energy: 0.7752984816577838 Energy: 0.893315721030774 Energy: 0.8708663950919072 Energy: 0.7752984816613975 Energy: 1.0801933543523894 Energy: 0.7752984816642884 Energy: 0.870866395086848 Energy: 0.7752984816642884 Energy: 1.0057698657453753 Energy: 0.8708663950933525 Energy: 0.7752984816613975 Energy: 1.0801933543531121 Energy: 0.7752984816577838 Energy: 0.8708663950940754 Energy: 0.7752984816613975 Energy: 1.080193354356003 Energy: 0.8708663950940754 Energy: 0.7752984816635656 Energy: 1.080193354356003 Energy: 0.7752984816628431 Energy: 0.8708663950933525 Energy: 0.7752984816592293 Energy: 0.8933157210329421 Energy: 0.8708663950926299 Energy: 0.7752984816585065 Energy: 1.0801933543538347 Energy: 0.7752984816635656 Energy: 0.8708663950861252 Energy: 0.7752984816628431 Energy: 0.9483627052193293 Energy: 0.8708663950947981 Energy: 0.7752984816628431 Energy: 1.0801933543523894 Energy: 0.7752984816585065 Energy: 0.8708663950940754 Energy: 0.7752984816628431 Energy: 1.080193354356003 Energy: 0.8708663950933525 Energy: 0.7752984816628431 Energy: 1.0801933543545577 Energy: 0.7752984816621202 Energy: 0.8708663950933525 Energy: 0.7752984816577838 Energy: 0.8933157210293283 Energy: 0.8708663950926299 Energy: 0.775298481659952 Energy: 1.0801933543523894 Energy: 0.7752984816642884 Energy: 0.870866395086848 Energy: 0.7752984816642884 Energy: 0.8763814994633415 Energy: 0.8708663950940754 Energy: 0.7752984816613975 Energy: 1.0801933543531121 Energy: 0.7752984816585065 Energy: 0.8708663950926299 Energy: 0.7752984816621202 Energy: 1.0801933543552804 Energy: 0.8708663950940754 Energy: 0.7752984816628431 Energy: 1.080193354356003 Energy: 0.7752984816635656 Energy: 0.8708663950933525 Energy: 0.7752984816592293 Energy: 0.8933157210322193 Energy: 0.8708663950926299 Energy: 0.7752984816585065 Energy: 1.0801933543531121 Energy: 0.7752984816628431 Energy: 0.8708663950861252 Energy: 0.7752984816635656 Energy: 0.9483627052251112 Energy: 0.8708663950940754 Energy: 0.7752984816635656 Energy: 1.0801933543516666 Energy: 0.775298481659952 Energy: 0.8708663950940754 Energy: 0.7752984816628431 Energy: 1.080193354356003 Energy: 0.8708663950940754 Energy: 0.7752984816635656 Energy: 1.0801933543552804 Energy: 0.7752984816621202 Energy: 0.8708663950933525 Energy: 0.7752984816577838 Energy: 0.8933157210314967 Energy: 0.8708663950919072 Energy: 0.775298481659952 Energy: 1.0801933543516666 Energy: 0.7752984816642884 Energy: 0.870866395086848 Energy: 0.7752984816635656 Energy: 0.8390316989565332 Energy: 0.8708663950940754 Energy: 0.7752984816621202 Energy: 1.0801933543538347 Energy: 0.7752984816577838 Energy: 0.8708663950933525 Energy: 0.7752984816613975 Energy: 1.0792643471282377 minimum gb energy = 0.7752984816577838 eV minimum distance = 2.30946144613426 Angstroms sigma value = 23