Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001_Al__MO_049243498555_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=4.081654928624631
cohesive_energy=3.5802802150217286
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=[1.9605194599604399e-19, 2.6648202865004994e-19, 3.15763379735256e-19, 3.5697136276173596e-19, 3.9336160064977796e-19, 4.2421631826734995e-19, 4.49468224195824e-19, 4.70064204825894e-19, 4.87034459733222e-19, 5.01172066351638e-19, 5.130570126226499e-19, 5.2313470365051e-19, 5.31756016118064e-19, 5.39207739642798e-19, 5.457109746002039e-19, 5.51425938653682e-19, 5.564583754610759e-19, 5.60859554674674e-19, 5.64642293707548e-19, 5.6780659255969795e-19, 5.70323612051712e-19, 5.721372760014e-19, 5.732219495826179e-19, 5.735792349719999e-19, 5.73196314756474e-19, 5.71973853984732e-19, 5.698061089989299e-19, 5.665921426711259e-19, 5.62210189577136e-19, 5.56509645113364e-19, 5.49344711206116e-19, 5.405391484256519e-19, 5.29876662926382e-19, 5.1707847597399e-19, 5.0177448476602195e-19, 4.834519927795979e-19, 4.6141084882566e-19, 4.347089730434159e-19, 4.0213672207419596e-19, 3.62167221585798e-19, 3.1287465526415395e-19, 2.51748412323786e-19, 1.75411104420222e-19, 7.91989555895514e-20]
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: 2.2204e-16 eV

========================================
theta = 0.0
========================================

Energy: 0.013265014866682063
Energy: 0.014554092358774239
Energy: 0.20619241120825488
Energy: 0.3653104342391958
Energy: 0.36795253933347083
Energy: 0.14803198005329657
Energy: 0.014523106090969531
Energy: 0.013832564795238422
Energy: 0.3697393490868571
Energy: 0.11613686442372229
Energy: 0.20587260390076395
Energy: 0.3054224233867835
Energy: 0.013721030223953443
Energy: 0.06683153368183947
Energy: 0.013495765550100704
Energy: 0.30608963364195596
Energy: 0.17109953125423302
Energy: 0.20562817426265384
Energy: 0.3049343581496543
Energy: 0.06607346265950058
Energy: 0.06705460138627717
Energy: 0.014909457325098779
Energy: 0.2689198755450969
Energy: 0.2066017977623747
Energy: 0.365173208950455
Energy: 0.36917006955643206
Energy: 0.06611556068727714
Energy: 0.014363544050927273
Energy: 0.06610729764509851
Energy: 0.3668876880079374
Energy: 0.11611913772742605
Energy: 0.20583172476116832
Energy: 0.26624212420937843
Energy: 0.013741231542613695
Energy: 0.06620846997722994
Energy: 0.013593995521451418
Energy: 0.3061088764810982
Energy: 0.20557200192503736
Energy: 0.20592251868325936
Energy: 0.304769350854291
Energy: 0.06593996061870659
Energy: 0.06787347166943132

minimum gb energy = 0.013265014866682063 eV
minimum distance =  2.85800123691496 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

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Energy: 0.5021918767852268
Energy: 0.47901740060471365
Energy: 0.4459410938918006
Energy: 0.4672679510833701
Energy: 0.5040691700052575
Energy: 0.5434361395378761
Energy: 0.41838997338656286
Energy: 0.41454960439551575
Energy: 0.41146775891894394
Energy: 0.45629391039969613
Energy: 0.4245332651083033
Energy: 0.4169911123724736
Energy: 0.44652763935033113
Energy: 0.5139901569333832
Energy: 0.4583803701441771
Energy: 0.46228370061235846
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Energy: 0.43207887532861605
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Energy: 0.4360082963488693
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Energy: 0.466878825693014
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Energy: 0.4617377558591773
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Energy: 0.4288715470392105
Energy: 0.440944721691066
Energy: 0.4178801399752662
Energy: 0.44735539934467194
Energy: 0.46780415159867816
Energy: 0.4255994006631551
Energy: 0.4750238073894119
Energy: 0.4537110007123569
Energy: 0.43300206888772236
Energy: 0.4755619790091053
Energy: 0.4733994000025688
Energy: 0.4229998583813857
Energy: 0.4603536030000301
Energy: 0.41033828142853185
Energy: 0.43691092187779973
Energy: 0.44516189739176665
Energy: 0.44000893673164587
Energy: 0.43716748819331724
Energy: 0.4944752241284969
Energy: 0.4642551116775724
Energy: 0.4565706227861929
Energy: 0.4535425976293776
Energy: 0.438984480381264
Energy: 0.415952518126008
Energy: 0.4496824939491578
Energy: 0.4246764592802709
Energy: 0.445741624807491
Energy: 0.43919359368416755
Energy: 0.46079670793954597
Energy: 0.4071851722070364
Energy: 0.4161404353339239
Energy: 0.46696945800062084
Energy: 0.4179248073650435
Energy: 0.444765383854306
Energy: 0.44497162322173567
Energy: 0.4557407034612516
Energy: 0.4239697649229643
Energy: 0.4244751644309541
Energy: 0.439800849059322

minimum gb energy = 0.4071851722070364 eV
minimum distance =  2.53762871323081 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

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Energy: 0.42449259647633336
Energy: 0.45273556326827974
Energy: 0.4474688993965361
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Energy: 0.4496021239351221
Energy: 0.4243283822148572
Energy: 0.4195128174622783
Energy: 0.42190568158763864
Energy: 0.41244129736072377
Energy: 0.41404767155035876
Energy: 0.44275530287540904
Energy: 0.4858616034188729
Energy: 0.4459005688027904
Energy: 0.42460973709184746
Energy: 0.4272096819365881
Energy: 0.41076529806379775
Energy: 0.4584420439326246
Energy: 0.4534407662694078
Energy: 0.4317284663665968
Energy: 0.4416680665505368
Energy: 0.4312135428856252
Energy: 0.4882986664636291
Energy: 0.4230170393221547
Energy: 0.45745369937476726
Energy: 0.4362669397994108
Energy: 0.43019685154310766
Energy: 0.4467920350308197
Energy: 0.44131477288621895
Energy: 0.42568762638483926
Energy: 0.4692156697725527
Energy: 0.409056184332479
Energy: 0.4136947290883338
Energy: 0.41758845813996653
Energy: 0.41643070180502717
Energy: 0.432660637192281
Energy: 0.4359965369477215
Energy: 0.41532095233988287
Energy: 0.41918675158665397
Energy: 0.42881412409669645
Energy: 0.414259444350112
Energy: 0.4148578918644114
Energy: 0.4286145700666917
Energy: 0.43342324528929205
Energy: 0.4207726676857606
Energy: 0.42327026692078923
Energy: 0.4134128233632093
Energy: 0.42075954659031517
Energy: 0.41527346078536576
Energy: 0.43811039587460077
Energy: 0.4129927849510674
Energy: 0.4550867264165661
Energy: 0.44187650530707134
Energy: 0.4171329586018383
Energy: 0.4851770573001796
Energy: 0.46001744046441323
Energy: 0.41261673092340917
Energy: 0.4306952412038103
Energy: 0.4393912094622675
Energy: 0.46127338680937585
Energy: 0.45679035953780095
Energy: 0.4188130094946182
Energy: 0.4318207295546288
Energy: 0.43261522101903366
Energy: 0.4183241497818898
Energy: 0.42820943669318084
Energy: 0.42984074084960766
Energy: 0.4485160648313615
Energy: 0.47651600882838446
Energy: 0.454417579723962
Energy: 0.42248002661508766
Energy: 0.4341723726163114
Energy: 0.41347971469198264
Energy: 0.41588511844743264
Energy: 0.4576951570028176
Energy: 0.4188935578689873
Energy: 0.4310384391684399
Energy: 0.41865003501562575
Energy: 0.420615361034758
Energy: 0.4213410195925871
Energy: 0.4182664960247921
Energy: 0.47157616748388226
Energy: 0.4755952287054734
Energy: 0.4674975131156336
Energy: 0.4176552272403131
Energy: 0.42477274577973806
Energy: 0.4138118044352371
Energy: 0.44937949698800234
Energy: 0.4513479376526415
Energy: 0.42623917771557457
Energy: 0.4521297068626714
Energy: 0.423644930479986
Energy: 0.4162272032405316
Energy: 0.44422457171856855
Energy: 0.46713912389336903
Energy: 0.4330245116426625
Energy: 0.4545677092020476
Energy: 0.45392051770805286
Energy: 0.4451591336993426
Energy: 0.42551623785590476
Energy: 0.4433273629939191
Energy: 0.4281880448780457
Energy: 0.4251474085501159
Energy: 0.4188049525880688
Energy: 0.4218511307778071
Energy: 0.42838076560244914
Energy: 0.4509660444895628
Energy: 0.42354733063069916
Energy: 0.43400423284870976
Energy: 0.4262446306567288

minimum gb energy = 0.409056184332479 eV
minimum distance =  2.54914811877125 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.4589539490047958
Energy: 0.4152330064572252
Energy: 0.4594861372300857
Energy: 0.41538566676763616
Energy: 0.44678587852771384
Energy: 0.4307636725647126
Energy: 0.4383564931240666
Energy: 0.41664179100450577
Energy: 0.4362698305934964
Energy: 0.4254934186863259
Energy: 0.41925016871591647
Energy: 0.4261478955204336
Energy: 0.42097342100613855
Energy: 0.4319144301486467
Energy: 0.40564701220768756
Energy: 0.4273919516807871
Energy: 0.4183958960567407
Energy: 0.41480764660603925
Energy: 0.42601415799329606
Energy: 0.4117760268920441
Energy: 0.42694396421009845
Energy: 0.4147479245428502
Energy: 0.45946024491657683
Energy: 0.4143825077368718
Energy: 0.4824218993473276
Energy: 0.4450165539100038
Energy: 0.41638979641455776
Energy: 0.44529320544975376
Energy: 0.4119332076800992
Energy: 0.42352001575299575
Energy: 0.4266400253031562
Energy: 0.4203247717606413
Energy: 0.42751177504618715
Energy: 0.41844935888275614
Energy: 0.4434750465254936
Energy: 0.40844640990457
Energy: 0.4185681626215055
Energy: 0.42154733951871576
Energy: 0.4142488388872641
Energy: 0.41435746625634223
Energy: 0.4084258308877013
Energy: 0.41779636545253007
Energy: 0.45935128136093767
Energy: 0.41750017271134016
Energy: 0.46327013413720164
Energy: 0.4168933194352048
Energy: 0.420809384572459
Energy: 0.4325617355353639
Energy: 0.405789517726876
Energy: 0.4186278886692763
Energy: 0.4292987473954291
Energy: 0.4201011713065005
Energy: 0.4426502966099215
Energy: 0.44473746246595647
Energy: 0.43796953636251235
Energy: 0.43201364514580165
Energy: 0.42452178287159353
Energy: 0.41667630058950045
Energy: 0.4210997471287736
Energy: 0.4146143738692537
Energy: 0.42662453122476984
Energy: 0.4117941921915464
Energy: 0.42702028224918653
Energy: 0.4152359193919696
Energy: 0.4320359502261376
Energy: 0.4162395405871661
Energy: 0.47035668943592723
Energy: 0.44464777049507803
Energy: 0.41675138362713454
Energy: 0.4164364126683389
Energy: 0.4199623346260779
Energy: 0.41645717397586585
Energy: 0.4229932888836629
Energy: 0.41934374498993365
Energy: 0.42304304474515964
Energy: 0.4183376450729441
Energy: 0.42999195241331745
Energy: 0.4092704820480767
Energy: 0.4187274479345112
Energy: 0.42203897920079186
Energy: 0.4140105534191075
Energy: 0.42124229354997705
Energy: 0.4089096635022821
Energy: 0.430982120495089
Energy: 0.4598574348411154
Energy: 0.41671986726217375
Energy: 0.4481053633395863
Energy: 0.4152137766805262
Energy: 0.44178324980792844
Energy: 0.43263877839759746
Energy: 0.4056005479980626
Energy: 0.4182633638648573
Energy: 0.4171434347770803
Energy: 0.41954289059671374
Energy: 0.4434537006794092
Energy: 0.4435345314204404
Energy: 0.4370758786600697
Energy: 0.48087781241901706
Energy: 0.4080658770734357
Energy: 0.43737151879893643
Energy: 0.43224631274021763
Energy: 0.417112773442784
Energy: 0.42163124556798687
Energy: 0.4129112156258595
Energy: 0.42161190323029674
Energy: 0.4167782408962952
Energy: 0.4320336629064738
Energy: 0.41646463886231655
Energy: 0.41624860208774883
Energy: 0.4448043988867661
Energy: 0.4088289712704251
Energy: 0.42960408629296926
Energy: 0.44113329165469506
Energy: 0.4418562991232577
Energy: 0.4226610693542372
Energy: 0.4343832753224555
Energy: 0.42299158272457893
Energy: 0.4183200763936238
Energy: 0.4142414572800712
Energy: 0.4128090310036252
Energy: 0.4320017074752419
Energy: 0.425024892777326
Energy: 0.41680121388796154
Energy: 0.421195989687507
Energy: 0.41938049089335155
Energy: 0.4314751063082095
Energy: 0.4391472791467736
Energy: 0.4213784619981346
Energy: 0.44641290090287683
Energy: 0.41494706819167493
Energy: 0.4229177635076171
Energy: 0.4335721510651028
Energy: 0.4056502057657272
Energy: 0.4373174326892271
Energy: 0.4444871530822885
Energy: 0.42360063054555425
Energy: 0.43694150830918754
Energy: 0.44310427197440666
Energy: 0.4373065095226314
Energy: 0.4361843614019356
Energy: 0.4078726267931567
Energy: 0.4171923609267917
Energy: 0.41514715499147714
Energy: 0.41684289426922927
Energy: 0.41437532112380393
Energy: 0.4086071732896984
Energy: 0.39903773653497265
Energy: 0.4160168842031149
Energy: 0.43198747322862896
Energy: 0.42291918966510506
Energy: 0.4167513453492303
Energy: 0.4366361863374433
Energy: 0.40860866658461953
Energy: 0.43586554585882636
Energy: 0.4203487228814602
Energy: 0.44358839266141004
Energy: 0.42093513717853354
Energy: 0.4322520495829463
Energy: 0.421149003715657
Energy: 0.4223697927195774
Energy: 0.4150156792048487
Energy: 0.44218890792517596
Energy: 0.4320744250986793
Energy: 0.42458497467708284
Energy: 0.4171655090038562
Energy: 0.4234163520966716
Energy: 0.4172587397265702
Energy: 0.4311726792077378
Energy: 0.4393440031954175
Energy: 0.4225637232468544
Energy: 0.4468456252919137
Energy: 0.416972302863626
Energy: 0.42326729134944047
Energy: 0.43445848081869576
Energy: 0.43307145915612966
Energy: 0.41720317794919864
Energy: 0.46779443865564724
Energy: 0.4192171556183055
Energy: 0.4367877699433142
Energy: 0.4431128538386231
Energy: 0.4174477503309823
Energy: 0.43615186606735884
Energy: 0.4076221101902503
Energy: 0.4146703983535935
Energy: 0.4155251232744403
Energy: 0.4221856030920133
Energy: 0.4324420280596735
Energy: 0.4167341124507627
Energy: 0.39919034750048304
Energy: 0.4130029724736215
Energy: 0.44677913820318965
Energy: 0.41987521082029605
Energy: 0.4169496812745148
Energy: 0.4352131875263817
Energy: 0.4059991373664604
Energy: 0.4178220315412023
Energy: 0.4205479279459749
Energy: 0.4010939631435514
Energy: 0.4208358860887704
Energy: 0.41322947060577286
Energy: 0.42113116903826975
Energy: 0.41228533055111244
Energy: 0.4158568014683771
Energy: 0.4409120632163534
Energy: 0.4319198253112695
Energy: 0.4164297609134345
Energy: 0.43357770940134516
Energy: 0.42258229334529285
Energy: 0.43068378842370897
Energy: 0.431200326311675
Energy: 0.4143076987271344
Energy: 0.4215935195255431
Energy: 0.42180622991884664
Energy: 0.4166817857085161
Energy: 0.4238873901478749
Energy: 0.41773002876794657
Energy: 0.43972884503406773
Energy: 0.4173832407488648
Energy: 0.4180177567183913
Energy: 0.4199558551907427
Energy: 0.44237551786384693
Energy: 0.44425502634232067
Energy: 0.4572196873204085
Energy: 0.4214761796119509
Energy: 0.4348715123780227
Energy: 0.42048053132137586
Energy: 0.4122144607564333
Energy: 0.4214411535984914
Energy: 0.4127080832991744
Energy: 0.41414842929473444
Energy: 0.42704502530899935
Energy: 0.4127180748648595
Energy: 0.43526451107666936
Energy: 0.4202204434425419
Energy: 0.41822349135071524
Energy: 0.4169330316526803
Energy: 0.4129633612617813
Energy: 0.4200888771427188
Energy: 0.41244093011182126
Energy: 0.41489060865037547
Energy: 0.42316971558558164
Energy: 0.41308258178872
Energy: 0.42373835210913496
Energy: 0.4119497596101507
Energy: 0.4220175021973145
Energy: 0.44004551740257764
Energy: 0.4309949058850714
Energy: 0.4402579891496667
Energy: 0.45981180766103597
Energy: 0.42224997346346493
Energy: 0.4303141626545688
Energy: 0.42148577940602433

minimum gb energy = 0.39903773653497265 eV
minimum distance =  2.53629905595228 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.3932912967433855
Energy: 0.38056488932594373
Energy: 0.5471345937567583
Energy: 0.48202635045772996
Energy: 0.45249054436755076
Energy: 0.44846447264976586
Energy: 0.38036926405276383
Energy: 0.3797167336776017
Energy: 0.4249821670146091
Energy: 0.45122667383701803
Energy: 0.4333900973758753
Energy: 0.42093995286198377
Energy: 0.41844486710878737
Energy: 0.4242961840968049
Energy: 0.4184680301553584
Energy: 0.41477080312392905
Energy: 0.4259030623394454
Energy: 0.43396859516448616
Energy: 0.42065212216881664
Energy: 0.4183393721064201
Energy: 0.4157751287347203
Energy: 0.4186182782161224
Energy: 0.41541288917875924
Energy: 0.4507967835404296
Energy: 0.42103354460893133
Energy: 0.4478666503434704
Energy: 0.4525783752986082
Energy: 0.42495401514896813
Energy: 0.417921227390845
Energy: 0.41895587326630473
Energy: 0.4508825858289609
Energy: 0.43372911841475514
Energy: 0.44060302142122604
Energy: 0.4282641598786679
Energy: 0.415948365652649
Energy: 0.3786163233985295
Energy: 0.42043257990086214
Energy: 0.42452976341324555
Energy: 0.42135505300921305
Energy: 0.4250455634250879
Energy: 0.416703262567335
Energy: 0.4163479624449704
Energy: 0.41094773959708936
Energy: 0.432947556567122
Energy: 0.42499419686475
Energy: 0.4389673498250722
Energy: 0.37882833021889395
Energy: 0.38090466335398093
Energy: 0.42325482366137623
Energy: 0.3785424809363479
Energy: 0.42419600083825804
Energy: 0.45788575932179126
Energy: 0.42204252561366196
Energy: 0.44919876257605323
Energy: 0.3983566383049406
Energy: 0.4152282641402805
Energy: 0.37851346460263463
Energy: 0.42396272494899
Energy: 0.4557837390807094
Energy: 0.4143142081749597
Energy: 0.4186779601149154
Energy: 0.4514292414972204
Energy: 0.4151447135429352
Energy: 0.4110389640895551
Energy: 0.43132418842030934
Energy: 0.45163594757671255
Energy: 0.4512587886636891
Energy: 0.42875570751445347
Energy: 0.4157244545462885
Energy: 0.4155067160536772
Energy: 0.41746568227819264
Energy: 0.42119501434251094
Energy: 0.4535361342844417
Energy: 0.4142665179017223
Energy: 0.42024357702505905
Energy: 0.4261498544702122
Energy: 0.46110043656116784
Energy: 0.425854855719608
Energy: 0.4199263429010865
Energy: 0.41405782264358565
Energy: 0.42231083342664194
Energy: 0.4492168758303384
Energy: 0.4258749954649428
Energy: 0.42455563094862064
Energy: 0.387622987286883
Energy: 0.4185097069736082
Energy: 0.4489618116464378
Energy: 0.4243574923623669
Energy: 0.444229775913205
Energy: 0.45234152595563637
Energy: 0.4155230654455561
Energy: 0.41917147550982925
Energy: 0.41418704653260163
Energy: 0.4249147765570043
Energy: 0.43392910942830254
Energy: 0.37913410091682126
Energy: 0.3797348732341907
Energy: 0.4244377068924473
Energy: 0.3794613200428784
Energy: 0.4319579507486417
Energy: 0.42868662815753666
Energy: 0.4399813430274088
Energy: 0.37907337813018716
Energy: 0.3790552432605882
Energy: 0.42501866632775226
Energy: 0.3933349362068183
Energy: 0.42434593000321663
Energy: 0.4373976940997456
Energy: 0.42584775183825796
Energy: 0.45239211288403547
Energy: 0.45487969093695924
Energy: 0.3785129074676611
Energy: 0.41944505675391364
Energy: 0.4244210106455201
Energy: 0.45055803488109847
Energy: 0.44848436795796587
Energy: 0.42074043037148795
Energy: 0.4172448474979505
Energy: 0.42401463957199687
Energy: 0.4172405530045427
Energy: 0.4145218945876306
Energy: 0.42555321517969147
Energy: 0.43402326683876263
Energy: 0.4208276396603201
Energy: 0.41836536582174166
Energy: 0.41568420903194464
Energy: 0.4184418867229729
Energy: 0.41430197548175196
Energy: 0.45087591212896316
Energy: 0.42104492723966463
Energy: 0.44786048825000835
Energy: 0.4529369068546052
Energy: 0.42533127615619676
Energy: 0.41680751214983536
Energy: 0.4193188114230789
Energy: 0.4512809009815685
Energy: 0.4340766696574457
Energy: 0.4342454028593743
Energy: 0.4282290891397394
Energy: 0.41617769486149014
Energy: 0.3789098532813195
Energy: 0.4206228157623367
Energy: 0.4245185839907211
Energy: 0.42157488505871793
Energy: 0.41922385168826143
Energy: 0.3794005072282584
Energy: 0.4164405956362108
Energy: 0.43445433114913706
Energy: 0.4311454806357324
Energy: 0.42491786481083615
Energy: 0.43538534437125004
Energy: 0.378901081346413
Energy: 0.3810564456213174
Energy: 0.42327989614932127
Energy: 0.3807942891336192
Energy: 0.42439393567290873
Energy: 0.458054173663747
Energy: 0.42207986527431557
Energy: 0.44927394838354046
Energy: 0.45227885633252474
Energy: 0.41547517685772817
Energy: 0.37842852360744433
Energy: 0.4239918583745884
Energy: 0.4560893839790156
Energy: 0.41428952825239673
Energy: 0.4188688527225219
Energy: 0.4512074163229595
Energy: 0.41947935729450325
Energy: 0.41079787336979845
Energy: 0.4314779935778526
Energy: 0.4517099454210915
Energy: 0.4331694497664418
Energy: 0.4277810493182391
Energy: 0.4157913682413932
Energy: 0.41534476304418866
Energy: 0.41683230574520186
Energy: 0.42247827818952927
Energy: 0.45337104812920226
Energy: 0.41388573682676505
Energy: 0.4201635286756216
Energy: 0.42534119277358023
Energy: 0.4610831810438849
Energy: 0.426158999041278
Energy: 0.4198784644370249
Energy: 0.4140375263097219
Energy: 0.4222934657678778
Energy: 0.4491534409292289
Energy: 0.42559646176165933
Energy: 0.4247939647680974
Energy: 0.3880628471343671
Energy: 0.41858098883453154
Energy: 0.44940498354512
Energy: 0.4242344989408182
Energy: 0.4435699838340972
Energy: 0.4520177387187518
Energy: 0.4154073106628347
Energy: 0.4189154780690426
Energy: 0.4141844695086917
Energy: 0.42512341919082863
Energy: 0.4341236159326499
Energy: 0.37913591200465446
Energy: 0.37970653838786533
Energy: 0.424531510061207
Energy: 0.3792226612655708
Energy: 0.43180834326350237
Energy: 0.42835995495387386
Energy: 0.4217155249758697
Energy: 0.3791005582868771
Energy: 0.37915623164660356
Energy: 0.42551173023081357

minimum gb energy = 0.37842852360744433 eV
minimum distance =  2.61324189896047 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 0.523194534275716
Energy: 0.43309299992282196
Energy: 0.4323776380470654
Energy: 0.41158675842673337
Energy: 0.42314169738374674
Energy: 0.40281364695952526
Energy: 0.47664054370878683
Energy: 0.41870759314629336
Energy: 0.44083905194080064
Energy: 0.4619609783023664
Energy: 0.4256181534650119
Energy: 0.38511937328516027
Energy: 0.47494564678004575
Energy: 0.459662805234884
Energy: 0.42104929114386125
Energy: 0.44381799736664285
Energy: 0.4402172119641341
Energy: 0.4164689867057098
Energy: 0.42726801557350863
Energy: 0.4124575407660763
Energy: 0.402140316944625
Energy: 0.4479289397378504
Energy: 0.4240176295492789
Energy: 0.4322236488080043
Energy: 0.42446512471405784
Energy: 0.4023870324997715
Energy: 0.41948746282049876
Energy: 0.45082973401697773
Energy: 0.3855856394157317
Energy: 0.4146968144067695
Energy: 0.42778320072973725
Energy: 0.41433807066894957
Energy: 0.38770196201232165
Energy: 0.4178513414166403
Energy: 0.4287837601236147
Energy: 0.394371421920481
Energy: 0.4107988877741914
Energy: 0.4360686121178502
Energy: 0.4283156427630897
Energy: 0.4323674482827124
Energy: 0.4164490707593672
Energy: 0.4210223817541409
Energy: 0.46734082044100916
Energy: 0.4191111824228045
Energy: 0.4062690474538691
Energy: 0.42967498747706817
Energy: 0.4034882508250038
Energy: 0.4103606460465234
Energy: 0.41706765554929026
Energy: 0.40908955330926633
Energy: 0.42889029356257913
Energy: 0.4218342986070475
Energy: 0.43991511015995827
Energy: 0.4075620844977148
Energy: 0.41833491541597534
Energy: 0.4427317201639196
Energy: 0.41458851433166055
Energy: 0.43134668167985113
Energy: 0.445411237901218
Energy: 0.4394173541191684
Energy: 0.4373404779590128
Energy: 0.4914969024079889
Energy: 0.4170386015189885
Energy: 0.438981308471206
Energy: 0.3982225837481848
Energy: 0.4172491820209525
Energy: 0.4402217112957803
Energy: 0.4059691492176259
Energy: 0.4259953543272703
Energy: 0.4715675546050094
Energy: 0.415936035663586
Energy: 0.44266801636183795
Energy: 0.4176174663435314
Energy: 0.434940020033453
Energy: 0.41815539802011004
Energy: 0.4193190228293079
Energy: 0.4315980089582065
Energy: 0.413852262742331
Energy: 0.43416304027778035
Energy: 0.43001822124306066
Energy: 0.4220040448119355
Energy: 0.4841194782422723
Energy: 0.48806332667932406
Energy: 0.43150826883055005
Energy: 0.4910364446167838
Energy: 0.4241844698310102
Energy: 0.4509201602829608
Energy: 0.48291389553119596
Energy: 0.4224745425318877
Energy: 0.40426916350940273
Energy: 0.38938819515636075
Energy: 0.385680610851475
Energy: 0.4294843341035604
Energy: 0.41184823834009154
Energy: 0.4128700397310038
Energy: 0.4015766286481977
Energy: 0.401373142964742
Energy: 0.41701556864708267
Energy: 0.41374992696791824
Energy: 0.43419139577382226
Energy: 0.41325138978951537
Energy: 0.4091090081165923
Energy: 0.41451434248229563
Energy: 0.42595429612549035
Energy: 0.43196350488416213
Energy: 0.4093683470322199
Energy: 0.41191069315909346
Energy: 0.4054241199723017
Energy: 0.4262530935826105
Energy: 0.39967694715508906
Energy: 0.4198288806935131
Energy: 0.4372922347885515
Energy: 0.3852723531329906
Energy: 0.4442751746908553
Energy: 0.4044642604940203
Energy: 0.4360889220830018
Energy: 0.4057369722394811
Energy: 0.4059740370073959
Energy: 0.44017392239994485
Energy: 0.41104414033765724
Energy: 0.40577623288551906
Energy: 0.4736523320713922
Energy: 0.40870233415111223
Energy: 0.40925583932277004
Energy: 0.41186540568065927
Energy: 0.38549837301774087
Energy: 0.39508474929038156
Energy: 0.4293936335553628
Energy: 0.4126760629453507
Energy: 0.4224063784806106
Energy: 0.402651725879169
Energy: 0.4052655246502199
Energy: 0.4278679376201008
Energy: 0.41269036135878817
Energy: 0.4273947533549759
Energy: 0.4092230422549185
Energy: 0.3992760458022278
Energy: 0.41106215701557863
Energy: 0.4167364425910798
Energy: 0.42540917626841857
Energy: 0.4143083199789893
Energy: 0.42318712507867373
Energy: 0.4412719729126671
Energy: 0.48760431259795145
Energy: 0.4353827893201263
Energy: 0.49464775027295654
Energy: 0.42734440256666534
Energy: 0.3856219708353031
Energy: 0.41474305575395853
Energy: 0.42122868588276885
Energy: 0.4368528387713875
Energy: 0.40318333244659127
Energy: 0.4059591400098421
Energy: 0.4149973285791418
Energy: 0.4277010395950191
Energy: 0.4188483430096306
Energy: 0.4189115546121151
Energy: 0.4176066240065465
Energy: 0.44575220479118727
Energy: 0.4142700001177323
Energy: 0.4208910023422882
Energy: 0.4169675238758798
Energy: 0.43187240397276827
Energy: 0.40663223916246466
Energy: 0.4250871408371247
Energy: 0.5028336866408575
Energy: 0.40067858035608317
Energy: 0.42765082481615113
Energy: 0.3940533682295768
Energy: 0.4567998932752337
Energy: 0.4780657466643546
Energy: 0.432213749413474
Energy: 0.41065842394231017
Energy: 0.42073094181801407
Energy: 0.4161647011631214

minimum gb energy = 0.38511937328516027 eV
minimum distance =  2.58327730494051 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.5059109127363763
Energy: 0.5540377339415186
Energy: 0.5115018394529687
Energy: 0.45481566940982854
Energy: 0.5065990891392941
Energy: 0.507104529279592
Energy: 0.5529236949878751
Energy: 0.5279535987853925
Energy: 0.5020765465195951
Energy: 0.4233019454257843
Energy: 0.43965924745777424
Energy: 0.41689445343015236
Energy: 0.4099891863812953
Energy: 0.49426912105883514
Energy: 0.5022378276052145
Energy: 0.5427014295967207
Energy: 0.478746842626029
Energy: 0.5020195680089136
Energy: 0.4806103849335557
Energy: 0.44403534810820433
Energy: 0.47882159928371276
Energy: 0.4433942625729578
Energy: 0.4761342913729439
Energy: 0.5057333109332858
Energy: 0.5138968491944221
Energy: 0.5096007373473961
Energy: 0.5064959912120316
Energy: 0.4967110952488689
Energy: 0.4385487123101265
Energy: 0.4755394601792843
Energy: 0.47509644447449173
Energy: 0.46686955657888085
Energy: 0.47350166120343845
Energy: 0.4675500735975983
Energy: 0.5130816098508575
Energy: 0.4476407287921322
Energy: 0.4806901124030583
Energy: 0.4536406467338639
Energy: 0.48902475846087096
Energy: 0.45606921060553773
Energy: 0.4685479037778145
Energy: 0.4483865013845592
Energy: 0.47981057044438336
Energy: 0.48050519936690356
Energy: 0.4586264427113326
Energy: 0.4437225046196974
Energy: 0.4835324280612381
Energy: 0.4569246487002828
Energy: 0.5011092408061278
Energy: 0.4473324164920844
Energy: 0.4653681139114277
Energy: 0.4395377717572174
Energy: 0.41430482541947855
Energy: 0.45067264234986737
Energy: 0.4527981605887094
Energy: 0.4452310269019471
Energy: 0.4072434080871805
Energy: 0.45611478418214746
Energy: 0.44767524640541395
Energy: 0.4591364004797829
Energy: 0.46301175311928083
Energy: 0.46893920634186015
Energy: 0.4616748870286945
Energy: 0.48070459134371873
Energy: 0.44534215590635406
Energy: 0.42423266037004836
Energy: 0.4428072765532786
Energy: 0.41972619639883574
Energy: 0.4473178387758366
Energy: 0.4452075074073186
Energy: 0.4452015015533832
Energy: 0.42459061350731
Energy: 0.4345096633144827
Energy: 0.44746149260802376
Energy: 0.45263877238369493
Energy: 0.4113029762896473
Energy: 0.4844383323968125
Energy: 0.421527557640598
Energy: 0.43045974485663574
Energy: 0.4631116648002081
Energy: 0.45734443887101306
Energy: 0.4725699169004082
Energy: 0.4812865161759296
Energy: 0.44605450471108815
Energy: 0.44893236419986
Energy: 0.4475525234399633
Energy: 0.444767589699885
Energy: 0.4941524084566932
Energy: 0.41475038318791707
Energy: 0.4503066880242334
Energy: 0.4518211576917228
Energy: 0.4807161167708993
Energy: 0.446535111324818
Energy: 0.47786731950347056
Energy: 0.4549297556221445
Energy: 0.460938065015269
Energy: 0.4583988144655114
Energy: 0.4440199831113648
Energy: 0.42463264734178563
Energy: 0.4688506439220363
Energy: 0.44742059234482556
Energy: 0.45627050831608035
Energy: 0.4569895025646739
Energy: 0.4509690264119042
Energy: 0.4411152909493405
Energy: 0.40697874598355727
Energy: 0.42507648737240994
Energy: 0.4651798503631039
Energy: 0.4902602641496328
Energy: 0.47862097117064484
Energy: 0.4787178237963416
Energy: 0.4863545725993584
Energy: 0.4566763497713321
Energy: 0.5028394544942695
Energy: 0.48211139499951966
Energy: 0.4945556944943687
Energy: 0.5010577103496408
Energy: 0.49860076853763396
Energy: 0.49404094132951365
Energy: 0.45432018498212584
Energy: 0.5032249760425854
Energy: 0.4805829517105752
Energy: 0.5094927678187371
Energy: 0.4873140208782887
Energy: 0.44385015719887155
Energy: 0.5155681358222406
Energy: 0.40276542341963917
Energy: 0.5017363361854433
Energy: 0.46223795940893814
Energy: 0.4724446928693398
Energy: 0.4371128667789289
Energy: 0.4264604694776757
Energy: 0.4775361705410092
Energy: 0.44725929330350395
Energy: 0.539346383373986
Energy: 0.5125273439465313
Energy: 0.46338712415031486
Energy: 0.5077760615771897
Energy: 0.5036674981288977
Energy: 0.4836569382306257
Energy: 0.5123271418684449
Energy: 0.49847840142471395
Energy: 0.45034885330151414
Energy: 0.5316917162092071
Energy: 0.46801483852115483
Energy: 0.4298175050794678
Energy: 0.5596951285602254
Energy: 0.4336537673252132
Energy: 0.4861184716768216
Energy: 0.44229187235581346
Energy: 0.45954230958921516
Energy: 0.46574879071511527
Energy: 0.48406752728928765
Energy: 0.4993875251377082
Energy: 0.5032396566140795
Energy: 0.45204420154956954
Energy: 0.48358670638485657
Energy: 0.5135032650784184
Energy: 0.5056424186697586
Energy: 0.47646796647565753
Energy: 0.5100191325937453
Energy: 0.526644889731891
Energy: 0.5474684287972659
Energy: 0.43401216165665396
Energy: 0.4516032384778189
Energy: 0.47921926391760056
Energy: 0.4100364492223671
Energy: 0.4949147648674473
Energy: 0.45103864304297203
Energy: 0.5436985421249996
Energy: 0.4777793633169537
Energy: 0.5423292666807368
Energy: 0.46477978403243775
Energy: 0.4780220228637378
Energy: 0.5007157154076695
Energy: 0.44389542346020766
Energy: 0.47620972039717546
Energy: 0.5039213094839068
Energy: 0.5151679155384317
Energy: 0.5101742105102113
Energy: 0.5065068951047952
Energy: 0.5009304353642471
Energy: 0.41780166177542927
Energy: 0.4475957990130735
Energy: 0.47303803336938693
Energy: 0.4671394099993571
Energy: 0.47927800451236824
Energy: 0.47169825461544745
Energy: 0.49528335021627085
Energy: 0.4464209559642189
Energy: 0.49221843976621354
Energy: 0.45321651829102244
Energy: 0.48129637566978223
Energy: 0.4566005330065439
Energy: 0.42193104367615536
Energy: 0.4661132379606535
Energy: 0.4789132726336152
Energy: 0.48233060324995974
Energy: 0.46102066992433666
Energy: 0.48110222350259224
Energy: 0.46798983048020604
Energy: 0.4589571002700875
Energy: 0.5008124125067981
Energy: 0.44332331257083163
Energy: 0.46514623014348744
Energy: 0.45160054003837125
Energy: 0.4554689791203207
Energy: 0.4443970530078871
Energy: 0.45124275017378573
Energy: 0.4462043413234606
Energy: 0.4084097458893923
Energy: 0.46718761570144585
Energy: 0.4486820483859173
Energy: 0.4594885445552084
Energy: 0.4835941253916814
Energy: 0.4630682940105196
Energy: 0.4614587714227669
Energy: 0.4276904415796715
Energy: 0.4455081457595979
Energy: 0.4244961699556831
Energy: 0.44240837324933574
Energy: 0.4091978757402164
Energy: 0.4461366225926428
Energy: 0.4603598116325285
Energy: 0.4425739072794538
Energy: 0.4254933178843176
Energy: 0.42748613062629265
Energy: 0.44368343093808565
Energy: 0.4150614422370339
Energy: 0.4127262681055955
Energy: 0.483717809727922
Energy: 0.40507191956294475
Energy: 0.43032193674976965
Energy: 0.4629518646853791
Energy: 0.4596179200696895
Energy: 0.4827525300933438
Energy: 0.4819699997902568
Energy: 0.45404439798712065
Energy: 0.4489875686005299
Energy: 0.44547638568163517
Energy: 0.451635222473249
Energy: 0.47722122122255106
Energy: 0.41461707692516175
Energy: 0.46862025216864617
Energy: 0.45254991480107354
Energy: 0.48812341465709796
Energy: 0.4765453833587383
Energy: 0.44970387017097735
Energy: 0.4566891223346155
Energy: 0.43224010372376614
Energy: 0.4600254161312983
Energy: 0.44432669526225965
Energy: 0.4253814883372766
Energy: 0.4560330349141677
Energy: 0.44652154869746813
Energy: 0.4426661481332203
Energy: 0.4580461234673019
Energy: 0.450144197863494
Energy: 0.4453628757652089
Energy: 0.4083418305259438
Energy: 0.4230860272375771
Energy: 0.44359453452425046
Energy: 0.4639999666210404
Energy: 0.46795081051610793
Energy: 0.46740600677708144
Energy: 0.49653104970176243
Energy: 0.45469813651949803
Energy: 0.4930309959277329
Energy: 0.4807098620248497
Energy: 0.4934986196195556
Energy: 0.5004463177051193
Energy: 0.4722034492969125
Energy: 0.4937656724276508
Energy: 0.4537751423584091
Energy: 0.50691475640851
Energy: 0.4813534567505139
Energy: 0.5122850162144627
Energy: 0.528047034474494
Energy: 0.4434843762940158
Energy: 0.5161022039733976
Energy: 0.46571269283005107
Energy: 0.5019395350192548
Energy: 0.47073928093929623
Energy: 0.4656372062050565
Energy: 0.4419187842587825
Energy: 0.4190174132467541
Energy: 0.49677974517614243
Energy: 0.4456282097326977
Energy: 0.42962116795761685
Energy: 0.5115884060392395
Energy: 0.4422729335428888
Energy: 0.506844267290805
Energy: 0.47674672682708663
Energy: 0.5525675303525637
Energy: 0.49514254874814534
Energy: 0.49764215287419855
Energy: 0.4251177130198304
Energy: 0.502166513655841
Energy: 0.4672325536075448
Energy: 0.4451593113208863
Energy: 0.5588976342394364
Energy: 0.4355671453727079
Energy: 0.5362070978596758
Energy: 0.4427083505440247
Energy: 0.5300768367537848
Energy: 0.4656284817524899
Energy: 0.4847994721720855
Energy: 0.5598748520429158
Energy: 0.5017668861175887
Energy: 0.4532089143939421
Energy: 0.449384617141954
Energy: 0.43847442752711296
Energy: 0.42636108266432915
Energy: 0.50294580530123
Energy: 0.4490901254097432

minimum gb energy = 0.40276542341963917 eV
minimum distance =  2.51997517050157 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.43554701239486693
Energy: 0.447504861848246
Energy: 0.43504821477046346
Energy: 0.439216979903295
Energy: 0.43808331975311593
Energy: 0.43529332351486344
Energy: 0.44667658157686563
Energy: 0.44587347762875096
Energy: 0.5328849890840694
Energy: 0.434873250684963
Energy: 0.43465490954009844
Energy: 0.4351863108541225
Energy: 0.4350679150825632
Energy: 0.5337182962100048
Energy: 0.4330351593241413
Energy: 0.5407888225704023
Energy: 0.4335196376578411
Energy: 0.43585750908847976
Energy: 0.435444526982447
Energy: 0.43421841087193463
Energy: 0.4359002381729792
Energy: 0.4345069605270332
Energy: 0.5421712855397546
Energy: 0.43519513351096606
Energy: 0.436289013000891
Energy: 0.43655322527068824
Energy: 0.43576293365561813
Energy: 0.4465909801451027
Energy: 0.4455938941324045
Energy: 0.533351373473512
Energy: 0.4397447066627783
Energy: 0.5293605316021682
Energy: 0.434733184291274
Energy: 0.43913586165789176
Energy: 0.5331362747903973
Energy: 0.43481333697755514
Energy: 0.5325477504839202
Energy: 0.4338271785070245
Energy: 0.4394696766594851
Energy: 0.4382900262306873
Energy: 0.43456877050464743
Energy: 0.44687140608195447
Energy: 0.43440018929380636
Energy: 0.5333490811390715
Energy: 0.43510356149582363
Energy: 0.4348679766091
Energy: 0.4351044227605167
Energy: 0.43518056390373167
Energy: 0.5327184467964574
Energy: 0.4338781150404411
Energy: 0.5408613920492523
Energy: 0.4342729586901585
Energy: 0.43520403312661504
Energy: 0.43502448729461723
Energy: 0.4349253572209886
Energy: 0.5327170990187767
Energy: 0.43483024369424406
Energy: 0.5339186704853973
Energy: 0.4335479347004039
Energy: 0.4387383789274633
Energy: 0.43777437089038235
Energy: 0.4345143521883724
Energy: 0.4473854108325278
Energy: 0.44551844397267093
Energy: 0.5280063853019892
Energy: 0.43953923679212253
Energy: 0.5297102018749545
Energy: 0.5285278775971656
Energy: 0.43929915471866676
Energy: 0.5283435710654762
Energy: 0.43524022601332985
Energy: 0.5425004936098022
Energy: 0.43422697766440127
Energy: 0.43600784447018176
Energy: 0.43733761553271533
Energy: 0.43510599076200895
Energy: 0.44779138696371223
Energy: 0.4338503974785236
Energy: 0.541205682481033
Energy: 0.4338538387450493
Energy: 0.4353099894132129
Energy: 0.4351818926889215
Energy: 0.4347051647282326
Energy: 0.5326457755951942
Energy: 0.4352181935253447
Energy: 0.5335804943910889
Energy: 0.435081642005045
Energy: 0.4356891243862137
Energy: 0.43496172278994777
Energy: 0.43514476170114097
Energy: 0.5328562880748565
Energy: 0.4351171559305019
Energy: 0.5319987919016362
Energy: 0.43374998883714094
Energy: 0.4393682172740116
Energy: 0.4382236625394038
Energy: 0.4345465415727182
Energy: 0.44683043447097487
Energy: 0.4456694357552721
Energy: 0.5334095510346176
Energy: 0.43943568579975373
Energy: 0.4399125473927646
Energy: 0.4346234973508753
Energy: 0.43451192514754644
Energy: 0.533392614372562
Energy: 0.4332861797573742
Energy: 0.5416343360693437
Energy: 0.4349701718822792
Energy: 0.43603378895598965
Energy: 0.43625627289067154
Energy: 0.43533763043907997
Energy: 0.43589563847161594
Energy: 0.43306258496964883
Energy: 0.5410914911105256
Energy: 0.43491603815456387
Energy: 0.4357292604815744
Energy: 0.4359637958436903
Energy: 0.4342844099353453
Energy: 0.4355018218660602
Energy: 0.445732103452389
Energy: 0.5329117333123192
Energy: 0.4345625668427365
Energy: 0.4350670926421
Energy: 0.4347424419244052
Energy: 0.4350161196872128
Energy: 0.533412280882959
Energy: 0.43531160712439676
Energy: 0.5320540444613479
Energy: 0.43374894001695324
Energy: 0.43921560629265927
Energy: 0.438164963327954
Energy: 0.4351765999498297
Energy: 0.446685666580993
Energy: 0.4356836781160076
Energy: 0.5328662568507435
Energy: 0.4362732261237754
Energy: 0.43502655397130274
Energy: 0.4352729517461377
Energy: 0.4348799650641334
Energy: 0.5318901787229738

minimum gb energy = 0.4330351593241413 eV
minimum distance =  2.52751489415761 Angstroms
sigma value = 23