Model name: model_name=EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_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=4.050000405311585
cohesive_energy=3.360264299713212
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=[7.49495025031932e-20, 2.2398429343319997e-19, 2.9671510173363e-19, 3.30437715526062e-19, 3.5810730599524195e-19, 3.8280966533825396e-19, 4.0490848765101597e-19, 4.2455758189039196e-19, 4.41772969822722e-19, 4.56871882421538e-19, 4.70331768323772e-19, 4.82349695255406e-19, 4.92906437096832e-19, 5.019619394322e-19, 5.09666806865106e-19, 5.162229136514339e-19, 5.2178086439478e-19, 5.26423972280112e-19, 5.3026438967180995e-19, 5.33319740512848e-19, 5.35604444392932e-19, 5.37160157904546e-19, 5.38046161583148e-19, 5.38331349024e-19, 5.3805096811305e-19, 5.37253084149318e-19, 5.35987364608458e-19, 5.34232981194228e-19, 5.31704746465776e-19, 5.27966868378654e-19, 5.22489026467008e-19, 5.146992436725e-19, 5.04094436532054e-19, 4.90229199941418e-19, 4.72701387565458e-19, 4.51126477012014e-19, 4.25192043837456e-19, 3.9458886795142193e-19, 3.58594367691978e-19, 3.1624403272545597e-19, 2.67150136306428e-19, 2.1407963748181196e-19, 1.65530481118344e-19, 1.3319839642656058e-19]
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: 0.012646550809148099
Energy: 0.013243969169636034
Energy: 0.6315739082032039
Energy: 0.50586015031581
Energy: 0.49761210793192745
Energy: 0.15105995933387822
Energy: 0.01328359068355294
Energy: 0.013031488324684955
Energy: 0.5008284924724277
Energy: 0.23799059166492834
Energy: 0.2863531100226811
Energy: 0.28439268243676735
Energy: 0.013045327963249134
Energy: 0.0692723958983173
Energy: 0.01307052309006973
Energy: 0.49716495049950205
Energy: 0.4869704284009864
Energy: 0.2855104349210349
Energy: 0.42867514090648934
Energy: 0.06749189678450349
Energy: 0.06910940320634025
Energy: 0.014258590611335926
Energy: 0.26208063548625227
Energy: 0.4841692984224665
Energy: 0.49586622707882133
Energy: 0.49849088003658254
Energy: 0.06726416122234809
Energy: 0.013636056009464787
Energy: 0.15082283427591217
Energy: 0.4975769957065211
Energy: 0.23959868185283065
Energy: 0.28776708754167907
Energy: 0.2617883499088365
Energy: 0.013103964936278295
Energy: 0.06774283193573039
Energy: 0.012900728092859472
Energy: 0.3306890701962403
Energy: 0.48702256692293067
Energy: 0.2848436584100389
Energy: 0.4280707835083599
Energy: 0.06742315877178158
Energy: 0.06867506209742295

minimum gb energy = 0.012646550809148099 eV
minimum distance =  2.83739601239021 Angstroms
sigma value = 5


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

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Energy: 0.6790572875368033
Energy: 0.6747160370411299
Energy: 0.6597436220069528
Energy: 0.7197863422569831
Energy: 0.6796265928658691
Energy: 0.6790401510001122
Energy: 0.5486340811026298
Energy: 0.67260939748617
Energy: 0.6187534886520115
Energy: 0.6148781807507934
Energy: 0.6437689485624684
Energy: 0.6239607350269899
Energy: 0.6093194203667781
Energy: 0.670365395111698
Energy: 0.6820276718975858
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Energy: 0.6978026816826529
Energy: 0.6610096535201454
Energy: 0.6927259154343973
Energy: 0.5930096715002346
Energy: 0.6073867488988769
Energy: 0.6323485238422123
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Energy: 0.6248881449627223
Energy: 0.6314472266450307
Energy: 0.7114967094120866
Energy: 0.6400509293487581
Energy: 0.6689690978937372
Energy: 0.6114028106414563
Energy: 0.6131616959360306
Energy: 0.6356686812027466
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Energy: 0.7031742894674949
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Energy: 0.5689861735164825
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Energy: 0.6608395840720116
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Energy: 0.592410950484627
Energy: 0.6239337519446588
Energy: 0.6285617247238968
Energy: 0.6078593254002986
Energy: 0.6363878006280612
Energy: 0.6183226811045526
Energy: 0.6174692795812846
Energy: 0.6736385498306429
Energy: 0.620611425027621
Energy: 0.60530957438336
Energy: 0.6081080521621641
Energy: 0.6250988062068182
Energy: 0.6517853681083206
Energy: 0.5673002576452569
Energy: 0.6252254848538703
Energy: 0.6404634136476542
Energy: 0.6489432526964013
Energy: 0.6353803962191211
Energy: 0.6709439319041525
Energy: 0.6626828625499016
Energy: 0.6527079486943844
Energy: 0.5960308600719579
Energy: 0.6374046394028537
Energy: 0.7008503912052314
Energy: 0.661230670650297
Energy: 0.6606035006904918
Energy: 0.646849215756474
Energy: 0.5663770151224707
Energy: 0.6335523658655229
Energy: 0.645323070728681
Energy: 0.69790866661017
Energy: 0.616214297578807
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Energy: 0.6383064717382201
Energy: 0.6359593850400638
Energy: 0.703012333855431
Energy: 0.6216970422114696
Energy: 0.6143610821709004

minimum gb energy = 0.5446355580082347 eV
minimum distance =  2.59796408794074 Angstroms
sigma value = 401


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

Energy: 0.5651288437838918
Energy: 0.6162234950621759
Energy: 0.6397100002384868
Energy: 0.7120507668511259
Energy: 0.6960914706207529
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Energy: 0.6403795426308211
Energy: 0.6057423645205613
Energy: 0.6464139874864926
Energy: 0.6470963752686583
Energy: 0.7051648833997948
Energy: 0.5908599000923452
Energy: 0.6191368864163238
Energy: 0.688581991234796
Energy: 0.6968779729181326
Energy: 0.6332567070323453
Energy: 0.6508660290116864
Energy: 0.5963849681403309
Energy: 0.57101973494261
Energy: 0.6245411374202124
Energy: 0.6124417177055574
Energy: 0.7641497891039025
Energy: 0.6673316657839543
Energy: 0.6199017279783982
Energy: 0.6662690149131228
Energy: 0.5394521339314214
Energy: 0.616652044132895
Energy: 0.5846669780463233
Energy: 0.6314902154078966
Energy: 0.6412579099843607
Energy: 0.5708159302031125
Energy: 0.589199493460645
Energy: 0.5369235754745337
Energy: 0.6153020798524036
Energy: 0.6007068641358312
Energy: 0.6803308726167373
Energy: 0.6792115005120638
Energy: 0.5591644812228564
Energy: 0.6048063228799617
Energy: 0.5646179248403155
Energy: 0.684589352782247
Energy: 0.5726133574307176
Energy: 0.6081244588571507
Energy: 0.7083782471465601
Energy: 0.6276446977904898
Energy: 0.6518276821699345
Energy: 0.6446672735436874
Energy: 0.6595086256979922
Energy: 0.6013367533566154
Energy: 0.5991428540872155
Energy: 0.7027866224423371
Energy: 0.657119459965433
Energy: 0.6543771501690968
Energy: 0.5674287039995254
Energy: 0.6907935903306804
Energy: 0.6116862928052639
Energy: 0.6069493181314202
Energy: 0.5702843525873251
Energy: 0.728642922410499
Energy: 0.6062570213116558
Energy: 0.6385119588908935
Energy: 0.6490003266222844
Energy: 0.5851295934369668
Energy: 0.5642119864565329
Energy: 0.5626943456846873
Energy: 0.6787755287523667
Energy: 0.6931433087769279
Energy: 0.6042173526536161
Energy: 0.6418204174694835
Energy: 0.6028853907346677
Energy: 0.5953638095592897
Energy: 0.5943790066495208
Energy: 0.5901538882196018
Energy: 0.6185715599400825
Energy: 0.6664621131993579
Energy: 0.6444516948015446
Energy: 0.6355467477246101
Energy: 0.6021581815116451
Energy: 0.6510800080291584
Energy: 0.6296255642493914
Energy: 0.696369231468814
Energy: 0.5475275377137625
Energy: 0.6275882706051944
Energy: 0.6857583563502512
Energy: 0.6985340207027421
Energy: 0.6351525943895933
Energy: 0.5988629992110126
Energy: 0.6087941335978794
Energy: 0.6013109318212473
Energy: 0.6328493520599873
Energy: 0.6362556972881854
Energy: 0.704863544290131
Energy: 0.6873597489417519
Energy: 0.6365170284427739
Energy: 0.5940227642040272
Energy: 0.6277382700130711
Energy: 0.667714113541145
Energy: 0.5617149990740304
Energy: 0.6188510037670878
Energy: 0.6798894732048538
Energy: 0.6043531121627032
Energy: 0.5848944348562122

minimum gb energy = 0.5367571524087247 eV
minimum distance =  2.59698468890338 Angstroms
sigma value = 311


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

Energy: 0.5766534861361539
Energy: 0.6978312937529493
Energy: 0.6149923578391994
Energy: 0.6105087398796762
Energy: 0.6253074279256352
Energy: 0.6498969412314899
Energy: 0.6691514774017153
Energy: 0.5925326779011589
Energy: 0.626278412539419
Energy: 0.5671075133574206
Energy: 0.6603096589366102
Energy: 0.6019912794101194
Energy: 0.6049730143337014
Energy: 0.6282781976440304
Energy: 0.5787782921125512
Energy: 0.6537076435920355
Energy: 0.6704872981519817
Energy: 0.6457316178631657
Energy: 0.6649908176309535
Energy: 0.6176118798189194
Energy: 0.6559850905580424
Energy: 0.6624593324110722
Energy: 0.6396578682655499
Energy: 0.5957267847769402
Energy: 0.5850610556829321
Energy: 0.599853866767101
Energy: 0.5441638952823464
Energy: 0.6291505799532098
Energy: 0.6016181138515623
Energy: 0.6857853402292302
Energy: 0.5765943896118472
Energy: 0.6675897989551368
Energy: 0.5837999213246454
Energy: 0.6450778112775702
Energy: 0.6420168434258456
Energy: 0.6366124089412154
Energy: 0.5698368613938725
Energy: 0.5695782690869121
Energy: 0.5570509135817492
Energy: 0.64365222056395
Energy: 0.6454946899618647
Energy: 0.5954331998994453
Energy: 0.6019821792416568
Energy: 0.6585029919452912
Energy: 0.6027745873184953
Energy: 0.6394584945986116
Energy: 0.6491524972417944
Energy: 0.6381106272635427
Energy: 0.6197296725943418
Energy: 0.6052660513614266
Energy: 0.6617669727038262
Energy: 0.6009434949847858
Energy: 0.6334298823618435
Energy: 0.6142195350707293
Energy: 0.6487738623314543
Energy: 0.6183815571812071
Energy: 0.6494013670180379
Energy: 0.6265214418142908
Energy: 0.6271118630461492
Energy: 0.6286749852639054
Energy: 0.6035978352814376
Energy: 0.6300630296681542
Energy: 0.6068291247124887
Energy: 0.5233410477639031
Energy: 0.647009765209069
Energy: 0.5772349755895237
Energy: 0.5694593189806111
Energy: 0.6122429517674389
Energy: 0.5804569946809893
Energy: 0.6457594828473023
Energy: 0.6401976392311264
Energy: 0.677116476187679
Energy: 0.5952736270981013
Energy: 0.624334374474828
Energy: 0.6222189064953194
Energy: 0.6312668630019975
Energy: 0.6367750917507288
Energy: 0.6236271099160243
Energy: 0.5878275916390353
Energy: 0.5858102669425881
Energy: 0.5879121415881859
Energy: 0.6100376819499207
Energy: 0.6431949731431192
Energy: 0.5900671153320215
Energy: 0.6044644284141326
Energy: 0.6431907234699457
Energy: 0.5832676511175368
Energy: 0.6050290571885634
Energy: 0.5907411119216246
Energy: 0.6544019352951531
Energy: 0.644209099674938
Energy: 0.6177808458642307
Energy: 0.6432725438370993
Energy: 0.6202151065368915
Energy: 0.6157982851229407
Energy: 0.6378640202770685
Energy: 0.6248244634286716
Energy: 0.6537589295782119
Energy: 0.6321577608995859
Energy: 0.6087969405361034
Energy: 0.6457669685816517
Energy: 0.6246212135706662
Energy: 0.6395701956594888
Energy: 0.6313782568780287
Energy: 0.6151751171024534
Energy: 0.5357900356510803
Energy: 0.6608027520995269
Energy: 0.5778604129534913
Energy: 0.5955886308425726
Energy: 0.5915158902216395
Energy: 0.5935450945566153
Energy: 0.628179960756957
Energy: 0.6383859942740039
Energy: 0.6745436420161668
Energy: 0.5956373907898932
Energy: 0.6521789026483351
Energy: 0.6132475518859661
Energy: 0.6680750931046991
Energy: 0.6446077248869141
Energy: 0.6679790560295883
Energy: 0.5990225125962596
Energy: 0.5852232329093726
Energy: 0.6063768949756287
Energy: 0.6086554276578698
Energy: 0.5769445679629872
Energy: 0.6060318497286721
Energy: 0.6393771260197189
Energy: 0.6357410896920354
Energy: 0.5812702398594295
Energy: 0.6157496713785523
Energy: 0.6096369694589977
Energy: 0.6355058729555901
Energy: 0.6391126385217466
Energy: 0.5905744535775114
Energy: 0.6637799066257284
Energy: 0.6084477700748923
Energy: 0.6193757313739036
Energy: 0.653461640102753
Energy: 0.6515900203733256
Energy: 0.6639715140286441
Energy: 0.6461500983776378
Energy: 0.6069978894815516
Energy: 0.6313136827157182
Energy: 0.6180427501955206
Energy: 0.5842951288310856
Energy: 0.6011864733284936
Energy: 0.6058697710828257
Energy: 0.5509396568734719
Energy: 0.6192817456849227
Energy: 0.60062050049996
Energy: 0.6125922599919833
Energy: 0.5938406150417881
Energy: 0.6139738817204592
Energy: 0.6360092800044129
Energy: 0.6560787705597138
Energy: 0.6928885617062133
Energy: 0.5857541923347386
Energy: 0.6595965716371319
Energy: 0.6058396377212087
Energy: 0.6485628622015196
Energy: 0.6315040973278483
Energy: 0.5412412191581447
Energy: 0.6489852212589158
Energy: 0.612406590528542
Energy: 0.5732337197574837
Energy: 0.5803157182427112
Energy: 0.5796124479814727
Energy: 0.6291741748280216
Energy: 0.6483920407050882
Energy: 0.6351027835719546
Energy: 0.6356115760202998
Energy: 0.6144587342399895
Energy: 0.5827643741880552
Energy: 0.5949072745373909
Energy: 0.6443536959031771
Energy: 0.6018213238198163
Energy: 0.6633575569249441
Energy: 0.6201380766617051
Energy: 0.6445526262957318
Energy: 0.6175326050413529
Energy: 0.6292006786140626
Energy: 0.6629722272084521
Energy: 0.6126246238505699
Energy: 0.6502182480065238
Energy: 0.6238710356179681
Energy: 0.59417294043268
Energy: 0.637972291504465
Energy: 0.6116524531841012
Energy: 0.6175155094878556
Energy: 0.6270604126557241
Energy: 0.6246546656886739
Energy: 0.5906123741765884
Energy: 0.6021550551660713
Energy: 0.6126613330602497
Energy: 0.6019610047008616
Energy: 0.6065815325629401
Energy: 0.6571523775226832
Energy: 0.7087461391802967
Energy: 0.5889659361916751
Energy: 0.6673467255604643
Energy: 0.579057748724374
Energy: 0.6655421242186622
Energy: 0.6317165193953952
Energy: 0.5532586542719005
Energy: 0.6096905140767331
Energy: 0.6270260533987233
Energy: 0.5790487565440496
Energy: 0.5987941926638617
Energy: 0.5762242328024783
Energy: 0.6103859428188817
Energy: 0.6526426341091159
Energy: 0.6239886919181292
Energy: 0.6484685317956352
Energy: 0.6282821782765611
Energy: 0.5956705085943048
Energy: 0.618448781547866
Energy: 0.6343105045822801
Energy: 0.6142808071567926
Energy: 0.6747101355552229
Energy: 0.6189013057806428
Energy: 0.6621516563518811
Energy: 0.6363813166042246
Energy: 0.6332739832860758
Energy: 0.6798396166003039
Energy: 0.6220044096139317
Energy: 0.659163679541459
Energy: 0.5994731578840286
Energy: 0.6054543779438378
Energy: 0.620703236563425
Energy: 0.6551809525980027
Energy: 0.6207608697757825
Energy: 0.6275632749782551
Energy: 0.5964443994059189
Energy: 0.5957954723096333
Energy: 0.5568066470708644
Energy: 0.6258030473435652
Energy: 0.6719958217942439
Energy: 0.5975098257756033
Energy: 0.6608591894349635
Energy: 0.6635410681588734
Energy: 0.6007404087115248
Energy: 0.6428570792459477
Energy: 0.5903145744862113
Energy: 0.6510366105734072
Energy: 0.6591349862220459
Energy: 0.6816597423891687
Energy: 0.6614969423368566
Energy: 0.6560523931652303
Energy: 0.5558825496925272
Energy: 0.5932956639633165
Energy: 0.524352332653764
Energy: 0.6238016183342804

minimum gb energy = 0.5233410477639031 eV
minimum distance =  2.5707211421425 Angstroms
sigma value = 39


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

Energy: 0.5782930235312133
Energy: 0.5049110096705887
Energy: 0.7541166459789473
Energy: 0.607906304374883
Energy: 0.5813157265334473
Energy: 0.6347977709861793
Energy: 0.50368909800241
Energy: 0.45873540809449115
Energy: 0.599883618935377
Energy: 0.58455435020759
Energy: 0.5463109438031346
Energy: 0.4997896096598575
Energy: 0.5478738232262786
Energy: 0.7076930213097293
Energy: 0.5957328583591276
Energy: 0.6457682553777929
Energy: 0.5848062472251745
Energy: 0.5840270250549179
Energy: 0.5495079228952534
Energy: 0.6076713750872152
Energy: 0.636610937735612
Energy: 0.5679001574767494
Energy: 0.6923716005368822
Energy: 0.5797408457691274
Energy: 0.5793724873580391
Energy: 0.5792235680212634
Energy: 0.583016078604022
Energy: 0.6276156377025407
Energy: 0.6137456709701908
Energy: 0.5004674490075649
Energy: 0.5896657893146989
Energy: 0.6332412700335273
Energy: 0.597015508863968
Energy: 0.5981298308636781
Energy: 0.5521228615986319
Energy: 0.5703738709089966
Energy: 0.580093874289394
Energy: 0.5814484993628626
Energy: 0.790208688739794
Energy: 0.5124194513850254
Energy: 0.5778815743028687
Energy: 0.6232116167065148
Energy: 0.6390537561266688
Energy: 0.5963592927591569
Energy: 0.5301606053529766
Energy: 0.6548125039164364
Energy: 0.5041427425736392
Energy: 0.5040893124654483
Energy: 0.5988745532055018
Energy: 0.571229146317461
Energy: 0.6333110298022508
Energy: 0.6018191907302877
Energy: 0.6552419057881033
Energy: 0.5460174489019931
Energy: 0.5828397960907564
Energy: 0.6147570050994632
Energy: 0.5711160635239362
Energy: 0.5128492730123579
Energy: 0.6722289509629077
Energy: 0.6332637574536327
Energy: 0.6574001669633984
Energy: 0.5881458012865439
Energy: 0.6159227553774931
Energy: 0.6174386677740193
Energy: 0.6701555725831498
Energy: 0.5606481308098248
Energy: 0.5348193612100696
Energy: 0.5167589863948059
Energy: 0.5492476982347791
Energy: 0.6998150706934779
Energy: 0.5674135039420997
Energy: 0.6409797430626956
Energy: 0.561002983759592
Energy: 0.688114543366377
Energy: 0.5506722173453751
Energy: 0.5738403855459441
Energy: 0.6299487277776312
Energy: 0.61310757492551
Energy: 0.5006204008314596
Energy: 0.5808468259607352
Energy: 0.5720868239668906
Energy: 0.5283725208623133
Energy: 0.6409329262786126
Energy: 0.6302253026306722
Energy: 0.5576977074785475
Energy: 0.5003314706378765
Energy: 0.5887339130258235
Energy: 0.5844919673243679
Energy: 0.545643594035641
Energy: 0.6459666786379796
Energy: 0.5585538570601548
Energy: 0.6197002066110098
Energy: 0.5915597528573276
Energy: 0.5804575545952467
Energy: 0.686081573694488
Energy: 0.5046303099905246
Energy: 0.5161667961968797
Energy: 0.5775945776022076
Energy: 0.5168743942432316
Energy: 0.5994853619221564
Energy: 0.5306957574189567
Energy: 0.6338163984408914
Energy: 0.5045230653148353
Energy: 0.5030669168814336
Energy: 0.623783990708546
Energy: 0.5758634122517163
Energy: 0.6431836713732636
Energy: 0.6723194811397626
Energy: 0.5445700952870017
Energy: 0.5814138264260255
Energy: 0.6333189048650948
Energy: 0.5055170264211002
Energy: 0.577983623834207
Energy: 0.6000118796154604
Energy: 0.5840954383952768
Energy: 0.5451608452962279
Energy: 0.49970691114777177
Energy: 0.5475297188246401
Energy: 0.6231590133180958
Energy: 0.5957534020710139
Energy: 0.6457577557990408
Energy: 0.5842116392508107
Energy: 0.5836428541047975
Energy: 0.5495722911702311
Energy: 0.6078593224257157
Energy: 0.6405040325089398
Energy: 0.5679863636806688
Energy: 0.6896364286618247
Energy: 0.5799912161744822
Energy: 0.5793806252924826
Energy: 0.5429276676661571
Energy: 0.5831751808160368
Energy: 0.6276202380829844
Energy: 0.6143797266708964
Energy: 0.5012452870419154
Energy: 0.5900701070771764
Energy: 0.6326343778062341
Energy: 0.5987598056821827
Energy: 0.5994010456105813
Energy: 0.558509122378279
Energy: 0.5705205366588488
Energy: 0.5800063478142554
Energy: 0.5818681010730448
Energy: 0.7923998305025592
Energy: 0.5124827823896057
Energy: 0.5162765213863412
Energy: 0.623236196320992
Energy: 0.5566947596070677
Energy: 0.5968038824717462
Energy: 0.5302103317086992
Energy: 0.6401931129420241
Energy: 0.5041435972406266
Energy: 0.5039497893613636
Energy: 0.5882962793393294
Energy: 0.5712220322082536
Energy: 0.6337793738301484
Energy: 0.6577269333312583
Energy: 0.6551710019177507
Energy: 0.5468380358435969
Energy: 0.5828546848304405
Energy: 0.613888150327624
Energy: 0.5710436985925806
Energy: 0.5123444898952586
Energy: 0.67236203448868
Energy: 0.6332937678376019
Energy: 0.6564537281061813
Energy: 0.5882962104562848
Energy: 0.6220667811903299
Energy: 0.6177636373275158
Energy: 0.7562160602289543
Energy: 0.5604135550324874
Energy: 0.534356492565029
Energy: 0.5167546073567099
Energy: 0.5498023198816264
Energy: 0.6993734918927819
Energy: 0.5673254922907065
Energy: 0.6416590866600214
Energy: 0.5609949052322071
Energy: 0.6881088382546705
Energy: 0.5012416069735177
Energy: 0.5832165428438484
Energy: 0.6301763425849507
Energy: 0.6129167858646539
Energy: 0.5004885983813183
Energy: 0.5813582501333245
Energy: 0.5734263391596309
Energy: 0.5278809487678953
Energy: 0.6390446793791689
Energy: 0.6291682664230944
Energy: 0.5575780242343803
Energy: 0.5004321975482249
Energy: 0.5884742860110723
Energy: 0.5844689577745136
Energy: 0.5460564253686282
Energy: 0.6457784733972308
Energy: 0.5858537655375075
Energy: 0.6196421892061571
Energy: 0.623102320492844
Energy: 0.5809759981012135
Energy: 0.6863390474124618
Energy: 0.5051578589106754
Energy: 0.5160492020072821
Energy: 0.5848384786450261
Energy: 0.5168341147841408
Energy: 0.5994187783286632
Energy: 0.5310216197517131
Energy: 0.6787866744088774
Energy: 0.5044070457096209
Energy: 0.5030484359235503
Energy: 0.6227603625742434

minimum gb energy = 0.45873540809449115 eV
minimum distance =  2.60153743551312 Angstroms
sigma value = 21


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

Energy: 0.6721777786646838
Energy: 0.6613626624519021
Energy: 0.7157670708670134
Energy: 0.7093112766910519
Energy: 0.6198919647971557
Energy: 0.6059747378118513
Energy: 0.6603515014601389
Energy: 0.575149180992121
Energy: 0.7419821349717867
Energy: 0.6977704847209333
Energy: 0.663577956480184
Energy: 0.661608165947907
Energy: 0.6741885087103324
Energy: 0.6088120639421845
Energy: 0.5539704217632492
Energy: 0.6653153133428441
Energy: 0.6016393063374469
Energy: 0.6598987151907675
Energy: 0.6621600645259968
Energy: 0.5697166799925338
Energy: 0.6439172959736903
Energy: 0.6554902211035215
Energy: 0.6859998486846285
Energy: 0.5784060234708311
Energy: 0.6288672403337725
Energy: 0.5440887770180174
Energy: 0.6020991901592238
Energy: 0.6692411265670266
Energy: 0.5590343100341832
Energy: 0.5311636335740041
Energy: 0.664498103335805
Energy: 0.598142807199644
Energy: 0.6722442501348739
Energy: 0.7190997314869887
Energy: 0.5084715733425813
Energy: 0.4872586717106954
Energy: 0.5965344264462372
Energy: 0.5383370999750828
Energy: 0.6630321451715347
Energy: 0.651677889758594
Energy: 0.6298895973949724
Energy: 0.5690130764427505
Energy: 0.6063122434104509
Energy: 0.7129476432949846
Energy: 0.5612084057135538
Energy: 0.5887471454648799
Energy: 0.5620950147332587
Energy: 0.5150262796815063
Energy: 0.6990974523923902
Energy: 0.5023619987958823
Energy: 0.6847730777925928
Energy: 0.5874365368862015
Energy: 0.6367181601703409
Energy: 0.5879695895379529
Energy: 0.5270642109476874
Energy: 0.5774513391995589
Energy: 0.6040335346228489
Energy: 0.6016693971528256
Energy: 0.6080729269253186
Energy: 0.612460049406127
Energy: 0.6842488744439978
Energy: 0.7035821587136041
Energy: 0.642963401588844
Energy: 0.5188067501087343
Energy: 0.6372967442848843
Energy: 0.5808737931468129
Energy: 0.6879101659253204
Energy: 0.568058052676606
Energy: 0.5911179867605616
Energy: 0.6444985950416197
Energy: 0.5967351199522456
Energy: 0.6661786494648276
Energy: 0.5478515876108991
Energy: 0.6791467210805586
Energy: 0.5959833885006653
Energy: 0.6985517148628599
Energy: 0.6090003921075919
Energy: 0.5515947732461777
Energy: 0.7039208002293718
Energy: 0.6216469459552468
Energy: 0.7574902939992123
Energy: 0.6053724798535662
Energy: 0.5822035331678125
Energy: 0.6857223984193355
Energy: 0.5833307285903279
Energy: 0.6447831270062458
Energy: 0.6581549493674594
Energy: 0.6916538834436587
Energy: 0.5856602656716303
Energy: 0.5812458601945709
Energy: 0.629417941723706
Energy: 0.6185899797809896
Energy: 0.7737547061837294
Energy: 0.6397815008170217
Energy: 0.7372635422971039
Energy: 0.5557761048276044
Energy: 0.6335495337340716
Energy: 0.6529478422650237
Energy: 0.5665237071288065
Energy: 0.7567863486507583
Energy: 0.6108529338877188
Energy: 0.6029504506030012
Energy: 0.5652541802228837
Energy: 0.6755660248069987
Energy: 0.6779567085605634
Energy: 0.5764819518836473
Energy: 0.6868570496781268
Energy: 0.5772172882518976
Energy: 0.6791841140645303
Energy: 0.616433776894614
Energy: 0.648855013821832
Energy: 0.6185162837513096
Energy: 0.49188415079249453
Energy: 0.5181147909654455
Energy: 0.5975960908545574
Energy: 0.5915864293355322
Energy: 0.6744262147493449
Energy: 0.5911988718934388
Energy: 0.6904589331100562
Energy: 0.5684141254378889
Energy: 0.6077769855222656
Energy: 0.7088376065950441
Energy: 0.6291601137167657
Energy: 0.6428632260447077
Energy: 0.6442382473922611
Energy: 0.614592052139868
Energy: 0.6213152691489742
Energy: 0.7119809950432635
Energy: 0.586107792455678
Energy: 0.5888576661828637
Energy: 0.510559233116135
Energy: 0.5103769144321952
Energy: 0.6846932635226726
Energy: 0.5415368975661647
Energy: 0.6711829726079914
Energy: 0.5751794224465866
Energy: 0.5893680662698857
Energy: 0.5210150261796905
Energy: 0.5494268067597458
Energy: 0.5827496850190087
Energy: 0.5467357097538909
Energy: 0.5626362929159828
Energy: 0.676668631944539
Energy: 0.5726287098184675
Energy: 0.6442657714217597
Energy: 0.6081018911801701
Energy: 0.6288806419895936
Energy: 0.5186138767417285
Energy: 0.5682782636684583
Energy: 0.5259318412088447
Energy: 0.539513499799921
Energy: 0.5636020746983411
Energy: 0.6160466245702059
Energy: 0.6792921564274502
Energy: 0.6180380892149702
Energy: 0.6466679478648957
Energy: 0.6684536386116088
Energy: 0.6393636465939236
Energy: 0.7629506474690456
Energy: 0.6784379101375034
Energy: 0.625035788095616
Energy: 0.6044216595919011
Energy: 0.6643738550439007
Energy: 0.5554320331174878
Energy: 0.6043970578040808
Energy: 0.6120760727303788
Energy: 0.6154944163887714
Energy: 0.7205516570866655
Energy: 0.618594335669966
Energy: 0.7327598405723378
Energy: 0.6607669549163919
Energy: 0.6820854280807696
Energy: 0.6857568218731619
Energy: 0.6586814611530807
Energy: 0.6088108951265048

minimum gb energy = 0.4872586717106954 eV
minimum distance =  2.60043150815579 Angstroms
sigma value = 113


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

Energy: 0.6763749657564833
Energy: 0.768385813744211
Energy: 0.705484160236324
Energy: 0.7079488650408101
Energy: 0.6944708554421674
Energy: 0.69002232334056
Energy: 0.7659194804159432
Energy: 0.7095763091776401
Energy: 0.702515427894024
Energy: 0.7045548655459859
Energy: 0.7347303995327802
Energy: 0.7255829311803621
Energy: 0.6758251199326808
Energy: 0.681588303687047
Energy: 0.7134750496012191
Energy: 0.700664796120271
Energy: 0.6741867392909034
Energy: 0.6454623601439252
Energy: 0.6881279471137906
Energy: 0.6617889478086693
Energy: 0.6863978982831844
Energy: 0.6290561592259467
Energy: 0.7066125294400207
Energy: 0.6468869268145748
Energy: 0.7114501058241073
Energy: 0.6887252865304224
Energy: 0.6522863257924665
Energy: 0.6594498028705549
Energy: 0.658610028244041
Energy: 0.6390403620492157
Energy: 0.6328051355391038
Energy: 0.6777767364386946
Energy: 0.7549949551322992
Energy: 0.7177963515572627
Energy: 0.6905997966082302
Energy: 0.619115796466696
Energy: 0.7076285631636645
Energy: 0.6834186722303047
Energy: 0.6618737568967914
Energy: 0.6490563826326801
Energy: 0.6528205137897216
Energy: 0.640962769837931
Energy: 0.7074943594800488
Energy: 0.6380890969963751
Energy: 0.6861899933551567
Energy: 0.658366247911483
Energy: 0.6555239353452912
Energy: 0.6878090856390439
Energy: 0.6717791852518838
Energy: 0.6080325981781793
Energy: 0.6710482272114818
Energy: 0.703616717813564
Energy: 0.7065644072356273
Energy: 0.7110858449547104
Energy: 0.6495071477097437
Energy: 0.6447852364636496
Energy: 0.6880216674633404
Energy: 0.7016790228705274
Energy: 0.6709337572040015
Energy: 0.7015801667626215
Energy: 0.6733910761389694
Energy: 0.6735255161039199
Energy: 0.7199200769895773
Energy: 0.6531089189560688
Energy: 0.6716466451366224
Energy: 0.6888722754476434
Energy: 0.6412734558654317
Energy: 0.7224387910181437
Energy: 0.7376854831541664
Energy: 0.574040526249144
Energy: 0.6670634002030182
Energy: 0.6814462884698834
Energy: 0.6907249620187816
Energy: 0.6689793313918265
Energy: 0.6841222737563631
Energy: 0.6757027644128352
Energy: 0.6855166474426047
Energy: 0.6991710055542205
Energy: 0.7287715203137498
Energy: 0.6685478784807192
Energy: 0.6790986986350739
Energy: 0.5868149366528478
Energy: 0.6395058510913918
Energy: 0.685720813104643
Energy: 0.6959665896188227
Energy: 0.7030507007380644
Energy: 0.6641445002239523
Energy: 0.7027928552409298
Energy: 0.6983588581056318
Energy: 0.6594814228230089
Energy: 0.6388404642110431
Energy: 0.6694373524225232
Energy: 0.6234603748457866
Energy: 0.7055989703466035
Energy: 0.6794483245145642
Energy: 0.6409471482431087
Energy: 0.705424999719801
Energy: 0.6821997064795162
Energy: 0.6470428152366652
Energy: 0.683102366300518
Energy: 0.6671892153752594
Energy: 0.6571249168401594
Energy: 0.6766620543988568
Energy: 0.6861516442758337
Energy: 0.7264052503898362
Energy: 0.6007538691045341
Energy: 0.5815820403473033
Energy: 0.7360116313554487
Energy: 0.7205614152073394
Energy: 0.6920943235324133
Energy: 0.6883689447569739
Energy: 0.658084077253509
Energy: 0.6414062065965889
Energy: 0.7041243986188432
Energy: 0.6844511357311995
Energy: 0.6141905120797245
Energy: 0.641686925268451
Energy: 0.6627597716601322
Energy: 0.6470014665538701
Energy: 0.6484615268224778
Energy: 0.6785774014938877
Energy: 0.6622706719807867
Energy: 0.6610161718381468
Energy: 0.6081800733006445
Energy: 0.6652899757876511
Energy: 0.7236036502603662
Energy: 0.6904585614818352
Energy: 0.6863499997060479
Energy: 0.6812553984922111
Energy: 0.7242212347550385
Energy: 0.7254015043495251
Energy: 0.7019289334408125
Energy: 0.7178694508422354
Energy: 0.6747222485987747
Energy: 0.7410568621315261
Energy: 0.6622537522842425
Energy: 0.7114490795732588
Energy: 0.6881328425848241
Energy: 0.6786855231694024
Energy: 0.7180785070317552
Energy: 0.7065463529640411
Energy: 0.7316240996660306
Energy: 0.7139366608883876
Energy: 0.7097808933892894
Energy: 0.6955163032717255
Energy: 0.6695869209869931
Energy: 0.6876478215577502
Energy: 0.6866369800819954
Energy: 0.7501166310619005
Energy: 0.700873929149477
Energy: 0.7065984020646467
Energy: 0.6972866574033831
Energy: 0.6679276300582901
Energy: 0.6804762803831172
Energy: 0.6764023999155386
Energy: 0.7349098273900407
Energy: 0.7046165802766413
Energy: 0.6864505104815651
Energy: 0.6817771380581756
Energy: 0.6902871526043924
Energy: 0.7657079094807432
Energy: 0.7273422809559881
Energy: 0.7186809984380759
Energy: 0.7590477477096546
Energy: 0.7384572758304274
Energy: 0.746445065088423
Energy: 0.7481406520155475
Energy: 0.6786789346341564
Energy: 0.6670708645808304
Energy: 0.6993448501099524
Energy: 0.673611947531763
Energy: 0.6981641741070861
Energy: 0.6622383443959068
Energy: 0.6131566861735501
Energy: 0.6970543017186781
Energy: 0.6531298563685872
Energy: 0.7010406222322549
Energy: 0.6368150790662366
Energy: 0.6831842629708912
Energy: 0.6676287307019977
Energy: 0.6561120643630414
Energy: 0.6592857212881473
Energy: 0.6755211081521111
Energy: 0.639374513512637
Energy: 0.7019306742141236
Energy: 0.6672038571055375
Energy: 0.7081834967247717
Energy: 0.7422127272729362
Energy: 0.7009176220708235
Energy: 0.6179752694587276
Energy: 0.6806252780509175
Energy: 0.6791050836976334
Energy: 0.6509919922196779
Energy: 0.5926575367301279
Energy: 0.6711943502467036
Energy: 0.6938412695102554
Energy: 0.6650268819690361
Energy: 0.6358438317920551
Energy: 0.7052696956014282
Energy: 0.6784156720991487
Energy: 0.6614944163935488
Energy: 0.6721160170444372
Energy: 0.686800651452398
Energy: 0.63123744852307
Energy: 0.7207447125518885
Energy: 0.6648396413254133
Energy: 0.6965026606732092
Energy: 0.7063262883891356
Energy: 0.6229306438092101
Energy: 0.6277950701773568
Energy: 0.6681137577844096
Energy: 0.6888930328144361
Energy: 0.6668398354456306
Energy: 0.6996892080148147
Energy: 0.65882637238673
Energy: 0.6692195749428168
Energy: 0.7041288414787105
Energy: 0.6996797796760502
Energy: 0.6708031176818335
Energy: 0.6883755808230017
Energy: 0.6542400605398809
Energy: 0.7444013747337591
Energy: 0.7098386853607731
Energy: 0.6743547033532006
Energy: 0.6657406704654659
Energy: 0.6882491357681789
Energy: 0.7099914403481078
Energy: 0.6555428609212369
Energy: 0.6651134116003926
Energy: 0.6921637351262987
Energy: 0.7131349361453636
Energy: 0.6980721177669541
Energy: 0.7282394038509459
Energy: 0.6685751933532831
Energy: 0.6816040582001155
Energy: 0.632930147455008
Energy: 0.6435857460540184
Energy: 0.6874096675915979
Energy: 0.6587418965015261
Energy: 0.6577455731155654
Energy: 0.6646186124964768
Energy: 0.6392632056750458
Energy: 0.6651258433818715
Energy: 0.6875453459835638
Energy: 0.6354786358359925
Energy: 0.6621244113287664
Energy: 0.6231466893725125
Energy: 0.6768255350731043
Energy: 0.6845463953218136
Energy: 0.6797003276459047
Energy: 0.7059272091803444
Energy: 0.6417515037599847
Energy: 0.6470990428011563
Energy: 0.6838595235903036
Energy: 0.66716917119843
Energy: 0.6279331296510308
Energy: 0.681253773924274
Energy: 0.7058579801574093
Energy: 0.6662094206314604
Energy: 0.634956152485237
Energy: 0.5870706424294992
Energy: 0.731936151716504
Energy: 0.6192508928230956
Energy: 0.6916174200320693
Energy: 0.6990949700844827
Energy: 0.6625190713796025
Energy: 0.6411670725267437
Energy: 0.6273217325429639
Energy: 0.6822164866320019
Energy: 0.6771640082142646
Energy: 0.6598914290105491
Energy: 0.6363055161490903
Energy: 0.6342149601279887
Energy: 0.6413171366650503
Energy: 0.6787926820600949
Energy: 0.653070271411733
Energy: 0.6517156964807032
Energy: 0.7132526926172769
Energy: 0.6749330302012002
Energy: 0.7076566496946598
Energy: 0.6992957936023722
Energy: 0.6726682686812208
Energy: 0.7129924376881214
Energy: 0.717630704682641
Energy: 0.6884174194601494
Energy: 0.8016632422407693
Energy: 0.6899684587311874
Energy: 0.673867317687912
Energy: 0.7502980945316656
Energy: 0.6613666298953648
Energy: 0.702970869653005
Energy: 0.6879455322945046
Energy: 0.6678842388841915
Energy: 0.7802035932536449
Energy: 0.6714285818045592
Energy: 0.7160968486598177
Energy: 0.714462482389137
Energy: 0.682343096227263
Energy: 0.7192666969470028
Energy: 0.6612525311850087
Energy: 0.68171654263647
Energy: 0.68730580692904
Energy: 0.7502218740261206
Energy: 0.7005768061499652
Energy: 0.7379492255794065
Energy: 0.6954839310099205
Energy: 0.6490355930830195
Energy: 0.7369815294874916
Energy: 0.6698129698097899
Energy: 0.717616868079911
Energy: 0.7025100353347159
Energy: 0.6505121268064404
Energy: 0.6700015663559834
Energy: 0.6902245458327234
Energy: 0.7252228518820195

minimum gb energy = 0.574040526249144 eV
minimum distance =  2.57312704748776 Angstroms
sigma value = 365


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

Energy: 0.6303910673090902
Energy: 0.712497236554048
Energy: 0.633109623131716
Energy: 0.7092147222067727
Energy: 0.7085984880360513
Energy: 0.633811426535022
Energy: 0.7115595453663074
Energy: 0.5722410109224368
Energy: 0.7728524610785803
Energy: 0.5838697982316405
Energy: 0.44008387713623603
Energy: 0.5839000723123448
Energy: 0.5852431876308011
Energy: 0.7713180814741548
Energy: 0.581752958492549
Energy: 0.8352991550964184
Energy: 0.5841352604356518
Energy: 0.5815440471592244
Energy: 0.5903716406209868
Energy: 0.5852744627020581
Energy: 0.4402308411947946
Energy: 0.5819948884358234
Energy: 0.8345679256273324
Energy: 0.5844996867935747
Energy: 0.581525333966935
Energy: 0.5906347028948846
Energy: 0.585875332470375
Energy: 0.7110777899726485
Energy: 0.57181673708825
Energy: 0.771640337099538
Energy: 0.566880518109723
Energy: 0.7692984329077003
Energy: 0.43872802564774804
Energy: 0.567287910280228
Energy: 0.7708247399063443
Energy: 0.6308564890195661
Energy: 0.8372198256812609
Energy: 0.6380779092725941
Energy: 0.7186818184842297
Energy: 0.5827332477917507
Energy: 0.5858804702046659
Energy: 0.7115807792296391
Energy: 0.5818363194461375
Energy: 0.7742081249732031
Energy: 0.5841569494386573
Energy: 0.4409594132214582
Energy: 0.5834148321338812
Energy: 0.585224459932164
Energy: 0.77305800193648
Energy: 0.581872436610721
Energy: 0.7715980801216789
Energy: 0.5841484576432914
Energy: 0.582228113157925
Energy: 0.5830401165084419
Energy: 0.5850430299553465
Energy: 0.7736313354438442
Energy: 0.5825040073873928
Energy: 0.8359415320197526
Energy: 0.5847087199274688
Energy: 0.5822551010993174
Energy: 0.5821362244905518
Energy: 0.5861474917609276
Energy: 0.7112950058062014
Energy: 0.5713324204912812
Energy: 0.7773644822712554
Energy: 0.5662083594421563
Energy: 0.7705841787002604
Energy: 0.7722001141890328
Energy: 0.5665637180821268
Energy: 0.7758154414239579
Energy: 0.5822815256732295
Energy: 0.8352323696376934
Energy: 0.5845461195503214
Energy: 0.5817138536177574
Energy: 0.5819566011335677
Energy: 0.5861173404869069
Energy: 0.7115962696878478
Energy: 0.581619502930299
Energy: 0.7715752599344732
Energy: 0.5840827986334949
Energy: 0.582217267623257
Energy: 0.5827515694199655
Energy: 0.5850720151034428
Energy: 0.7710815979015455
Energy: 0.5820075699540699
Energy: 0.7736945033196174
Energy: 0.5839710040907284
Energy: 0.5835523690029596
Energy: 0.5835726703690703
Energy: 0.5850452849316264
Energy: 0.7725803620989328
Energy: 0.6303736290017918
Energy: 0.8355391207020232
Energy: 0.6339708992614228
Energy: 0.7096327569731344
Energy: 0.5834118388750612
Energy: 0.6316208277488466
Energy: 0.7115905111070215
Energy: 0.572222751582229
Energy: 0.7722121770905326
Energy: 0.5673019180078426
Energy: 0.43935407831360546
Energy: 0.5841778579415706
Energy: 0.5824965043918462
Energy: 0.7707442365809763
Energy: 0.5819667285833574
Energy: 0.8347683021223847
Energy: 0.584306382512331
Energy: 0.5811427639849217
Energy: 0.5813464429835375
Energy: 0.5857506785911539
Energy: 0.5586995813252669
Energy: 0.5818152298723879
Energy: 0.8340668568420277
Energy: 0.5842909074554743
Energy: 0.5813482311986488
Energy: 0.5902835896075042
Energy: 0.5855834882312154
Energy: 0.5823354655840959
Energy: 0.5724922034165816
Energy: 0.7722729314542427
Energy: 0.5841648764787811
Energy: 0.5843697588725959
Energy: 0.43974976852646885
Energy: 0.5823238488760508
Energy: 0.7709960103891688
Energy: 0.630453028858771
Energy: 0.7707067446385137
Energy: 0.6331644367582631
Energy: 0.7089320134835772
Energy: 0.7101054118356631
Energy: 0.6338916162205099
Energy: 0.7114965021580534
Energy: 0.582371021178143
Energy: 0.7732233069293398
Energy: 0.5839120682492489
Energy: 0.44044140552937844
Energy: 0.5836268648447054
Energy: 0.5852329280286365
Energy: 0.7719788841018995

minimum gb energy = 0.43872802564774804 eV
minimum distance =  2.54511499016598 Angstroms
sigma value = 23