Model name: model_name=EAM_Dynamo_SturgeonLaird_2000_Al__MO_120808805541_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050010219216347
cohesive_energy=3.3902685453001857
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[7.833842651943e-20, 1.99256299264044e-19, 2.8034406088741797e-19, 3.1647634833738597e-19, 3.5280890786660397e-19, 3.8190924206994597e-19, 4.064049206271719e-19, 4.2731813223077397e-19, 4.4528494100445e-19, 4.6077798905523e-19, 4.741561639491299e-19, 4.85738298836316e-19, 4.95928142228556e-19, 5.049564075611459e-19, 5.1292082760876e-19, 5.19875876376954e-19, 5.258551995750419e-19, 5.30876421145998e-19, 5.34961971562698e-19, 5.38140690004554e-19, 5.40460641770586e-19, 5.41997129162592e-19, 5.428591001916839e-19, 5.43137878926e-19, 5.4284147624871e-19, 5.41883374621578e-19, 5.4015783038676e-19, 5.37535067236902e-19, 5.33878900158114e-19, 5.29037122370166e-19, 5.22825483560148e-19, 5.15013270292764e-19, 5.05308886420626e-19, 4.93332616081476e-19, 4.78600601931846e-19, 4.604847907312079e-19, 4.38212933341974e-19, 4.10899026085542e-19, 3.7759618257121796e-19, 3.37208513981346e-19, 2.88300470051862e-19, 2.28752371095984e-19, 1.553415990320844e-19, 6.34388246938836e-20, -5.22529080882858e-20, -1.9821328227530997e-19, -3.8497580814742195e-19, -6.26181898219488e-19, -9.412355137058818e-19, -1.37359409362722e-18, -1.98716365738386e-18, -2.9097129850074e-18, -4.51456525398618e-18, -8.219166132419999e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.011785405027312455
Energy: 0.014582757397875633
Energy: 0.06808168251269033
Energy: 0.06772154036379312
Energy: 0.014077225469850328
Energy: 0.012708850960169476
Energy: 0.06658071343002125
Energy: 0.06846412362419399
Energy: 0.06738349565331564
Energy: 0.013638301937023657
Energy: 0.012248457657051742
Energy: 0.06983015886328545
Energy: 0.06686527582031178
Energy: 0.06794665461653357
Energy: 0.06803246888426341
Energy: 0.06656577912024303
Energy: 0.06964573133894177
Energy: 0.0665906589918521
Energy: 0.06777518269877822
Energy: 0.06752939158955618
Energy: 0.06804872088710388
Energy: 0.01443602006825421
Energy: 0.012083502414158842
Energy: 0.06687641546444394
Energy: 0.06721464046957501
Energy: 0.06765647927855928
Energy: 0.013747052912676867
Energy: 0.012093135540542381
Energy: 0.06662107136628381
Energy: 0.06796813642210292
Energy: 0.06720527753705383
Energy: 0.012981974734771454
Energy: 0.012698302324590295
Energy: 0.06888066922190274
Energy: 0.06671800174860944
Energy: 0.06796259998459506
Energy: 0.013218079131483184
Energy: 0.012244514135888533
Energy: 0.06673515206355822
Energy: 0.06655777556980601
Energy: 0.06717566064231215
Energy: 0.0672957354787157
Energy: 0.06825623129844781
Energy: 0.013157926700488336
Energy: 0.012966175074965778
Energy: 0.06685509422505789
Energy: 0.06773509247108772
Energy: 0.06808422776471902
Energy: 0.013532793172840113
Energy: 0.06748850463084068
Energy: 0.06817162934267784
Energy: 0.0665079093542318
Energy: 0.06752680769101782
Energy: 0.012527304163590472
Energy: 0.014634008327764337
Energy: 0.06878437011199438
Energy: 0.0661361548658097
Energy: 0.06739979748723103
Energy: 0.012925750571023234
Energy: 0.01216834203570429
Energy: 0.012199719734309446
Energy: 0.06838076553117939
Energy: 0.0673830071652371
Energy: 0.06740568820222236
Energy: 0.06899158904466303
Energy: 0.015630056174464158
Energy: 0.06878630550998557
Energy: 0.06713429978523883
Energy: 0.06785961143951158
Energy: 0.06859292732802168

minimum gb energy = 0.011785405027312455 eV
minimum distance =  2.82275489933973 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 0.5648244652570393
Energy: 0.5337378125764612
Energy: 0.5274985107465755
Energy: 0.5537316578609914
Energy: 0.6539064330926939
Energy: 0.5233163492904032
Energy: 0.534507963042014
Energy: 0.5343838630837762
Energy: 0.5662737939476208
Energy: 0.46813822391107895
Energy: 0.6200169081624387
Energy: 0.5364684880725809
Energy: 0.47677666093658727
Energy: 0.48856948896628
Energy: 0.452658972428406
Energy: 0.5578778928394944
Energy: 0.5340668223675353
Energy: 0.4768372058198669
Energy: 0.5193521938352291
Energy: 0.5339347493077752
Energy: 0.5982748369986626
Energy: 0.49498963693557924
Energy: 0.45069555213861423
Energy: 0.4798944707238199
Energy: 0.4529427655416186
Energy: 0.49878654762785607
Energy: 0.49544414120533214
Energy: 0.4961991020039519
Energy: 0.5399438300506096
Energy: 0.4998868285691671
Energy: 0.5209050615645817
Energy: 0.6086216034846454
Energy: 0.4508259363820866
Energy: 0.45195079540531213
Energy: 0.4512170014392865
Energy: 0.5308503469994734
Energy: 0.5990913115668844
Energy: 0.5151638890529975
Energy: 0.4524357396791085
Energy: 0.5743576848968316
Energy: 0.5708468926539071
Energy: 0.5862090725645657
Energy: 0.6433145236264102
Energy: 0.5165123001617432
Energy: 0.5952940670416331
Energy: 0.5675119960325138
Energy: 0.5571350179501493
Energy: 0.5485398404909048
Energy: 0.48617106099401886
Energy: 0.571297833227715
Energy: 0.5645590034038998
Energy: 0.6001632858704393
Energy: 0.5133375779816716
Energy: 0.5841153444331825
Energy: 0.5669863487861969
Energy: 0.5635505950699861
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Energy: 0.4848626211301212
Energy: 0.5850105205884304
Energy: 0.5456281365960282
Energy: 0.5646639648596096
Energy: 0.5706647778472707
Energy: 0.5208890672746097
Energy: 0.5490568159313638
Energy: 0.5495725560099587
Energy: 0.5738350353383164
Energy: 0.5252970926836839
Energy: 0.48119553394580594
Energy: 0.5427825089011815
Energy: 0.5469349013751839
Energy: 0.5405036316060758
Energy: 0.5626334634285409
Energy: 0.4731375685658155
Energy: 0.5398378684354074
Energy: 0.5467354623754904
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Energy: 0.5528418148045625
Energy: 0.6227503614785735
Energy: 0.5408143530650322
Energy: 0.5788515005571897
Energy: 0.49077243177995294
Energy: 0.4782071977880347
Energy: 0.5478559929477612
Energy: 0.5560060397029358
Energy: 0.5796554013435259
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Energy: 0.4224941829024891
Energy: 0.5506929355605888
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Energy: 0.48251337344016554
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Energy: 0.5642418229525364
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Energy: 0.5876585230668889
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Energy: 0.5669892981944998
Energy: 0.565589180002241
Energy: 0.45030558613357935
Energy: 0.49453544376989206
Energy: 0.5886557150062509
Energy: 0.5593510708642819
Energy: 0.5559891618027618
Energy: 0.4786422491817709
Energy: 0.4944091830352839
Energy: 0.5879348302674856
Energy: 0.5021704179275944
Energy: 0.630898576860939
Energy: 0.6559487766439103
Energy: 0.5548751165386165
Energy: 0.5547924617282814
Energy: 0.5550048198801392
Energy: 0.5529912311871179
Energy: 0.5510496253106113
Energy: 0.5549062117458156
Energy: 0.5554060063700308
Energy: 0.5552996908285946
Energy: 0.5513112957051247
Energy: 0.4183472490575207
Energy: 0.5548494861147968
Energy: 0.5572685487835269
Energy: 0.5905195395903488
Energy: 0.49571547005276373
Energy: 0.4185991637815974
Energy: 0.559253810379625
Energy: 0.5577072155507924
Energy: 0.4991823431658416
Energy: 0.49606151618921196
Energy: 0.4998871466232506
Energy: 0.4998909974441157
Energy: 0.4971131215669768
Energy: 0.5035395938300505
Energy: 0.4888668551679065
Energy: 0.4787796604286439
Energy: 0.49940213556816965
Energy: 0.5038711763526659
Energy: 0.4802356655798088
Energy: 0.48890894438270266
Energy: 0.4918645705195403
Energy: 0.5033339547931212
Energy: 0.6000092527680214
Energy: 0.47684435237470524
Energy: 0.4521065703408792
Energy: 0.48959974770916265
Energy: 0.5015292065289945
Energy: 0.4987277263848636
Energy: 0.5016299989907613
Energy: 0.45184527537681496
Energy: 0.5505725877576072
Energy: 0.5668725691549522
Energy: 0.5499221952054048
Energy: 0.5487120197212606
Energy: 0.4828550865382703
Energy: 0.6124860588061609
Energy: 0.5567219796263698
Energy: 0.5868810331102776
Energy: 0.48199893948300504
Energy: 0.4528829556656413
Energy: 0.5661723007485343
Energy: 0.5647215071729826
Energy: 0.5606855021165479
Energy: 0.4785980873042549
Energy: 0.5550015288221851
Energy: 0.5661293885777366
Energy: 0.5638381547870706
Energy: 0.5942257795299558
Energy: 0.5235068507378716
Energy: 0.5872141256892737
Energy: 0.5464569936368825
Energy: 0.5723030925710108
Energy: 0.5841227864072626
Energy: 0.47936682268054037
Energy: 0.5386723894067005
Energy: 0.5472023751198234
Energy: 0.5791517212198553
Energy: 0.5222361568875851
Energy: 0.5180860292917858
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Energy: 0.5939742241237141
Energy: 0.5426069130049
Energy: 0.4214523082657016
Energy: 0.4214757634016535
Energy: 0.5422204972885496
Energy: 0.5467381530871017
Energy: 0.5438607746427152
Energy: 0.47351719411405313
Energy: 0.47253085126277894
Energy: 0.5464888320509199
Energy: 0.5771056095720025
Energy: 0.48274298635868335
Energy: 0.42303260789348884
Energy: 0.5535937376515158
Energy: 0.5406391052225843
Energy: 0.5775865474309838
Energy: 0.48943992193131575
Energy: 0.44727964504970136
Energy: 0.4844351231565619
Energy: 0.5389531368593828
Energy: 0.48241657467119703
Energy: 0.48948415141507595
Energy: 0.47974306630455577
Energy: 0.5096893936446927
Energy: 0.5027787248324483
Energy: 0.5080080979104977
Energy: 0.48602836120065857
Energy: 0.47992314321215357
Energy: 0.5033195984376791
Energy: 0.5062773010164635
Energy: 0.48395309425232963
Energy: 0.488715896148221
Energy: 0.48147384469824
Energy: 0.48508213934506916
Energy: 0.5067743996084781
Energy: 0.5109609645054017
Energy: 0.5154509779097235
Energy: 0.515304232828943
Energy: 0.519068331782009
Energy: 0.5060368003935527
Energy: 0.5958874383061761
Energy: 0.48612624716902453
Energy: 0.4822216753370164
Energy: 0.5708826660382531
Energy: 0.5313893827207461
Energy: 0.4543783226433973
Energy: 0.452953714885455
Energy: 0.5186639773833102
Energy: 0.5860324322434315
Energy: 0.5349843999792196
Energy: 0.6366964505665247
Energy: 0.5220748848019255
Energy: 0.5252032754026061
Energy: 0.5641839980655233
Energy: 0.5659411125346369
Energy: 0.4539053505687046
Energy: 0.5398768759311322
Energy: 0.5253494066234577
Energy: 0.5650202763601949
Energy: 0.566294675330654
Energy: 0.5366303565983092
Energy: 0.5153601054308902
Energy: 0.5659685090704684
Energy: 0.5225128160555469
Energy: 0.5722064907242422
Energy: 0.45213459597277234
Energy: 0.45252373100530036
Energy: 0.5680889553173826
Energy: 0.5218428442687425
Energy: 0.5880913424030323
Energy: 0.698903935874922
Energy: 0.521550047182799
Energy: 0.5349185833502595
Energy: 0.5283632162526133
Energy: 0.5537431682395173
Energy: 0.5512312377099551
Energy: 0.5232787917291281
Energy: 0.5337999678820169
Energy: 0.5341347742218142
Energy: 0.5685819170121477

minimum gb energy = 0.4183472490575207 eV
minimum distance =  2.52262586014553 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.023273263094434
Energy: 0.4880273131626776
Energy: 0.49804437820167824
Energy: 0.5085209710701519
Energy: 0.496229887930021
Energy: 0.5050820107998659
Energy: 0.49712546925533235
Energy: 0.5099234389294237
Energy: 0.5076765436899181
Energy: 0.5787784676103319
Energy: 0.4986392450442741
Energy: 0.5307592673695735
Energy: 0.5091927853383929
Energy: 0.5064080244034623
Energy: 0.5047003708610895
Energy: 0.5359253101892733
Energy: 0.5065881327519983
Energy: 0.5102865550648497
Energy: 0.5257938846099027
Energy: 0.518905422039358
Energy: 0.5332323317036445
Energy: 0.5584208291885981
Energy: 0.5032003656451169
Energy: 0.5103084155438158
Energy: 0.5611916162545417
Energy: 0.5296852229233894
Energy: 0.49692869051563393
Energy: 0.4908803688038489
Energy: 0.5083101684918876
Energy: 0.5063042086875135
Energy: 0.5605852138007105
Energy: 0.5268450318465687
Energy: 0.5218944749168515
Energy: 0.5094900204134093
Energy: 0.5099951211037065
Energy: 0.5613739777885138
Energy: 0.5202403875290212
Energy: 0.5063518769425647
Energy: 0.509130532504755
Energy: 0.5298313176890257
Energy: 0.522769733694828
Energy: 0.517247458090338
Energy: 0.5966817772439011
Energy: 0.5287614100619545
Energy: 0.5039714882265841
Energy: 0.5070277800581189
Energy: 0.5106540742280024
Energy: 0.5969089042002681
Energy: 0.5908181794614187
Energy: 0.5108685375935033
Energy: 0.5090755663130884
Energy: 0.5189447853959617
Energy: 0.5103722080757117
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Energy: 0.5197215013730859
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Energy: 0.5036150538793669
Energy: 0.5218453613867582
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Energy: 0.5397023518889922
Energy: 0.531770748961018
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Energy: 0.5354528047715451
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Energy: 0.5704631062358181
Energy: 0.5591255333955617
Energy: 0.6379008913153585
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Energy: 0.5076039934086828
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Energy: 0.5232465259298529
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Energy: 0.5624427247668458
Energy: 0.5260902107855727
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Energy: 0.5193574336403161
Energy: 0.5126010908573609
Energy: 0.5635382455365578
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Energy: 0.5227885161201425
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Energy: 0.5792806070009003
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Energy: 0.5108523595371992
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Energy: 0.5021016720779373
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Energy: 0.5231344302713768
Energy: 0.5665930884276776
Energy: 0.5616434710301443
Energy: 0.5307786379233074
Energy: 0.5248415154939865
Energy: 0.5202128088157065
Energy: 0.5656927451777767
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Energy: 0.511453646864415
Energy: 0.526033599809251
Energy: 0.5280603510107026
Energy: 0.5146284016155177
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Energy: 0.529457508566447
Energy: 0.6045171452852539
Energy: 0.5178864928570645
Energy: 0.5152386875223807
Energy: 0.514271183563959
Energy: 0.5239721296857592
Energy: 0.6046625362527556
Energy: 0.5140143683834277
Energy: 0.5240897024909952
Energy: 0.5120520428284094
Energy: 0.5147893366111643
Energy: 0.5128135165995475
Energy: 0.6019379763991124
Energy: 0.5240683942297041
Energy: 0.5243727053735614
Energy: 0.5150515682685554
Energy: 0.5099044374018509
Energy: 0.5290471920901167
Energy: 0.5186002650752319
Energy: 0.5319628657909169
Energy: 0.5157071396059062
Energy: 0.4845326368789905
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Energy: 0.5732912972723577
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Energy: 0.5693919838833742
Energy: 0.4849040745184763
Energy: 0.589124930462411
Energy: 0.5590024491592208
Energy: 0.5503008401035886
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Energy: 0.5596486656603915
Energy: 0.56709850086581
Energy: 0.5062148037986085
Energy: 0.5263732058654533
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minimum gb energy = 0.48383474196536036 eV
minimum distance =  2.58359577357784 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.5345782401312987
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Energy: 0.6457034301055631
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Energy: 0.5471023671029588
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Energy: 0.569681560286436
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Energy: 0.5902099826650841
Energy: 0.537022325009732
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Energy: 0.5430677251835428
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Energy: 0.5674147673004494
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Energy: 0.5711458776976087
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Energy: 0.5391647767375567
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Energy: 0.5601039892681889
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Energy: 0.5266717775058111
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Energy: 0.6093945104362521
Energy: 0.5410292246267958
Energy: 0.536326417366701
Energy: 0.5683104507557389
Energy: 0.5786414096721553
Energy: 0.543100552524366
Energy: 0.5711518232847969
Energy: 0.5705370042165298
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Energy: 0.5431349787210059
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Energy: 0.5401302231984039
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Energy: 0.5519487964333374
Energy: 0.5720523543651254
Energy: 0.5790154329597086
Energy: 0.5734845248993938
Energy: 0.557646342271715
Energy: 0.5884148995690702
Energy: 0.572699870981367
Energy: 0.5739311981765746
Energy: 0.573286912485852
Energy: 0.5632610746805745
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Energy: 0.5678950507349438
Energy: 0.5710757547453666
Energy: 0.557483202233236
Energy: 0.5718620748095476
Energy: 0.5707709915743922
Energy: 0.5648963239668039
Energy: 0.5702169848285981
Energy: 0.5305665373655243
Energy: 0.5723564111243573
Energy: 0.5706335021755651
Energy: 0.5783272000834823
Energy: 0.5715350587130854
Energy: 0.5849971895669623
Energy: 0.579030054199789
Energy: 0.5688431086452931
Energy: 0.5594239864524354
Energy: 0.5671688069650918
Energy: 0.5727032669516776
Energy: 0.581967876860587
Energy: 0.5578835977382298
Energy: 0.5860967666140764
Energy: 0.5778948649654607
Energy: 0.5727139069465025
Energy: 0.57075966376813
Energy: 0.5343762834649602
Energy: 0.5742749443970039
Energy: 0.5162995170825023
Energy: 0.570177028579086
Energy: 0.568063994913028
Energy: 0.5708595382175498
Energy: 0.6088892407734686
Energy: 0.5538646385547585
Energy: 0.5587763387771929
Energy: 0.5647333919048989
Energy: 0.5352110953254733
Energy: 0.572764154317003
Energy: 0.5436812816673156
Energy: 0.5696133502946313
Energy: 0.5679180208880307
Energy: 0.5783048641918639
Energy: 0.588879477787288
Energy: 0.5722788208217663
Energy: 0.564654688769023
Energy: 0.5670592577361028
Energy: 0.582617500599328
Energy: 0.544953981489268
Energy: 0.5724080937904305
Energy: 0.5821090870334797
Energy: 0.5662255591273961
Energy: 0.5904888923039525
Energy: 0.5704881156027112
Energy: 0.5416180093831636
Energy: 0.5405037822811193
Energy: 0.5347948115477125
Energy: 0.5650859698851236
Energy: 0.5189074470427955
Energy: 0.5409874036911801
Energy: 0.5500681066574138
Energy: 0.5419304742262021
Energy: 0.5680581148332466
Energy: 0.5712417498894139
Energy: 0.5368090103480192
Energy: 0.5483493313115355
Energy: 0.5491762510812098
Energy: 0.5370012260768002
Energy: 0.5368573552310013
Energy: 0.5368627118628078
Energy: 0.5415990484389371
Energy: 0.5383394968001797
Energy: 0.579770601431667

minimum gb energy = 0.5162995170825023 eV
minimum distance =  2.56545192976667 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.6740496217159574
Energy: 0.5065308191833948
Energy: 0.50986215615891
Energy: 0.5333935913434606
Energy: 0.5081052492434132
Energy: 0.6739903355663407
Energy: 0.5102822627143032
Energy: 0.5098285091809085
Energy: 0.5337246921080632
Energy: 0.5046711119396899
Energy: 0.5047501318889128
Energy: 0.535253757372859
Energy: 0.5357035780237284
Energy: 0.5297200495551894
Energy: 0.5291334692254067
Energy: 0.5288493678675832
Energy: 0.5318686804202666
Energy: 0.5351893390622507
Energy: 0.5304321865588273
Energy: 0.552857114843669
Energy: 0.5328800923056055
Energy: 0.5538563748149216
Energy: 0.5093929882521134
Energy: 0.5345800644572347
Energy: 0.5459358064343239
Energy: 0.5329899384490207
Energy: 0.5096755067181641
Energy: 0.5333451980781558
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Energy: 0.5490008206130434
Energy: 0.5046791223422818
Energy: 0.5335477959754967
Energy: 0.5328335606107836
Energy: 0.5439522333040144
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Energy: 0.533841798973443
Energy: 0.5101203656054678
Energy: 0.5501227661358641
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Energy: 0.5294493315411687
Energy: 0.5273156895378184
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Energy: 0.5351326583063429
Energy: 0.5072930705146069
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Energy: 0.5278752950652658
Energy: 0.5290398363144128
Energy: 0.5653508268975423
Energy: 0.5312295947286414
Energy: 0.5109551050996135
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Energy: 0.5656976000261544
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Energy: 0.5106928686345766
Energy: 0.5059342707228837
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Energy: 0.5282179063008232
Energy: 0.5281133580046485
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Energy: 0.5280980617670724
Energy: 0.5054411450498864
Energy: 0.5086195475996891
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Energy: 0.5289246393661489
Energy: 0.5083754901997956
Energy: 0.5130882315415778
Energy: 0.5101879723354172
Energy: 0.5286670846857932
Energy: 0.5447334496051381
Energy: 0.5533829425614782
Energy: 0.5330468405744657
Energy: 0.5352809218591584
Energy: 0.5327489043731792
Energy: 0.5279385038474878
Energy: 0.5525511996237648
Energy: 0.5333778414997592
Energy: 0.5329872366114717
Energy: 0.534418253628079
Energy: 0.5284539951430605
Energy: 0.5458746205733351
Energy: 0.5325541279186325
Energy: 0.5337247536525089
Energy: 0.5353162839136193
Energy: 0.5489091984304432
Energy: 0.5344296411284215
Energy: 0.5326640448626356
Energy: 0.5334451959483203
Energy: 0.5346252504941383
Energy: 0.509594032855933
Energy: 0.5344651269906335
Energy: 0.5308536731338366
Energy: 0.5343644470244514
Energy: 0.5316984527412183
Energy: 0.5368966664745926
Energy: 0.5355567585832001
Energy: 0.5295309773237946
Energy: 0.5337157101703641
Energy: 0.5297002323833039
Energy: 0.5360255178908432
Energy: 0.5535538686164987
Energy: 0.5370889452613288
Energy: 0.5482528604911951
Energy: 0.5287316473647917
Energy: 0.5093917745822343
Energy: 0.5075367021257746
Energy: 0.5309758334697354
Energy: 0.5279798558254908
Energy: 0.5290409259437382
Energy: 0.5092154063690869
Energy: 0.5303701013322658
Energy: 0.5329380237185686
Energy: 0.52850231491406
Energy: 0.5060959935698276
Energy: 0.5279975846880227
Energy: 0.5540403796238668
Energy: 0.5321665062433995
Energy: 0.5128826127698318
Energy: 0.5046698749328212
Energy: 0.528345261646163
Energy: 0.5049660616980831
Energy: 0.5296490910733841
Energy: 0.5336216775322237
Energy: 0.5103150633696146
Energy: 0.534786804277442
Energy: 0.5303530236858393
Energy: 0.5305966731586457
Energy: 0.533614892403547
Energy: 0.5102283354767619
Energy: 0.535343381063596

minimum gb energy = 0.5046698749328212 eV
minimum distance =  2.58947063744611 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9300364442031288
Energy: 0.4567609102201598
Energy: 0.46364259810851977
Energy: 0.46338593321677274
Energy: 0.4570701651605492
Energy: 0.4765547975827516
Energy: 0.46725450077987923
Energy: 0.4643438338344219
Energy: 0.46372765989743964
Energy: 0.4602954192080541
Energy: 0.4946320209983207
Energy: 0.48280597287569355
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Energy: 0.46290006322063804
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Energy: 0.46337458367017315
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Energy: 0.47537301730303483
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Energy: 0.4749339634161875
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Energy: 0.46195862833703316
Energy: 0.478583621464645
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Energy: 0.47610190249984524
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Energy: 0.4759566129433228
Energy: 0.4709245988154698
Energy: 0.564067013786934
Energy: 0.4862974059380827
Energy: 0.47330440354627323
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Energy: 0.4800494946125266
Energy: 0.48933272107546
Energy: 0.4582048060787979
Energy: 0.47423186849896487
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Energy: 0.48691222175961335
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Energy: 0.4838760174165536
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Energy: 0.4694428783649901
Energy: 0.4728772838665054
Energy: 0.4609615258295198
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Energy: 0.47872481178591714
Energy: 0.46072775663453613
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Energy: 0.4891115719804904
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Energy: 0.4624459240940871
Energy: 0.4789063450878956
Energy: 0.4908508071274535
Energy: 0.4856030996778582
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Energy: 0.4813235367515394
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Energy: 0.47973424898327616
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Energy: 0.4832706300375842
Energy: 0.47754549675743585
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Energy: 0.45925996171683886
Energy: 0.45885792705452827
Energy: 0.47315672977324197
Energy: 0.4779217176638391
Energy: 0.459117482941418
Energy: 0.45868936566363294
Energy: 0.4681105680433129
Energy: 0.45844975086452916
Energy: 0.4860804083724037
Energy: 0.46096775797295353
Energy: 0.4635262213131304
Energy: 0.4668833944069134
Energy: 0.45850329037702503
Energy: 0.48581753425996366
Energy: 0.46090151247309785
Energy: 0.4634940789097716
Energy: 0.46817535585953635
Energy: 0.46350333060531573
Energy: 0.4944563837626468
Energy: 0.46351062778546454
Energy: 0.46078429279298727
Energy: 0.46245158441639317
Energy: 0.464101911499488
Energy: 0.48991023169571857
Energy: 0.4638050271867423
Energy: 0.461526791941529
Energy: 0.4591528050271505
Energy: 0.46244392239556337
Energy: 0.45812439230155194
Energy: 0.46098083493526176
Energy: 0.4582465250384202
Energy: 0.45935195019475017
Energy: 0.4632745091001855
Energy: 0.4578781669761599
Energy: 0.4599222937507989
Energy: 0.4580488574481942
Energy: 0.4800230926462295

minimum gb energy = 0.4567609102201598 eV
minimum distance =  2.64807892429772 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.4053280937018055
Energy: 0.29966338697270045
Energy: 0.2703802441092006
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Energy: 0.2956905828900262
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Energy: 0.28963062127000233
Energy: 0.258791650061786
Energy: 0.3121964286484508
Energy: 0.31155312675236085
Energy: 0.2853364375647781
Energy: 0.29094822458014313
Energy: 0.29368268531613845
Energy: 0.29841977835084177
Energy: 0.30751175506648226
Energy: 0.29478804803529746
Energy: 0.29412688216072364
Energy: 0.2580038644737413
Energy: 0.3199575844004069
Energy: 0.300064032807212
Energy: 0.3005528151896263
Energy: 0.2450900102789344
Energy: 0.24410469336328927
Energy: 0.270544214586363
Energy: 0.24555329884028032
Energy: 0.2434505952812178
Energy: 0.25381487758293075
Energy: 0.2715903318581575
Energy: 0.32222114162324145
Energy: 0.2906217328426085
Energy: 0.40788789950236143
Energy: 0.2527613566934451
Energy: 0.3322521960841496
Energy: 0.2602942363535283
Energy: 0.259508853902658
Energy: 0.2936830696506204
Energy: 0.2631860889106834
Energy: 0.26529964088298646
Energy: 0.26403495706910296
Energy: 0.40574893174459986

minimum gb energy = 0.2434505952812178 eV
minimum distance =  2.65765779143601 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.4488893349438824
Energy: 0.425308097141024
Energy: 0.4298972316604949
Energy: 0.43733620389211947
Energy: 0.4187593536290731
Energy: 0.4171854429519797
Energy: 0.42256957714875687
Energy: 0.4289023574853013
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Energy: 0.4296123275682712
Energy: 0.46844879945830453
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Energy: 0.42699862804883887
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Energy: 0.4330126452946054
Energy: 0.44458616767905307
Energy: 0.47214018914164385
Energy: 0.4402532227529162
Energy: 0.4219712489540122
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Energy: 0.4487780750336309
Energy: 0.4701624578051127
Energy: 0.42341495528526885
Energy: 0.4384596592376662
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Energy: 0.4312691552589234
Energy: 0.4238590177719869
Energy: 0.43415074502080836
Energy: 0.4356600245069503
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Energy: 0.4302410687943252
Energy: 0.4294764450606906
Energy: 0.427773030999628
Energy: 0.4488161994554854
Energy: 0.44074710853221005
Energy: 0.4236238227275314
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Energy: 0.4293262241910934
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Energy: 0.4232585577636258
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Energy: 0.4161679433162924
Energy: 0.4237774096493338
Energy: 0.4332795355681878
Energy: 0.4471324041106244
Energy: 0.4307093084630244

minimum gb energy = 0.4161679433162924 eV
minimum distance =  2.61775212674949 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.7830814139247536
Energy: 0.5444801230374736
Energy: 0.5497637819440556
Energy: 0.5504621668133977
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Energy: 0.5573125819473097
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Energy: 0.5450047510024975
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Energy: 0.5472007809263563
Energy: 0.5660679707531228
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Energy: 0.5485085742429594
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Energy: 0.5495358497552935
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Energy: 0.5511075052985213
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Energy: 0.5623692897248086
Energy: 0.5560624937728398
Energy: 0.5581609281039047
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Energy: 0.5485989138101973
Energy: 0.5480225878585943
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Energy: 0.5601518581416826
Energy: 0.5466826876063707
Energy: 0.5549073030808047
Energy: 0.5626939585735999
Energy: 0.5502569432745691
Energy: 0.5487299867972822
Energy: 0.5468673425707868
Energy: 0.5467049901367682
Energy: 0.5551784643387792
Energy: 0.5479593983960928
Energy: 0.5547533889688846
Energy: 0.5472674750887583
Energy: 0.546601534305082
Energy: 0.5539522433965769
Energy: 0.5489055540254182
Energy: 0.543811042061506
Energy: 0.5550745902169997
Energy: 0.5457586584748769
Energy: 0.5461337311597825
Energy: 0.5486488017209558
Energy: 0.5447385259945506
Energy: 0.5551580987238269
Energy: 0.5457046659311583
Energy: 0.5466008674666505
Energy: 0.5480765491703663

minimum gb energy = 0.5365052189977934 eV
minimum distance =  2.61612433328206 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 0.9100777237776715
Energy: 0.6184151819480707
Energy: 0.6305263444355973
Energy: 0.6225241560791026
Energy: 0.6573651885585968
Energy: 0.6165996667818525
Energy: 0.6251840284994205
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Energy: 0.6256971933694976
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Energy: 0.6215640461811999
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Energy: 0.6206867047223917
Energy: 0.633423963658623
Energy: 0.6404775745954279
Energy: 0.6468623203039071
Energy: 0.6237046841127358
Energy: 0.6258152841796356
Energy: 0.6247528256433323
Energy: 0.6378052791424289
Energy: 0.625260945882488
Energy: 0.6342257193134797
Energy: 0.6265212765902864
Energy: 0.6290356228085349
Energy: 0.6194686016489196
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minimum gb energy = 0.60491288345286 eV
minimum distance =  2.56256588013262 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.632948876793474
Energy: 0.6318549307407896
Energy: 0.6135234362797439
Energy: 0.6353025418814608
Energy: 0.6577532308443352
Energy: 0.614005834118788
Energy: 0.6202913857307979
Energy: 0.6139614130834551
Energy: 0.6359373950099685
Energy: 0.6579105046875502
Energy: 0.6137854557667533
Energy: 0.6202984095084056
Energy: 0.6367673663997496
Energy: 0.6345988633096198
Energy: 0.6193240588437845
Energy: 0.6155999044239863
Energy: 0.6319164193642509
Energy: 0.6370840784720153
Energy: 0.6354501661211103
Energy: 0.6181081629666797
Energy: 0.6166739111172186
Energy: 0.6316954036022436
Energy: 0.5970196122643455
Energy: 0.6200482761531437
Energy: 0.616073461458424
Energy: 0.6136652725414158
Energy: 0.6231990310570299
Energy: 0.597963918895326
Energy: 0.6208946150637592
Energy: 0.6164164120703856
Energy: 0.6141908445104259
Energy: 0.6212891718248728
Energy: 0.6231308262978271
Energy: 0.610885783101548
Energy: 0.6097927906146288
Energy: 0.6150791211886084
Energy: 0.6119248502356567
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Energy: 0.6156251542947644
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Energy: 0.6221480449255782
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Energy: 0.6127101096997439
Energy: 0.6442404177796649
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Energy: 0.6245906175441315
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Energy: 0.6167540421920495
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Energy: 0.648192329425731
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Energy: 0.645835162658134
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Energy: 0.6131346116222979
Energy: 0.6262379846872207
Energy: 0.6017899064793031
Energy: 0.6014123109790697
Energy: 0.615816306338824
Energy: 0.6143130591043748
Energy: 0.6113377760480357
Energy: 0.6182345441857876
Energy: 0.6196915957949501
Energy: 0.6132527451211304
Energy: 0.6158423727066724
Energy: 0.6118067142351205
Energy: 0.6168472837712763
Energy: 0.6192129531382735
Energy: 0.6119720320557628
Energy: 0.6109347349007391
Energy: 0.6104860282032006
Energy: 0.6102647504800686
Energy: 0.6248220351330995
Energy: 0.6107741657785177
Energy: 0.6285512934180293
Energy: 0.6147813576834422
Energy: 0.6097872725556192
Energy: 0.6259570336298421
Energy: 0.6102312722032419
Energy: 0.6293032822390868
Energy: 0.6393310388016828
Energy: 0.6350732584225501
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Energy: 0.6251330486999995
Energy: 0.6186495593151188
Energy: 0.6360557452381422
Energy: 0.633490679607913
Energy: 0.6318977260019539
Energy: 0.629854264812494
Energy: 0.6360613285006721
Energy: 0.636395670348137
Energy: 0.6321883722403074
Energy: 0.6321037487367627
Energy: 0.6362860066570041
Energy: 0.6144748037793473
Energy: 0.618931933964942
Energy: 0.6160230300420682
Energy: 0.6383442760606911
Energy: 0.6209375413842172
Energy: 0.6138755043120135
Energy: 0.6577499183169996
Energy: 0.6177571698664979
Energy: 0.6197803348151105
Energy: 0.6364524426195465
Energy: 0.61361036521131
Energy: 0.6159437134346795
Energy: 0.6205390367463993
Energy: 0.6054613942572192
Energy: 0.5949636123508993
Energy: 0.6147849774905321
Energy: 0.6180749896194674
Energy: 0.62119428630074
Energy: 0.6047713182018817
Energy: 0.5957491333406534
Energy: 0.6143232958237008
Energy: 0.6129555257283574
Energy: 0.6175495932102387
Energy: 0.6202704188085264
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Energy: 0.6128429466497748
Energy: 0.6121717454683798
Energy: 0.6361861596968076
Energy: 0.6107637805430357
Energy: 0.6169427864786013
Energy: 0.6260036736779495
Energy: 0.6174845938213314
Energy: 0.6384978181440956
Energy: 0.6108211566959811
Energy: 0.6181880325677394
Energy: 0.6253618246002072
Energy: 0.6146809662195778
Energy: 0.5999942732088407
Energy: 0.6280754458051068
Energy: 0.627837538488257
Energy: 0.6171711739857826
Energy: 0.5977534972629018
Energy: 0.6228715034528357
Energy: 0.6138359816184809
Energy: 0.6360643225376089
Energy: 0.6177101586885674
Energy: 0.6000642282901697
Energy: 0.6438296425340525
Energy: 0.6127416903605639
Energy: 0.6115618622938611
Energy: 0.6270963541373362
Energy: 0.6444165954113861
Energy: 0.6415981795041465
Energy: 0.6129880358227056
Energy: 0.6119776813506524
Energy: 0.6366458928703
Energy: 0.5976151243943121
Energy: 0.6179118988267055
Energy: 0.6120899363666515
Energy: 0.6121632421928216
Energy: 0.6318383199547115
Energy: 0.6129102345561418
Energy: 0.617600020886019
Energy: 0.6130096309726872
Energy: 0.6114467416450459
Energy: 0.6219313757485021
Energy: 0.6281834681055555
Energy: 0.6121562956779836
Energy: 0.6352103263221742
Energy: 0.6247843771003653
Energy: 0.6098687879123662
Energy: 0.6149598716309745
Energy: 0.6139339565622064
Energy: 0.6369524615695816
Energy: 0.6245228934358902
Energy: 0.6101074833872958
Energy: 0.6106213649651967
Energy: 0.6215211217757914
Energy: 0.6253613995207576
Energy: 0.6503399395881523
Energy: 0.6182188863965511
Energy: 0.6310115730258251
Energy: 0.6276733689867268
Energy: 0.6271501121589323
Energy: 0.6508526159655746
Energy: 0.6202393746773928
Energy: 0.6313173723722485
Energy: 0.6136505787794334
Energy: 0.6340278647541904
Energy: 0.6137688892537622
Energy: 0.6162188664532634
Energy: 0.6323819093316542
Energy: 0.6148845227605432
Energy: 0.6348759055593536
Energy: 0.6558571383209055
Energy: 0.6131378891476336
Energy: 0.619990687945766
Energy: 0.6406541150720579
Energy: 0.6227748131411305
Energy: 0.613956080870888
Energy: 0.6136798832319569
Energy: 0.6325995633160262
Energy: 0.6277541745449601
Energy: 0.6229376746809012
Energy: 0.6204328115091988
Energy: 0.6139667003677516
Energy: 0.6248412120412234

minimum gb energy = 0.5949636123508993 eV
minimum distance =  2.56873363636924 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.577714966707125
Energy: 0.584308072247949
Energy: 0.6355595200526307
Energy: 0.592665731505092
Energy: 0.583759303481831
Energy: 0.5782388206934165
Energy: 0.5939810409033576
Energy: 0.6350129313205517
Energy: 0.5933527004352251
Energy: 0.5831977980729833
Energy: 0.5811446593252932
Energy: 0.5902629212837656
Energy: 0.5893737634133972
Energy: 0.5888934081666718
Energy: 0.5904509839037608
Energy: 0.6258584946052174
Energy: 0.5903411298738008
Energy: 0.5831988700734385
Energy: 0.5889618286651819
Energy: 0.5914368901143732
Energy: 0.5898591227348557
Energy: 0.5895689299675585
Energy: 0.5900680427647161
Energy: 0.5932553048168251
Energy: 0.6259995710601003
Energy: 0.5891591393498216
Energy: 0.589468742990732
Energy: 0.5899256774552654
Energy: 0.636571168132051
Energy: 0.6263324581906686
Energy: 0.6366676188825611
Energy: 0.5802492960852357
Energy: 0.5826686695764326
Energy: 0.5896178743141497
Energy: 0.5920016161557008
Energy: 0.6363089909020837
Energy: 0.5796020267584279
Energy: 0.582931872748391
Energy: 0.5895214086152434
Energy: 0.5818505115637793
Energy: 0.5902455948282936
Energy: 0.5867673992159006
Energy: 0.5792991417909293
Energy: 0.5953172182951733
Energy: 0.5943947676604558
Energy: 0.5894792202209314
Energy: 0.5847795640409732
Energy: 0.5798348281825007
Energy: 0.5906167535407091
Energy: 0.5902377446867079
Energy: 0.5895718107370287
Energy: 0.636651596631951
Energy: 0.5948348819937584
Energy: 0.5896306273693609
Energy: 0.5913941242595002
Energy: 0.5897695254978329
Energy: 0.6354464152852155
Energy: 0.5934859065592617
Energy: 0.590106249576068
Energy: 0.5906531509156879
Energy: 0.5922966337744403
Energy: 0.5811734076231946
Energy: 0.5912316490916901
Energy: 0.5906554580536205
Energy: 0.5906124966497015
Energy: 0.5915268485976732
Energy: 0.5805532171600741
Energy: 0.5955294320296088
Energy: 0.590412445114567
Energy: 0.5900653821572783
Energy: 0.5954741249778545
Energy: 0.6235911378129434
Energy: 0.5934733578094682
Energy: 0.5788464481638458
Energy: 0.5825756646181375
Energy: 0.5946187438663337
Energy: 0.6239204285575725
Energy: 0.5920321181440598
Energy: 0.5786603888973264
Energy: 0.5829054508565189
Energy: 0.5901160577888003
Energy: 0.5827905273104466
Energy: 0.5887578607514794
Energy: 0.5819276140198024
Energy: 0.6276465227582443
Energy: 0.5900039367283237
Energy: 0.5888957465834735
Energy: 0.5888438130381541
Energy: 0.5810729891005957
Energy: 0.6300067125311097
Energy: 0.5902039645256653
Energy: 0.5902897603472758
Energy: 0.6245399489533875
Energy: 0.6369359466704115
Energy: 0.5936655426234556
Energy: 0.5912701067055554
Energy: 0.5912003805024074
Energy: 0.625280837535132
Energy: 0.5977321444466045
Energy: 0.589708575414108
Energy: 0.5807379241467088
Energy: 0.5951578561983295
Energy: 0.5883908718098201
Energy: 0.5907005069225774
Energy: 0.6276131268736049
Energy: 0.5815945485075817
Energy: 0.5954993076909041
Energy: 0.5801400833432998
Energy: 0.5950189119298649
Energy: 0.6272347592534798
Energy: 0.5778470391653777
Energy: 0.5928181559717551
Energy: 0.6351290347240653
Energy: 0.5941298132516408
Energy: 0.5838248678394347
Energy: 0.5785708744195194
Energy: 0.5938675764487709
Energy: 0.6362508683085591
Energy: 0.5933402497694318
Energy: 0.5833659273309032
Energy: 0.6273103584338636
Energy: 0.590124444286798
Energy: 0.5892714965061366
Energy: 0.5887653943208078
Energy: 0.5904057496889661
Energy: 0.626144904085257
Energy: 0.5900897660600178
Energy: 0.5829146887935904
Energy: 0.5890528203797463
Energy: 0.5972035182295893
Energy: 0.5898526147416749
Energy: 0.5896713640826691
Energy: 0.5904188195883509
Energy: 0.6366663162626953
Energy: 0.6257802105390485
Energy: 0.5891727700816698
Energy: 0.5895362840008523
Energy: 0.5901493789974438
Energy: 0.6356274556269035
Energy: 0.6271347354019721
Energy: 0.6367811251291822
Energy: 0.5803821555404158
Energy: 0.5825273468169574
Energy: 0.589783666326331
Energy: 0.6378984452678217
Energy: 0.6362379090750104
Energy: 0.579658993934144
Energy: 0.583406958847675
Energy: 0.5893576454449498
Energy: 0.6264025260070641
Energy: 0.5902811250532755
Energy: 0.5827623976217196
Energy: 0.5791489200138474
Energy: 0.5908391777828639
Energy: 0.5940958880639519
Energy: 0.5892036556631655
Energy: 0.585246327782246
Energy: 0.5797443420222672
Energy: 0.5903430775829531
Energy: 0.5900929749686556
Energy: 0.5898555369093101
Energy: 0.6366669029137236
Energy: 0.5949096370083174
Energy: 0.5895600180477626
Energy: 0.5844406950601644
Energy: 0.5898780916742955
Energy: 0.6357056438347578
Energy: 0.5936366273931628
Energy: 0.589921998211101
Energy: 0.5908187265932047
Energy: 0.5934649132398006
Energy: 0.5810122801274296
Energy: 0.592169548370874
Energy: 0.5905843555032546
Energy: 0.5913258508717688
Energy: 0.5916443852522895
Energy: 0.5805056327726035
Energy: 0.595492537588562
Energy: 0.5906191146600166
Energy: 0.5901887559019748
Energy: 0.5956517234373163
Energy: 0.6237000596635235
Energy: 0.5940512531974357
Energy: 0.5790882073062311
Energy: 0.5827114161006846
Energy: 0.6139850158846758
Energy: 0.6238472486140374
Energy: 0.5923452216030903
Energy: 0.5786563932644057
Energy: 0.5830241709899298
Energy: 0.5900183298678515
Energy: 0.5828168862807234
Energy: 0.5887835711847842
Energy: 0.5819660526333154
Energy: 0.628398662082474
Energy: 0.59005672528272
Energy: 0.5887930236651455
Energy: 0.5889563976839982
Energy: 0.5811756396803361
Energy: 0.5911012033882067
Energy: 0.5902434265282773
Energy: 0.5903337044621619
Energy: 0.62411907295978
Energy: 0.6374666520752319
Energy: 0.5928209612388868
Energy: 0.5909408779749814
Energy: 0.5910876796538939
Energy: 0.62473271509015
Energy: 0.5925209289147323
Energy: 0.5901359168047017
Energy: 0.5806933484617588
Energy: 0.595083135965036
Energy: 0.5883389604679198
Energy: 0.5907197757760488
Energy: 0.6278866287175622
Energy: 0.5812942734593994
Energy: 0.595384486515954
Energy: 0.5800863393391328
Energy: 0.5910847320659335
Energy: 0.6274493840822312

minimum gb energy = 0.577714966707125 eV
minimum distance =  2.59292638541224 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 0.9763274927314702
Energy: 0.6094137153290716
Energy: 0.6585701065629302
Energy: 0.6098419768044406
Energy: 0.6607538392462369
Energy: 0.5888615849001222
Energy: 0.6696360315454748
Energy: 0.6535450049647475
Energy: 0.6058509694751452
Energy: 0.661230131216414
Energy: 0.575626274702335
Energy: 0.6335764962386021
Energy: 0.6006259026290552
Energy: 0.6020313939322515
Energy: 0.6466945465941201
Energy: 0.5817365432062698
Energy: 0.644530979111398
Energy: 0.5993429542517199
Energy: 0.6455260301809754
Energy: 0.6216419581151774
Energy: 0.6669189733774363
Energy: 0.6003201137810051
Energy: 0.6042900097209771
Energy: 0.6208633095384858
Energy: 0.6700641781143014
Energy: 0.6537572959946368
Energy: 0.6062234183078504
Energy: 0.5853161999539779
Energy: 0.6169510596049931
Energy: 0.6635541010308206
Energy: 0.6234834741161853
Energy: 0.5896569744323812
Energy: 0.6253543382902068
Energy: 0.674690094926581
Energy: 0.6675413940955313
Energy: 0.6251906453506297
Energy: 0.6183449073475477
Energy: 0.6252529408749056
Energy: 0.6694303433812406
Energy: 0.6640454315021153
Energy: 0.66857894584302
Energy: 0.6382147765612867
Energy: 0.6405208629984165
Energy: 0.5864142248831192
Energy: 0.6079430353329033
Energy: 0.6639360241887265
Energy: 0.6384785598005089
Energy: 0.5816751478023231
Energy: 0.5867067024859511
Energy: 0.5755904786582782
Energy: 0.634138832640342
Energy: 0.5853149226049235
Energy: 0.5856625678360399
Energy: 0.6640464350491563
Energy: 0.7224196463976006
Energy: 0.633335715563036
Energy: 0.5855346070393547
Energy: 0.5856424119817164
Energy: 0.6701027500740113
Energy: 0.7467510134980196
Energy: 0.5889363254924407
Energy: 0.585734818890269
Energy: 0.5996161863629947
Energy: 0.5910351990492574
Energy: 0.6313615446231575
Energy: 0.5879214470689317
Energy: 0.5858258564750616
Energy: 0.5865874373036521
Energy: 0.5905812983866742
Energy: 0.6599180937902648
Energy: 0.5889307842961756
Energy: 0.5862721887801807
Energy: 0.5909589138915362
Energy: 0.6431703683533729
Energy: 0.6462803928714297
Energy: 0.5878975214860368
Energy: 0.5854688136396672
Energy: 0.5859237564754205
Energy: 0.643315326714997
Energy: 0.6237065453279266
Energy: 0.5910449181903958
Energy: 0.7234073891975348
Energy: 0.6292432851688989
Energy: 0.6411615571570686
Energy: 0.5931844598566319
Energy: 0.5902084954683604
Energy: 0.7204053181298381
Energy: 0.6298286445018381
Energy: 0.6757614280598405
Energy: 0.5923453735116362
Energy: 0.6390826578714746
Energy: 0.5879008382848012
Energy: 0.5938253545203458
Energy: 0.5914467798662493
Energy: 0.592888654357934
Energy: 0.604752015766139
Energy: 0.5880289717027659
Energy: 0.5934764672775842
Energy: 0.5917375554502478
Energy: 0.5935449860182112
Energy: 0.6459276716871595
Energy: 0.5977725904000565
Energy: 0.5904903423741971
Energy: 0.5912088209715707
Energy: 0.5922298064920176
Energy: 0.6242807193038639
Energy: 0.6225494322352755
Energy: 0.5914739555036652
Energy: 0.5909945593566673
Energy: 0.5925044398784304
Energy: 0.6680975808881426
Energy: 0.6502020320596081
Energy: 0.591357871570622
Energy: 0.5813176299370773
Energy: 0.6407111132982458
Energy: 0.6677887116828204
Energy: 0.6511564059490483
Energy: 0.5815423283773338
Energy: 0.5816773724968582
Energy: 0.640200785187561
Energy: 0.6451686027029397
Energy: 0.63416140663342
Energy: 0.5909362277707307
Energy: 0.592224413721178
Energy: 0.6370345803062806
Energy: 0.6457268813301863
Energy: 0.6338282877242088
Energy: 0.5902785548124195
Energy: 0.5954940805081433
Energy: 0.6594621351536571
Energy: 0.5984060938588027
Energy: 0.6500758138665846
Energy: 0.6611764036742932
Energy: 0.6476809313307406
Energy: 0.6412643860877855
Energy: 0.5988373820837428
Energy: 0.6521359907422541
Energy: 0.5738801975474989
Energy: 0.6442290241157699
Energy: 0.6364024757464863
Energy: 0.5861784670828415
Energy: 0.6244488123052162
Energy: 0.6674830473252373
Energy: 0.6011719051150973
Energy: 0.6356181962743672
Energy: 0.6075996896956696
Energy: 0.6302880490001652
Energy: 0.6679002013129542
Energy: 0.6003349542092556
Energy: 0.6338249994197742
Energy: 0.6080832107442832
Energy: 0.669134973966208
Energy: 0.5921892868592904
Energy: 0.6225146917188448
Energy: 0.6210923879947121
Energy: 0.6779158160420393
Energy: 0.6691378660424561
Energy: 0.5925846214531433
Energy: 0.6273079297159181
Energy: 0.6294611944112696
Energy: 0.581567108269862
Energy: 0.6251969200607127
Energy: 0.7123214549562507
Energy: 0.6812400295942203
Energy: 0.6521196617982223
Energy: 0.5823428144282731
Energy: 0.6472755981436574
Energy: 0.6869828356745623
Energy: 0.683133223981641
Energy: 0.6533579436681065
Energy: 0.6898426619396664
Energy: 0.7194597166665634
Energy: 0.711303434285861
Energy: 0.6229927332760256
Energy: 0.5884592243798216
Energy: 0.7047367420558273
Energy: 0.7198769600267225
Energy: 0.7107973669943819
Energy: 0.6241311934339661
Energy: 0.5871588926876602
Energy: 0.5864581439067369
Energy: 0.6207870767805175
Energy: 0.598778151425292
Energy: 0.5863193579144186
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Energy: 0.5868816055790266
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Energy: 0.5899475375776211
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Energy: 0.6522255778417949
Energy: 0.6043893867785078
Energy: 0.5855035813485306
Energy: 0.5873845950198371
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Energy: 0.5929681764846906
Energy: 0.5926006595937493
Energy: 0.6322922389205416
Energy: 0.6460993552893498
Energy: 0.5850998556510966
Energy: 0.5899472896000189
Energy: 0.5909698665214175
Energy: 0.6260386095845518
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Energy: 0.5862961104341523
Energy: 0.6183924841173152
Energy: 0.7193296865429292
Energy: 0.5907098095514036
Energy: 0.5818283380683895
Energy: 0.5810776071609117
Energy: 0.6192515738697774
Energy: 0.721170863560263
Energy: 0.5909751217657401
Energy: 0.590272883789332
Energy: 0.5912751330668
Energy: 0.5897133454116038
Energy: 0.5863383181256325
Energy: 0.5906805911953975
Energy: 0.5948224899956649
Energy: 0.5903786356337952
Energy: 0.5941657395879585
Energy: 0.613231840030338
Energy: 0.5888508133385738
Energy: 0.589310083290604
Energy: 0.5837729841892415
Energy: 0.6697588774987392
Energy: 0.6675313947927017
Energy: 0.6808468640212268
Energy: 0.58740826772262
Energy: 0.6161460437099092
Energy: 0.6689196398025763
Energy: 0.6458608194827115
Energy: 0.597362341378036
Energy: 0.5925179622011091
Energy: 0.647071155352337
Energy: 0.6443861360720926
Energy: 0.6212801460437013
Energy: 0.5747518480961334
Energy: 0.5883904674715343
Energy: 0.6408694559727204
Energy: 0.6236058994425633
Energy: 0.6081177357543
Energy: 0.576352504789799

minimum gb energy = 0.5738801975474989 eV
minimum distance =  2.56841210718289 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 0.7896556064396967
Energy: 0.5595781718404702
Energy: 0.6339289645780474
Energy: 0.5606163218248941
Energy: 0.5583138938828043
Energy: 0.7885800215164376
Energy: 0.5829473730103555
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Energy: 0.5444081379436183
Energy: 0.6241003303168522
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Energy: 0.5668803855274062
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Energy: 0.600939638742953
Energy: 0.6010013409427775
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Energy: 0.5690434259770318
Energy: 0.60970783161789
Energy: 0.6013322775854829
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Energy: 0.5705810135905649
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Energy: 0.6012276789286295
Energy: 0.5663314263554847
Energy: 0.566653890090388
Energy: 0.6233513580352543
Energy: 0.5651815730085303
Energy: 0.6213955923650119
Energy: 0.5805279447362084
Energy: 0.5710481357388236
Energy: 0.5665822302985212
Energy: 0.564587987339326
Energy: 0.6202631304772452
Energy: 0.5813770445042565
Energy: 0.5720895991742131
Energy: 0.5668442366342719
Energy: 0.5476446060472377
Energy: 0.5653814051372217
Energy: 0.5497777905228287
Energy: 0.5488139960643028
Energy: 0.5872609922046176
Energy: 0.561902620602045
Energy: 0.5682616060055526
Energy: 0.5503559174148287
Energy: 0.5493313178231511
Energy: 0.5861669856938223
Energy: 0.5479875782967041
Energy: 0.5467703380060479
Energy: 0.5511412932919565
Energy: 0.5897292575676079
Energy: 0.546948970324317
Energy: 0.5469875300469563
Energy: 0.5466301469667173
Energy: 0.5821999005588429
Energy: 0.5898162106484587
Energy: 0.5684646540245135
Energy: 0.5484508632669467
Energy: 0.5493398316495935
Energy: 0.5496770203612951
Energy: 0.6097840884332334
Energy: 0.5479778172739304
Energy: 0.5479615247235895
Energy: 0.5504955627934487
Energy: 0.5503946541121735
Energy: 0.6287648724863413
Energy: 0.5473056193384517
Energy: 0.5468595228970868
Energy: 0.5489784173265618
Energy: 0.6205103620233468
Energy: 0.6217045050417337
Energy: 0.548631172948577
Energy: 0.5475491884977811
Energy: 0.5505256303425442
Energy: 0.6209075773095272
Energy: 0.6211690773653883
Energy: 0.5468674772851874
Energy: 0.6025327097114733
Energy: 0.5509770020182501
Energy: 0.6562013260474157
Energy: 0.5528556255135249
Energy: 0.5509751822059062
Energy: 0.657538309985517
Energy: 0.5493135315602391
Energy: 0.6864642027953969
Energy: 0.5526638227050916
Energy: 0.5788247590802451

minimum gb energy = 0.5444081379436183 eV
minimum distance =  2.63038408223428 Angstroms
sigma value = 33