Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Al__MO_519613893196_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=4.031999975442886
cohesive_energy=3.360958551709536
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01278936995911121
Energy: 0.24934330785363001
Energy: 0.23547815167265623
Energy: 0.24927511249834605
Energy: 0.012789369957716111
Energy: 0.24934330785584846
Energy: 0.13487090578115385
Energy: 0.23502721689773848
Energy: 0.013126633491053915
Energy: 0.1455333832741728
Energy: 0.012995253639697758
Energy: 0.23502721689812728
Energy: 0.013126633492449013
Energy: 0.14553338327257187
Energy: 0.01278936995911121
Energy: 0.24934330785363001
Energy: 0.23547815167286207
Energy: 0.24927511249834605
Energy: 0.012789369957716111
Energy: 0.24934330785564263
Energy: 0.134870905780948
Energy: 0.23502721689753264
Energy: 0.013126633491053915
Energy: 0.14553338327398985
Energy: 0.012995253639697758
Energy: 0.23502721689812728
Energy: 0.013126633492449013
Energy: 0.14553338327257187
Energy: 0.012789369958928248
Energy: 0.24934330785363001
Energy: 0.23547815167286207
Energy: 0.24927511249834605
Energy: 0.012789369957716111
Energy: 0.24934330785603145
Energy: 0.13487090578115385
Energy: 0.23502721689753264
Energy: 0.013126633491053915
Energy: 0.14553338327398985
Energy: 0.012995253639697758
Energy: 0.23502721689812728
Energy: 0.013126633492449013
Energy: 0.14553338327257187

minimum gb energy = 0.012789369957716111 eV
minimum distance =  2.82610827797625 Angstroms
sigma value = 5


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

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Energy: 0.6003461431436499
Energy: 0.6153366862043047
Energy: 0.6002336565039782
Energy: 0.6110332879941494
Energy: 0.6003461431534851
Energy: 0.6099461203638482
Energy: 0.5654076216547348
Energy: 0.5714828775137534
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Energy: 0.5889808912649683
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Energy: 0.5616541554654015
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Energy: 0.5549319920293738
Energy: 0.6140867315800098
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Energy: 0.5827439316909636
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Energy: 0.570033706637803
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Energy: 0.6101296372119056
Energy: 0.6080519328480208
Energy: 0.5786889796559446
Energy: 0.625810508955711
Energy: 0.5965400267116295
Energy: 0.6080519328431034
Energy: 0.5786889796559446
Energy: 0.6258105089655461
Energy: 0.5863489655637742
Energy: 0.5857371032683986
Energy: 0.6067716977495494
Energy: 0.5702608779643408
Energy: 0.5863489655441487
Energy: 0.5857371032733162
Energy: 0.6067716977544668
Energy: 0.5521530144671114
Energy: 0.570402763331227
Energy: 0.6321270064849598
Energy: 0.5706088971007599
Energy: 0.5521530144621939
Energy: 0.5704027633164742
Energy: 0.6321270064923361
Energy: 0.5645592367234449
Energy: 0.5922811867340478
Energy: 0.6146043933861668
Energy: 0.587570833887745
Energy: 0.5645592367111509
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Energy: 0.6146043933763317
Energy: 0.5521502402429691
Energy: 0.5879426451108217
Energy: 0.5945663335537876
Energy: 0.5638891167415635
Energy: 0.5521502402478866
Energy: 0.5879426450837751
Energy: 0.5945663335439526

minimum gb energy = 0.5518192571280149 eV
minimum distance =  2.53377387616016 Angstroms
sigma value = 401


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

Energy: 0.6238165457829213
Energy: 0.5836396628186593
Energy: 0.6142059002439703
Energy: 0.5829035447044401
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Energy: 0.586749066125016
Energy: 0.5626919332682984
Energy: 0.5827155948550834
Energy: 0.5794732889071864
Energy: 0.5867490661205504
Energy: 0.5626919332677403
Energy: 0.5827155948609698
Energy: 0.5624196459234565
Energy: 0.564538954913289
Energy: 0.5901624073997424
Energy: 0.5705036618893088
Energy: 0.5624196459195492
Energy: 0.5645389549085698
Energy: 0.5901624073997424
Energy: 0.573139570134399
Energy: 0.6095869874080939
Energy: 0.5865395743153805
Energy: 0.5707673804555271
Energy: 0.573139570134399
Energy: 0.609586987399721
Energy: 0.586539574318476
Energy: 0.5726646344493542
Energy: 0.5940619110796401
Energy: 0.6001470800130843
Energy: 0.5713648839317126
Energy: 0.5726646344482379
Energy: 0.5940619110774075
Energy: 0.6001470800066904
Energy: 0.562048920542127
Energy: 0.5720627249126538
Energy: 0.6003638360135068
Energy: 0.5785456013814166
Energy: 0.562048920540706
Energy: 0.5720627249095583
Energy: 0.6003638360098532
Energy: 0.562725089621219
Energy: 0.5703102441842359
Energy: 0.6295237227034148
Energy: 0.5776004183341312
Energy: 0.5627250896164997
Energy: 0.5703102441795166
Energy: 0.6295237227078804
Energy: 0.6036730342545585
Energy: 0.5836396628192175
Energy: 0.6142059002456448
Energy: 0.5829035447049983
Energy: 0.6036730342500928
Energy: 0.5836396628195221
Energy: 0.614205900244224
Energy: 0.5593050992227466
Energy: 0.5698193911509155
Energy: 0.6336571659667866
Energy: 0.5791220951085086
Energy: 0.5593050992171648
Energy: 0.5698193911501036
Energy: 0.6336571659603419

minimum gb energy = 0.5550517223439322 eV
minimum distance =  2.56414656828535 Angstroms
sigma value = 311


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

Energy: 0.5937356222644231
Energy: 0.570852467002857
Energy: 0.6140216996490203
Energy: 0.5708611103799343
Energy: 0.5937356222608782
Energy: 0.570852467004146
Energy: 0.6178074193805083
Energy: 0.6157755788743909
Energy: 0.5839972095568897
Energy: 0.5870809339926585
Energy: 0.5757148772159097
Energy: 0.6157755788756801
Energy: 0.5839972095581788
Energy: 0.5870809339920139
Energy: 0.5799586614918139
Energy: 0.586098829507296
Energy: 0.6325263670214356
Energy: 0.5786185624912563
Energy: 0.5799586614924584
Energy: 0.5860988295050402
Energy: 0.6120157052024716
Energy: 0.5685319728940201
Energy: 0.5670390074086163
Energy: 0.6339283417810998
Energy: 0.5773400174831756
Energy: 0.5685319728946646
Energy: 0.567039007405716
Energy: 0.6339283417823889
Energy: 0.5875033039548335
Energy: 0.5751283560169292
Energy: 0.619150201619773
Energy: 0.5792347068122778
Energy: 0.5875033039551557
Energy: 0.575128356017574
Energy: 0.6191502016194508
Energy: 0.5689357171293179
Energy: 0.5731890085596254
Energy: 0.6032956314696827
Energy: 0.5762527343834044
Energy: 0.5689357171306069
Energy: 0.5731890085596254
Energy: 0.6032956314680713
Energy: 0.5683670698770289
Energy: 0.5727933583611152
Energy: 0.6021263442281789
Energy: 0.5785186251499834
Energy: 0.5683670698799002
Energy: 0.5727933583611152
Energy: 0.5912856385556116
Energy: 0.5738168056355861
Energy: 0.5707179649645374
Energy: 0.6473137926821106
Energy: 0.5677671561891678
Energy: 0.5738168056375198
Energy: 0.5707179649655042
Energy: 0.6473137926830629
Energy: 0.5683550065673175
Energy: 0.5683820462878973
Energy: 0.6094192926674796
Energy: 0.5705101972098763
Energy: 0.5683550065647685
Energy: 0.5683820462888642
Energy: 0.6094192926684465
Energy: 0.5714749722181643
Energy: 0.5805119021454745
Energy: 0.6045563486667552
Energy: 0.5752026895217246
Energy: 0.5714749722217093
Energy: 0.5805119021432187
Energy: 0.6045563486683667
Energy: 0.6075893841606893
Energy: 0.5681251846601716
Energy: 0.6083413958626723
Energy: 0.5618315799151659
Energy: 0.6075893841606893
Energy: 0.5681251846614607
Energy: 0.6083413958617055
Energy: 0.5871645701415122
Energy: 0.5831643971015262
Energy: 0.6077712217842061
Energy: 0.5833681182743575
Energy: 0.5871645701460241
Energy: 0.5831643971063604
Energy: 0.6077712217825947
Energy: 0.5931546557417015
Energy: 0.5783554481380927
Energy: 0.6280650404691523
Energy: 0.5663696443075479
Energy: 0.5931546557423459
Energy: 0.57835544813487
Energy: 0.6280650404743087
Energy: 0.571239706702374
Energy: 0.5830775148766519
Energy: 0.6390285213070873
Energy: 0.5792043732558942
Energy: 0.5712397066991513
Energy: 0.5830775148740738
Energy: 0.6390285213057982
Energy: 0.5859400898830157
Energy: 0.5668472543757881
Energy: 0.6279287486553354
Energy: 0.5783489445236759
Energy: 0.5859400898788262
Energy: 0.5668472543761104
Energy: 0.62792874865598
Energy: 0.5871228356602377
Energy: 0.5832120350770862
Energy: 0.6078582959104276
Energy: 0.5830805291982548
Energy: 0.5871228356579818
Energy: 0.5832120350774085
Energy: 0.6078582959104276
Energy: 0.6076398253490068
Energy: 0.5725795762581195
Energy: 0.5916033499856171
Energy: 0.5679998132547254
Energy: 0.607639825345784
Energy: 0.5725795762584418
Energy: 0.5916033499836835
Energy: 0.574704278092395
Energy: 0.5751718967935222
Energy: 0.6218258312746515
Energy: 0.5805131478780453
Energy: 0.5747042780930397
Energy: 0.5751718967912662
Energy: 0.6218258312746515
Energy: 0.5683669140842068
Energy: 0.5705220651391321
Energy: 0.6064675263298426
Energy: 0.5682974297048035
Energy: 0.5683669140806912
Energy: 0.5705220651407436
Energy: 0.606467526329198
Energy: 0.5739779703925038
Energy: 0.5677305369076662
Energy: 0.6473201402576054
Energy: 0.5707590861047578
Energy: 0.5739779703908923
Energy: 0.5677305369076662
Energy: 0.6473201402572831
Energy: 0.5683163587391914
Energy: 0.5784321389873394
Energy: 0.6126963329902255
Energy: 0.5726570884673468
Energy: 0.5683163587391914
Energy: 0.5784321389860501
Energy: 0.6126963329928038
Energy: 0.5689561608036211
Energy: 0.5774605189612085
Energy: 0.6033720861431036
Energy: 0.5620733645485078
Energy: 0.5689561608052325
Energy: 0.5774605189612085
Energy: 0.6033720861427811
Energy: 0.5873917320971002
Energy: 0.5792516024122588
Energy: 0.5900885092609524
Energy: 0.5752258455798139
Energy: 0.5873917320977448
Energy: 0.5792516024135481
Energy: 0.5557633464357985
Energy: 0.5829033177595679
Energy: 0.5772020584456201
Energy: 0.633987794563318
Energy: 0.5671407508683964
Energy: 0.5829033177595679
Energy: 0.5772020584459423
Energy: 0.6339877945658963
Energy: 0.5804123111992116
Energy: 0.5781545566095806
Energy: 0.6128409490165005
Energy: 0.5859552711803959
Energy: 0.5804123112001784
Energy: 0.5781545566102251
Energy: 0.6068485877140759
Energy: 0.6061784483742798
Energy: 0.5755426682138395
Energy: 0.5870406242488507
Energy: 0.5840325663247526
Energy: 0.6061784483781472
Energy: 0.5755426682157732
Energy: 0.5870406242504621
Energy: 0.5937356222647455
Energy: 0.5708524670047905
Energy: 0.6057462318121482
Energy: 0.5708611103789676
Energy: 0.5937356222647455
Energy: 0.5708524670031793
Energy: 0.6057462318134371
Energy: 0.6061732640477999
Energy: 0.5918034513451104
Energy: 0.5870809339916916
Energy: 0.5757148772152653
Energy: 0.6061732640455441
Energy: 0.5918034513425322
Energy: 0.5870809339942696
Energy: 0.5810034256659025
Energy: 0.5860988295050402
Energy: 0.612015705202794
Energy: 0.5780834443821623
Energy: 0.5810034256662246
Energy: 0.5860988295050402
Energy: 0.6120157052089171
Energy: 0.5685319728953092
Energy: 0.5670390074060382
Energy: 0.6339283417817444
Energy: 0.5773400174828534
Energy: 0.568531972892731
Energy: 0.5670390074076497
Energy: 0.6339283417807775
Energy: 0.5875033039548335
Energy: 0.5751283560172515
Energy: 0.6191502016194508
Energy: 0.5792347068135668
Energy: 0.5875033039532221
Energy: 0.5751283560172515
Energy: 0.6191502016194508
Energy: 0.5689357171299624
Energy: 0.5620061790560792
Energy: 0.6032956314700049
Energy: 0.5843504737239792
Energy: 0.5689357171296402
Energy: 0.5620061790560792
Energy: 0.6032956314687159
Energy: 0.5683670698824783
Energy: 0.5733287888015074
Energy: 0.5912856385546447
Energy: 0.5785186251503057
Energy: 0.5683670698779958
Energy: 0.5733287888018297
Energy: 0.5912856385552892
Energy: 0.573816805637842
Energy: 0.5707179649674378
Energy: 0.647313792684352
Energy: 0.5677671561894901
Energy: 0.5738168056349415
Energy: 0.5707179649642151
Energy: 0.6473137926824329
Energy: 0.5799043506897477
Energy: 0.5683820462891865
Energy: 0.6063791544623782
Energy: 0.5705101972063313
Energy: 0.5799043506900698
Energy: 0.5683820462907979
Energy: 0.6063791544617336
Energy: 0.5714749722207425
Energy: 0.5805119021438633
Energy: 0.6218752010508667
Energy: 0.5752026895217246
Energy: 0.5714749722194533
Energy: 0.5805119021477305
Energy: 0.6218752010531227

minimum gb energy = 0.5557633464357985 eV
minimum distance =  2.57225294223479 Angstroms
sigma value = 39


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

Energy: 0.5717479205820782
Energy: 0.5779038817741416
Energy: 0.5978667051973795
Energy: 0.577877046737419
Energy: 0.5717479205767879
Energy: 0.5779038817661545
Energy: 0.6221705054893288
Energy: 0.5636179696977066
Energy: 0.591349938384485
Energy: 0.5493449013772672
Energy: 0.590933511433753
Energy: 0.5636179696996084
Energy: 0.5913499383871474
Energy: 0.5493449013711817
Energy: 0.5718180913915515
Energy: 0.5458945047440981
Energy: 0.5708497158356423
Energy: 0.559619619348175
Energy: 0.5718180914033077
Energy: 0.5458945047494228
Energy: 0.570849715831078
Energy: 0.5696167270464825
Energy: 0.5915669348972168
Energy: 0.5498651799078446
Energy: 0.563663460381347
Energy: 0.5696167270464825
Energy: 0.5915669348972168
Energy: 0.5498651799177335
Energy: 0.5990504974960938
Energy: 0.5594233201395505
Energy: 0.5593501584517144
Energy: 0.5592924123068475
Energy: 0.5990504974957135
Energy: 0.5594233201437343
Energy: 0.5593501584528555
Energy: 0.5698944080036301
Energy: 0.563055633283041
Energy: 0.5950689287844363
Energy: 0.5687449444183555
Energy: 0.5698944080028695
Energy: 0.5630556332792376
Energy: 0.5950689287878594
Energy: 0.6213781840104795
Energy: 0.5599018357588431
Energy: 0.5872143483774714
Energy: 0.5603003233442315
Energy: 0.6213781840070564
Energy: 0.5599018357550397
Energy: 0.5575622070839412
Energy: 0.5768452423084853
Energy: 0.5451600600438848
Energy: 0.6164372305510208
Energy: 0.5453738333327893
Energy: 0.5768452423122888
Energy: 0.5451600600377994
Energy: 0.6164372305525422
Energy: 0.6214212983583199
Energy: 0.5600559247580122
Energy: 0.5873527606264705
Energy: 0.5598342106045894
Energy: 0.6214212983530296
Energy: 0.5600559247640978
Energy: 0.5716966415601454
Energy: 0.5700040331573019
Energy: 0.5687572788863352
Energy: 0.5950123573030365
Energy: 0.563073174767871
Energy: 0.5700040331576822
Energy: 0.5687572788908994
Energy: 0.5950123573125452
Energy: 0.599097453286192
Energy: 0.5592452215370449
Energy: 0.5693520801270181
Energy: 0.5593015513453827
Energy: 0.5990974532911366
Energy: 0.559245221529438
Energy: 0.5656232926976298
Energy: 0.5643072576163278
Energy: 0.5637708926660104
Energy: 0.549747812402783
Energy: 0.5915371676365524
Energy: 0.5643072576148065
Energy: 0.5637708926682925
Energy: 0.5497478124062062
Energy: 0.5718428958149403
Energy: 0.5595975684652325
Energy: 0.5750971436326959
Energy: 0.5458807475867787
Energy: 0.5718428958107564
Energy: 0.5595975684686555
Energy: 0.5731542487979556
Energy: 0.5635734462043253
Energy: 0.5908026279213209
Energy: 0.5494828872430623
Energy: 0.5911476796286605
Energy: 0.5635734462058466
Energy: 0.590802627921701
Energy: 0.5494828872453444
Energy: 0.5717479205816979
Energy: 0.5779038817722401
Energy: 0.61108906901911
Energy: 0.5778770467381797
Energy: 0.5717479205760273
Energy: 0.5779038817642527
Energy: 0.5937785698667173
Energy: 0.563617969698087
Energy: 0.591349938384485
Energy: 0.5493449013799296
Energy: 0.590933511434894
Energy: 0.563617969700369
Energy: 0.5913499383879081
Energy: 0.5493449013727031
Energy: 0.5718180913911712
Energy: 0.545894504742957
Energy: 0.5708497158356423
Energy: 0.5596196193485554
Energy: 0.5718180914044487
Energy: 0.5458945047475211
Energy: 0.5708497158322191
Energy: 0.5696167270464825
Energy: 0.5915669348960757
Energy: 0.5498651799093659
Energy: 0.5636634603832141
Energy: 0.5696167270461022
Energy: 0.5915669348972168
Energy: 0.5498651799181138
Energy: 0.5990504974979955
Energy: 0.5594233201399308
Energy: 0.5593501584513342
Energy: 0.5592924123068475
Energy: 0.5990504974976152
Energy: 0.5594233201448753
Energy: 0.5593501584532359
Energy: 0.5698944080024891
Energy: 0.5630556332822803
Energy: 0.5950689287829148
Energy: 0.5687449444183555
Energy: 0.5698944080028695
Energy: 0.5630556332784769
Energy: 0.5950689287859576
Energy: 0.6213781840127617
Energy: 0.5599018357577021
Energy: 0.5730666298475356
Energy: 0.560300323343851
Energy: 0.6213781840097188
Energy: 0.5599018357527575
Energy: 0.5575622070843215
Energy: 0.5768452423096264
Energy: 0.5451600600442652
Energy: 0.6164372305510208
Energy: 0.5453738333308875
Energy: 0.5768452423119085
Energy: 0.5451600600377994
Energy: 0.6164372305533029
Energy: 0.6214212983579395
Energy: 0.5600559247591533
Energy: 0.5962660551237438
Energy: 0.5598342106019615
Energy: 0.6214212983545511
Energy: 0.5600559247640978
Energy: 0.5893443314237337
Energy: 0.5700040331573019
Energy: 0.5687572788859548
Energy: 0.5950123573030365
Energy: 0.5630731747705333
Energy: 0.5700040331576822
Energy: 0.5687572788916601
Energy: 0.5950123573133058
Energy: 0.5990974532827689
Energy: 0.5592452215385664
Energy: 0.5679846869269923
Energy: 0.559301551344622
Energy: 0.5990974532896151
Energy: 0.5592452215321004
Energy: 0.5583279326950374
Energy: 0.5643072576167082
Energy: 0.5637708926671515
Energy: 0.5497478124031634
Energy: 0.5915371676369328
Energy: 0.5643072576148065
Energy: 0.5637708926690532
Energy: 0.5497478124054456
Energy: 0.5718428958126582
Energy: 0.5595975684644717
Energy: 0.5640729372680195
Energy: 0.5458807475875396
Energy: 0.5718428958107564
Energy: 0.5595975684678949
Energy: 0.584964681371176
Energy: 0.5635734462031843
Energy: 0.5908026279201798
Energy: 0.5494828872434427
Energy: 0.5911476796278998
Energy: 0.5635734462031843
Energy: 0.5908026279220815
Energy: 0.5494828872461051
Energy: 0.5717479205820782
Energy: 0.5779038817741416
Energy: 0.592574745879933
Energy: 0.577877046737419
Energy: 0.5717479205767879
Energy: 0.5779038817661545
Energy: 0.5980078850731342
Energy: 0.5636179696977066
Energy: 0.591349938384485
Energy: 0.5493449013776476
Energy: 0.590933511433753
Energy: 0.5636179696996084
Energy: 0.5913499383871474
Energy: 0.5493449013711817

minimum gb energy = 0.5451600600377994 eV
minimum distance =  2.60272136253974 Angstroms
sigma value = 21


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

Energy: 0.5844973070316416
Energy: 0.6258515920966452
Energy: 0.5851174974109461
Energy: 0.6258588962945622
Energy: 0.5844973070288711
Energy: 0.625851592093875
Energy: 0.5929388942065759
Energy: 0.5938204085665497
Energy: 0.5676854096882407
Energy: 0.5617168355640237
Energy: 0.5634052045029067
Energy: 0.593820408566088
Energy: 0.5676854096919344
Energy: 0.5617168355617151
Energy: 0.5844160024189737
Energy: 0.5623918052696681
Energy: 0.5751394025126342
Energy: 0.5582813794479689
Energy: 0.5844160024235909
Energy: 0.5623918052692064
Energy: 0.5855731429908142
Energy: 0.5844689387231435
Energy: 0.5632766082399951
Energy: 0.5813416667959965
Energy: 0.563728985544089
Energy: 0.5844689387231435
Energy: 0.563276608243689
Energy: 0.5813416667983051
Energy: 0.5612990331356615
Energy: 0.6034234586829941
Energy: 0.5778052370374689
Energy: 0.5771602178569775
Energy: 0.5612990331342763
Energy: 0.6034234586816088
Energy: 0.5778052370374689
Energy: 0.5843937804126652
Energy: 0.5584493488986889
Energy: 0.5792826323840703
Energy: 0.5705258580708031
Energy: 0.5843937804126652
Energy: 0.5584493488982272
Energy: 0.579282632384532
Energy: 0.5842945000309177
Energy: 0.6030944855868177
Energy: 0.555757362581556
Energy: 0.5703904207636444
Energy: 0.5842945000332262
Energy: 0.6030944855858943
Energy: 0.5557573625824794
Energy: 0.5845282768810605
Energy: 0.5611797253064825
Energy: 0.5792140570175962
Energy: 0.5703364767894951
Energy: 0.5845282768805987
Energy: 0.5611797253041739
Energy: 0.5792140570194432
Energy: 0.5842126262767032
Energy: 0.5714738559303731
Energy: 0.5897515189585164
Energy: 0.5802392492286638
Energy: 0.5842126262725477
Energy: 0.5714738559354521
Energy: 0.5814758308867611
Energy: 0.5824402177524297
Energy: 0.5573295223787793
Energy: 0.5707565711960769
Energy: 0.5698884369532379
Energy: 0.5824402177515062
Energy: 0.5573295223769322
Energy: 0.5707565711923831
Energy: 0.5855575472159682
Energy: 0.5893846996736889
Energy: 0.5727606522258055
Energy: 0.5691327579948183
Energy: 0.5855575472187385
Energy: 0.5893846996723037
Energy: 0.5727606522294993
Energy: 0.535947286874544
Energy: 0.5766497843119062
Energy: 0.5694730396033191
Energy: 0.5500940993912894
Energy: 0.535947286874544
Energy: 0.5766497843132913
Energy: 0.5694730396037808
Energy: 0.6041825579440513
Energy: 0.5672178754501725
Energy: 0.5786584771121108
Energy: 0.5683087079130501
Energy: 0.6041825579440513
Energy: 0.5672178754478641
Energy: 0.5786584771111873
Energy: 0.5361207626743523
Energy: 0.5765494387223807
Energy: 0.5789597713381077
Energy: 0.5443609646067624
Energy: 0.536120762672967
Energy: 0.5765494387209955
Energy: 0.5789597713371843
Energy: 0.5850443337731553
Energy: 0.5412711163714354
Energy: 0.5728767630361586
Energy: 0.5623638591394342
Energy: 0.5850443337690209
Energy: 0.5412711163668181
Energy: 0.5673001946386509
Energy: 0.5361003530162488
Energy: 0.603367101054542
Energy: 0.5800774263086017
Energy: 0.5696952245512816
Energy: 0.5361003530167106
Energy: 0.6033671010526953
Energy: 0.580077426306314
Energy: 0.5855561022654022
Energy: 0.5414282152453703
Energy: 0.5799891714811588
Energy: 0.5624709845547904
Energy: 0.5855561022654022
Energy: 0.5414282152412149
Energy: 0.5828122410990836
Energy: 0.5361297884687775
Energy: 0.5708457560691712
Energy: 0.5668625383208316
Energy: 0.5830848337830029
Energy: 0.5361297884692391
Energy: 0.5708457560691712
Energy: 0.5668625383226785
Energy: 0.5844452123820857
Energy: 0.5414185097220134
Energy: 0.6045924899494178
Energy: 0.5628887862110901
Energy: 0.5844452123820857
Energy: 0.5414185097275542
Energy: 0.6045924899549584
Energy: 0.5355898740398384
Energy: 0.5885174226699713
Energy: 0.5632813502678071
Energy: 0.588554299982223
Energy: 0.5355898740463025
Energy: 0.5885174226708948
Energy: 0.5632813502673455
Energy: 0.5844621624296552
Energy: 0.5629226847010733
Energy: 0.6046291262389754
Energy: 0.5414901817541256
Energy: 0.5844621624328873
Energy: 0.5629226846996881
Energy: 0.6046291262408223
Energy: 0.536156687783977
Energy: 0.5831097650852463
Energy: 0.5668918870155389
Energy: 0.5708418407335104
Energy: 0.5361566877876707
Energy: 0.5831097650894016
Energy: 0.5668918870127685
Energy: 0.5859119896160917
Energy: 0.5623852993228888
Energy: 0.579946427068901
Energy: 0.5413978569237585
Energy: 0.5859119896170152
Energy: 0.5623852993265827
Energy: 0.5799464270675158
Energy: 0.5361070253307294
Energy: 0.5696477383535319
Energy: 0.5798009131828152
Energy: 0.6032732815224187
Energy: 0.5361070253307294
Energy: 0.5696477383563022
Energy: 0.5798009131846622
Energy: 0.5850803243051558
Energy: 0.5623597115369683
Energy: 0.5894766196690618
Energy: 0.5412270610575678
Energy: 0.5850803243070027
Energy: 0.562359711534198
Energy: 0.5894766196686002

minimum gb energy = 0.5355898740398384 eV
minimum distance =  2.5858091190382 Angstroms
sigma value = 113


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

Energy: 0.5753962637402978
Energy: 0.6158090191464517
Energy: 0.5803156267833177
Energy: 0.6159548688041185
Energy: 0.5753962637469976
Energy: 0.6158090191420944
Energy: 0.5984580313995423
Energy: 0.6043272666753134
Energy: 0.586728935443043
Energy: 0.5971703270085323
Energy: 0.5865733233885725
Energy: 0.6043272666735331
Energy: 0.5867289354471661
Energy: 0.5971703270008017
Energy: 0.5760820351501468
Energy: 0.5846800582365758
Energy: 0.5919080705638742
Energy: 0.5874280831174666
Energy: 0.5760820351560502
Energy: 0.5846800582071995
Energy: 0.5919080705757278
Energy: 0.5495949494804371
Energy: 0.5866109524308352
Energy: 0.5957836315642865
Energy: 0.5852965088441534
Energy: 0.5495949494873711
Energy: 0.5866109524164046
Energy: 0.5957836315570711
Energy: 0.6195059778807264
Energy: 0.5573830354598268
Energy: 0.5969984085336159
Energy: 0.5536176768544241
Energy: 0.61950597788588
Energy: 0.557383035461373
Energy: 0.5969984085248546
Energy: 0.549464851626201
Energy: 0.5668996306393063
Energy: 0.5833325868847431
Energy: 0.5641437919256848
Energy: 0.549464851626482
Energy: 0.5668996306256722
Energy: 0.5833325868898969
Energy: 0.5693880092168087
Energy: 0.5572610592399677
Energy: 0.5911160898906257
Energy: 0.5596014269595025
Energy: 0.5693880092196666
Energy: 0.557261059243341
Energy: 0.6073603300674537
Energy: 0.5494064093520151
Energy: 0.5616793214069002
Energy: 0.6008791387266806
Energy: 0.5569068155164217
Energy: 0.5494064093530459
Energy: 0.5616793214058695
Energy: 0.6008791387047537
Energy: 0.5694070006668722
Energy: 0.5613788736176174
Energy: 0.638469865804409
Energy: 0.5567116721550901
Energy: 0.5694070006895486
Energy: 0.56137887361996
Energy: 0.6384698657979434
Energy: 0.5424205238932638
Energy: 0.5621082597710972
Energy: 0.6277688222515643
Energy: 0.5577470711899641
Energy: 0.542420523901744
Energy: 0.5621082597579786
Energy: 0.6277688222492217
Energy: 0.5689176183070928
Energy: 0.5605782904064176
Energy: 0.6377705021166988
Energy: 0.5569493989816945
Energy: 0.5689176183096696
Energy: 0.5605782904149446
Energy: 0.6377705021089682
Energy: 0.5424369632984034
Energy: 0.5548444499315095
Energy: 0.6246078858920456
Energy: 0.5619509112227131
Energy: 0.5424369632940461
Energy: 0.5548444499351172
Energy: 0.6246078858925609
Energy: 0.6071479184897717
Energy: 0.5680341289140424
Energy: 0.6218964293398428
Energy: 0.558472116112994
Energy: 0.6071479185147908
Energy: 0.5680341289199926
Energy: 0.6395832829800397
Energy: 0.584708969107199
Energy: 0.5927256693435672
Energy: 0.6063598592821802
Energy: 0.5785183913326235
Energy: 0.5847089691092604
Energy: 0.5927256693298864
Energy: 0.6063598592904261
Energy: 0.6070420049514449
Energy: 0.5743826087704664
Energy: 0.629948682242985
Energy: 0.5917698718241283
Energy: 0.6070420049277376
Energy: 0.5743826087761357
Energy: 0.6299486822538077
Energy: 0.5847311233043183
Energy: 0.5554551085185812
Energy: 0.6054531824849351
Energy: 0.5619938228337433
Energy: 0.5847311233112993
Energy: 0.5554551085227042
Energy: 0.6054531824973041
Energy: 0.6109002845373385
Energy: 0.5681253479052898
Energy: 0.6840430466203685
Energy: 0.558600327078911
Energy: 0.6109002845520033
Energy: 0.568125347901682
Energy: 0.6840430466095458
Energy: 0.5423484732495977
Energy: 0.5513844349098183
Energy: 0.6089023339775198
Energy: 0.5647064092844627
Energy: 0.5423484732642624
Energy: 0.5513844349046645
Energy: 0.6089023339759736
Energy: 0.6107124277586486
Energy: 0.5738895605459342
Energy: 0.6068460025003936
Energy: 0.5692210994924999
Energy: 0.6107124277655827
Energy: 0.5738895605487452
Energy: 0.624017262133817
Energy: 0.5545169527871657
Energy: 0.5597641206750219
Energy: 0.6266300279939274
Energy: 0.5544136054457012
Energy: 0.5545169527954117
Energy: 0.5597641206796603
Energy: 0.6266300279833855
Energy: 0.589038622766076
Energy: 0.5599429373223502
Energy: 0.6236320169013218
Energy: 0.5719462870742937
Energy: 0.5890386227655606
Energy: 0.5599429373334072
Energy: 0.6236320169000099
Energy: 0.5545691295569714
Energy: 0.5554812099267764
Energy: 0.6134085067354459
Energy: 0.5592811542024555
Energy: 0.5545691295530827
Energy: 0.5554812099131424
Energy: 0.6134085067351648
Energy: 0.5908515812682769
Energy: 0.5562200104287266
Energy: 0.6034337028725038
Energy: 0.5958078161401318
Energy: 0.5908515812737118
Energy: 0.5562200104387529
Energy: 0.6034337028866533
Energy: 0.5690816472697326
Energy: 0.5566851150144719
Energy: 0.6000834509247843
Energy: 0.5597353008442946
Energy: 0.5690816472705291
Energy: 0.5566851150170489
Energy: 0.600083450927127
Energy: 0.5626474351664412
Energy: 0.5883001509023466
Energy: 0.5925788949819843
Energy: 0.619705699145924
Energy: 0.5626474351692523
Energy: 0.5883001509100771
Energy: 0.5985681670106437
Energy: 0.5670317529107488
Energy: 0.5840291434152468
Energy: 0.6354981917233107
Energy: 0.5640089487644269
Energy: 0.5670317529181983
Energy: 0.5840291434091092
Energy: 0.6354981917119723
Energy: 0.5925288041074233
Energy: 0.5800296854823271
Energy: 0.566678867290602
Energy: 0.6184593602768474
Energy: 0.5925288040978655
Energy: 0.5800296854699583
Energy: 0.5666788672952404
Energy: 0.5683247328344986
Energy: 0.6119637544169909
Energy: 0.6379585582398843
Energy: 0.5914786930219135
Energy: 0.5683247328406831
Energy: 0.6119637544203643
Energy: 0.6379585582344496
Energy: 0.6367945528273186
Energy: 0.5804207271606112
Energy: 0.5981313490899326
Energy: 0.6201177967387622
Energy: 0.6367945528322382
Energy: 0.5804207271554574
Energy: 0.598131349089183
Energy: 0.5687805604412233
Energy: 0.581769912800481
Energy: 0.6367464415755223
Energy: 0.5640192310229165
Energy: 0.568780560421639
Energy: 0.5817699127870812
Energy: 0.636746441568026
Energy: 0.5887244441057966
Energy: 0.580458239562098
Energy: 0.6170846674509378
Energy: 0.6120633143497516
Energy: 0.5887244441303003
Energy: 0.5804582395636441
Energy: 0.6170846674383345
Energy: 0.5690735729473531
Energy: 0.5557185418383334
Energy: 0.5986352459785429
Energy: 0.5599691249325778
Energy: 0.5690735729424335
Energy: 0.5557185418463451
Energy: 0.5986352459847275
Energy: 0.589090475263301
Energy: 0.5614024311006075
Energy: 0.6090625665626347
Energy: 0.5949328036040333
Energy: 0.5890904752643318
Energy: 0.5614024310925958
Energy: 0.6090625665744882
Energy: 0.5612620156327038
Energy: 0.5566217256569527
Energy: 0.6024612578725241
Energy: 0.5612709457062098
Energy: 0.561262015635515
Energy: 0.5566217256651986
Energy: 0.602461257883347
Energy: 0.5680493771995645
Energy: 0.5566350834143499
Energy: 0.6063968996765737
Energy: 0.5922123789183698
Energy: 0.5680493771967066
Energy: 0.556635083411773
Energy: 0.6063968996722164
Energy: 0.5613176555876872
Energy: 0.5602691655510766
Energy: 0.5830334463400108
Energy: 0.5532153094579573
Energy: 0.5613176555923255
Energy: 0.5602691655685994
Energy: 0.583033446355753
Energy: 0.5628297558184492
Energy: 0.5600305822822761
Energy: 0.6166913281279061
Energy: 0.5959967566585138
Energy: 0.5628297558179338
Energy: 0.5600305822871955
Energy: 0.6166913281296862
Energy: 0.5607902174171993
Energy: 0.5599376430584326
Energy: 0.582253684329542
Energy: 0.5531699709096723
Energy: 0.5607902174200103
Energy: 0.5599376430587137
Energy: 0.5822536843506723
Energy: 0.5628297244625741
Energy: 0.5817311197292869
Energy: 0.6314494201856025
Energy: 0.581779549416818
Energy: 0.5628297244625741
Energy: 0.5817311197406252
Energy: 0.6314494201699069
Energy: 0.5737427259333722
Energy: 0.5840115375138927
Energy: 0.5989420333375066
Energy: 0.5773565191868488
Energy: 0.5737427259390413
Energy: 0.5840115375046159
Energy: 0.5989420333308068
Energy: 0.5905632401222168
Energy: 0.5881296220862008
Energy: 0.6162253787227278
Energy: 0.5772364303070574
Energy: 0.5905632401103633
Energy: 0.5881296220884966
Energy: 0.6162253787278814
Energy: 0.5738064468175029
Energy: 0.5654028752081254
Energy: 0.6813102785351849
Energy: 0.5930607368655585
Energy: 0.573806446805415
Energy: 0.5654028752040023
Energy: 0.6813102785410883
Energy: 0.5687601231416206
Energy: 0.588257881386149
Energy: 0.6063501630014064
Energy: 0.5979508397328119
Energy: 0.5687601231586279
Energy: 0.5882578813828225
Energy: 0.6063501630016408
Energy: 0.5823764703498205
Energy: 0.5692948412496575
Energy: 0.6058264640133985
Energy: 0.5605440263183752
Energy: 0.582376470339513
Energy: 0.5692948412400995
Energy: 0.6058264639958756
Energy: 0.5569416674707449
Energy: 0.5858156724944001
Energy: 0.6025721634145181
Energy: 0.5890977336666463
Energy: 0.556941667466903
Energy: 0.5858156725170767
Energy: 0.60257216340913

minimum gb energy = 0.5423484732495977 eV
minimum distance =  2.56405344341147 Angstroms
sigma value = 365


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

Energy: 0.5540700091024678
Energy: 0.49254105908649054
Energy: 0.5994687978082311
Energy: 0.4925410590899764
Energy: 0.554070009097239
Energy: 0.4925410590917194
Energy: 0.5594428293930014
Energy: 0.554070009096658
Energy: 0.4925410590888145
Energy: 0.5345609170673724
Energy: 0.49254105908649054
Energy: 0.5540700091030488
Energy: 0.4925410590917194
Energy: 0.5345609170650486
Energy: 0.5540700090960771
Energy: 0.49254105909113843
Energy: 0.5660104109664187
Energy: 0.4925410590928814
Energy: 0.5540700091030488
Energy: 0.4925410590870715
Energy: 0.5594428293953254
Energy: 0.554070009101306
Energy: 0.4925410590893955
Energy: 0.6822262587809306
Energy: 0.4925410590899764
Energy: 0.554070009096658
Energy: 0.4925410590923004
Energy: 0.4881451296783372
Energy: 0.554070009096658
Energy: 0.4925410590882335
Energy: 0.467187451380294
Energy: 0.4925410590853285
Energy: 0.5540700091036298
Energy: 0.4925410590917194
Energy: 0.5594428293947444
Energy: 0.554070009097239
Energy: 0.4925410590917194
Energy: 0.4881451520027337
Energy: 0.4925410590917194
Energy: 0.5540700091030488
Energy: 0.49254105908590956
Energy: 0.48814512468926446
Energy: 0.5540700091018869
Energy: 0.4925410590876525
Energy: 0.643887837120915
Energy: 0.4925410590917194
Energy: 0.554070009097239
Energy: 0.4925410590934624
Energy: 0.5660104109687426
Energy: 0.554070009096658
Energy: 0.4925410590934624
Energy: 0.54620618504273
Energy: 0.4925410590888145
Energy: 0.5540700091030488
Energy: 0.49254105909113843
Energy: 0.48814512287391576
Energy: 0.554070009096658
Energy: 0.4925410590899764
Energy: 0.5594428293930014
Energy: 0.4925410590923004
Energy: 0.5540700091036298
Energy: 0.4925410590847476
Energy: 0.5660104109646757
Energy: 0.5540700091024678
Energy: 0.4925410590876525
Energy: 0.683574700299735
Energy: 0.4925410590923004
Energy: 0.554070009096658
Energy: 0.4925410590888145
Energy: 0.5541903515864407
Energy: 0.5540700090960771
Energy: 0.4925410590888145
Energy: 0.46718745256323757
Energy: 0.4925410590847476
Energy: 0.5540700091030488
Energy: 0.4925410590923004
Energy: 0.5660104109658377
Energy: 0.554070009097239
Energy: 0.49254105909113843
Energy: 0.5345609170627246
Energy: 0.49254105909113843
Energy: 0.5540700091030488
Energy: 0.4925410590876525
Energy: 0.5541903515881836
Energy: 0.5540700091024678
Energy: 0.4925410590870715
Energy: 0.6469790919211068
Energy: 0.4925410590928814
Energy: 0.554070009097239
Energy: 0.4925410590899764
Energy: 0.5541903515876027
Energy: 0.554070009096658
Energy: 0.49254105909113843
Energy: 0.5345609170656296
Energy: 0.4925410590876525
Energy: 0.5540700091030488
Energy: 0.4925410590928814
Energy: 0.5541903515817929
Energy: 0.554070009096658
Energy: 0.4925410590905574
Energy: 0.5345609170627246
Energy: 0.4925410590934624
Energy: 0.5540700091036298
Energy: 0.49254105908590956
Energy: 0.5660104109669997
Energy: 0.5540700091018869
Energy: 0.4925410590888145
Energy: 0.4881451676156405
Energy: 0.4925410590876525
Energy: 0.554070009096658
Energy: 0.49254105909113843
Energy: 0.5660104109658377
Energy: 0.554070009096658
Energy: 0.4925410590876525
Energy: 0.5345609170633056
Energy: 0.49254105908590956
Energy: 0.5540700091036298
Energy: 0.4925410590923004
Energy: 0.5660104109669997
Energy: 0.554070009096658
Energy: 0.49254105909113843
Energy: 0.5345609170615626
Energy: 0.49254105909113843
Energy: 0.5540700091030488
Energy: 0.4925410590870715
Energy: 0.4881451753544484
Energy: 0.554070009101306
Energy: 0.4925410590888145
Energy: 0.48814517204023095
Energy: 0.4925410590899764
Energy: 0.554070009097239
Energy: 0.4925410590905574
Energy: 0.48814517747935776
Energy: 0.554070009096658
Energy: 0.4925410590882335
Energy: 0.5345609170650486
Energy: 0.49254105908590956
Energy: 0.5540700091030488
Energy: 0.4925410590934624
Energy: 0.4881451785037446

minimum gb energy = 0.467187451380294 eV
minimum distance =  2.58461566881303 Angstroms
sigma value = 23