Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080053493380546
cohesive_energy=3.930314152984703
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.7505046928868197e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06388753471942e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.8571615914122e-19, 1.9324813688654397e-19, 7.75272444896358e-20, -6.808321432052279e-20, -2.52634416002388e-19, -4.88748788731602e-19, -7.94386412139978e-19, -1.1952926625592618e-18, -1.72852428335724e-18, -2.4493275292274997e-18, -3.44413502304444e-18, -4.81500541639386e-18, -6.75232535869398e-18, -9.61695309322062e-18, -1.410623599992228e-17, -2.1759801737007597e-17, -3.6448717335183e-17]
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: 0.014574858218603753
Energy: 0.015726074612987643
Energy: 0.20534460953613806
Energy: 0.4940024716718581
Energy: 0.4898384114813223
Energy: 0.1782377927220994
Energy: 0.015164944520819748
Energy: 0.015084191147756136
Energy: 0.406862328142349
Energy: 0.1400463027088265
Energy: 0.20486616951369013
Energy: 0.36191582014876433
Energy: 0.015689659105257315
Energy: 0.05971780214466871
Energy: 0.014965308906180561
Energy: 0.40733242834615335
Energy: 0.1381891748648176
Energy: 0.20527535747768466
Energy: 0.3615662412793946
Energy: 0.05855299171293846
Energy: 0.05970398532568839
Energy: 0.0164651986130603
Energy: 0.20554836623698522
Energy: 0.2058605796968194
Energy: 0.6272656835762294
Energy: 0.49002087656957055
Energy: 0.05886685943154751
Energy: 0.01518574082515254
Energy: 0.059480550997136304
Energy: 0.49507185502938006
Energy: 0.14263083422181563
Energy: 0.20487964055493454
Energy: 0.3620431675244986
Energy: 0.015389027234527324
Energy: 0.059235686267048934
Energy: 0.014907153390427693
Energy: 0.36119947237690647
Energy: 0.20786027844396382
Energy: 0.20520852225680852
Energy: 0.20506620230409228
Energy: 0.05851251233797316
Energy: 0.05947482955135515

minimum gb energy = 0.014574858218603753 eV
minimum distance =  2.85699404556252 Angstroms
sigma value = 5


========================================
theta = 24.432697679454535
========================================

Energy: 0.6875876413418055
Energy: 0.6114691934842841
Energy: 0.699730629815502
Energy: 0.644117137855468
Energy: 0.6448491144661127
Energy: 0.6452745162042101
Energy: 0.6110703587378198
Energy: 0.6067314555655238
Energy: 0.636289564194853
Energy: 0.6105730802302551
Energy: 0.6589537688411627
Energy: 0.6282481650994339
Energy: 0.6142760880400822
Energy: 0.65397274063341
Energy: 0.6014637896678975
Energy: 0.6643940805158692
Energy: 0.6719331193049337
Energy: 0.6223182170324608
Energy: 0.6402703656481907
Energy: 0.6630664711394629
Energy: 0.6341364310931651
Energy: 0.610571465209673
Energy: 0.635797631249482
Energy: 0.6195075731700193
Energy: 0.6248534633495052
Energy: 0.6254024233829748
Energy: 0.6130346315887617
Energy: 0.6344229572995821
Energy: 0.6455853911305685
Energy: 0.6187139492778913
Energy: 0.6404972994319177
Energy: 0.624520818529388
Energy: 0.6493414705042232
Energy: 0.6494376319633334
Energy: 0.6373420466719515
Energy: 0.6320481760013062
Energy: 0.6430259332706858
Energy: 0.6094658268326275
Energy: 0.6084991857232573
Energy: 0.6398018627883432
Energy: 0.6104545924074898
Energy: 0.6315472461489702
Energy: 0.6622714995390074
Energy: 0.6386319955368315
Energy: 0.6774605070633651
Energy: 0.6225061919956473
Energy: 0.6430943286681133
Energy: 0.6770349648273403
Energy: 0.6265352590325279
Energy: 0.6346939705587376
Energy: 0.6334036856600899
Energy: 0.6405319341510923
Energy: 0.6391673180261268
Energy: 0.6260060608618642
Energy: 0.6137311703463132
Energy: 0.6768536898814526
Energy: 0.6178321368193914
Energy: 0.6257287537026984
Energy: 0.6039491300960734
Energy: 0.6253696694079558
Energy: 0.6642918202857373
Energy: 0.6342794308076893
Energy: 0.6102348871620112
Energy: 0.6128191872060059
Energy: 0.6380083960273258
Energy: 0.6110156546698357
Energy: 0.6378241483046597
Energy: 0.6179646964660115
Energy: 0.6698279445023552
Energy: 0.6163374566038735
Energy: 0.6221510827925597
Energy: 0.6499277801936247
Energy: 0.6596569817870693
Energy: 0.6488990428276223
Energy: 0.6844242538705595
Energy: 0.6129860693318459
Energy: 0.6049117885940843
Energy: 0.6067449707944886
Energy: 0.6118996423024826
Energy: 0.6687801354522881
Energy: 0.6816778233034284
Energy: 0.6313306471037204
Energy: 0.6445630530628089
Energy: 0.6124401329692406
Energy: 0.6148305064855314
Energy: 0.6237389974712364
Energy: 0.6420624249431136
Energy: 0.6727199865583638
Energy: 0.6327640855190295
Energy: 0.6254347275124732
Energy: 0.6259498472836449
Energy: 0.6735442551326429
Energy: 0.6601264243777635
Energy: 0.6936113204454516
Energy: 0.6781353678558907
Energy: 0.6695548065855819
Energy: 0.679640195693678
Energy: 0.7074027733975192
Energy: 0.6375708871669999
Energy: 0.6187675774845895
Energy: 0.6130007174875878
Energy: 0.6258421001751483
Energy: 0.6538099668590882
Energy: 0.6277093624518867
Energy: 0.6398498485748443
Energy: 0.6153784047369466
Energy: 0.6373800931435583
Energy: 0.6294341651020089
Energy: 0.6151904253567633
Energy: 0.6653772679117896
Energy: 0.6361947662343577
Energy: 0.6162082690003298
Energy: 0.6465508748268849
Energy: 0.6213671418868426
Energy: 0.6228017111425425
Energy: 0.6523139641192228
Energy: 0.6588029287644513
Energy: 0.6328091774054457
Energy: 0.652396983031085
Energy: 0.603104100878032
Energy: 0.6311546733845068
Energy: 0.6474322156339007
Energy: 0.631260025782001
Energy: 0.6321895942181804
Energy: 0.713992468990852
Energy: 0.630961070531563
Energy: 0.6665871638543369
Energy: 0.6443862975068465
Energy: 0.6064462401715062
Energy: 0.6464881877401455
Energy: 0.6302342293900254
Energy: 0.6137552298493687
Energy: 0.6232670648346309
Energy: 0.6453586447807507
Energy: 0.6717406265584468
Energy: 0.6783796165279928
Energy: 0.6640916816068646
Energy: 0.6597801150958649
Energy: 0.6605473140221965
Energy: 0.6250713230649517
Energy: 0.6231402827648928
Energy: 0.7156832584168794
Energy: 0.6174722959414274
Energy: 0.6143451189066484
Energy: 0.6708512941239156
Energy: 0.6392160139212046
Energy: 0.6665217588731218
Energy: 0.7143356358645174
Energy: 0.6424780092648078
Energy: 0.658110217546801
Energy: 0.6424746783337841
Energy: 0.6626046453194678
Energy: 0.6649561332207871
Energy: 0.6233659547440933
Energy: 0.6226591598059218
Energy: 0.6086953471534499
Energy: 0.6117679682585913
Energy: 0.6188912318685876
Energy: 0.6517813568809373
Energy: 0.6116099829068047
Energy: 0.6270362797070337
Energy: 0.6145052182511181
Energy: 0.6410667462635187
Energy: 0.6980759524115512
Energy: 0.6316904347737525
Energy: 0.641762590604506
Energy: 0.6489330564414982
Energy: 0.6428415853941958
Energy: 0.6049675962695085
Energy: 0.6415940094972948
Energy: 0.6239117151267606
Energy: 0.6608693510149786
Energy: 0.6065421599262198
Energy: 0.6257915369920554
Energy: 0.6273015188993029
Energy: 0.6305185539399614
Energy: 0.6792883957087301
Energy: 0.6354482120167144
Energy: 0.6379351091485601
Energy: 0.6259197605218059
Energy: 0.6846918828262112
Energy: 0.6447853924932716
Energy: 0.6034679263860274
Energy: 0.6433389518740914
Energy: 0.6212614509030985
Energy: 0.6440758968896707
Energy: 0.6269438931544359
Energy: 0.6612621412880639
Energy: 0.6411375718739545
Energy: 0.6311869399197193
Energy: 0.6203447228261848
Energy: 0.6137082161651588
Energy: 0.6243719866345998
Energy: 0.612851228155376
Energy: 0.6381781204155326
Energy: 0.6365781322483642
Energy: 0.6301599393806274
Energy: 0.6424337401399428
Energy: 0.6136352557862377
Energy: 0.6085922478648683
Energy: 0.616745498598368
Energy: 0.6331804299440256
Energy: 0.6399807556314815
Energy: 0.6119804313802345
Energy: 0.6588715595708807
Energy: 0.6688195704281019
Energy: 0.64355941105007
Energy: 0.6333006618918836
Energy: 0.6169928840302371
Energy: 0.6560072256693754
Energy: 0.644461784615384
Energy: 0.6493972995698529
Energy: 0.6457928767053185
Energy: 0.6588184749623046
Energy: 0.6379495362315043
Energy: 0.6796041740754369
Energy: 0.6542660067664802
Energy: 0.6139580969193057
Energy: 0.6366757397798541
Energy: 0.6255517697660207
Energy: 0.6307795102393152
Energy: 0.6519582444215476
Energy: 0.6360178234113482
Energy: 0.640994481966027
Energy: 0.6155582204106758
Energy: 0.6255064295508044
Energy: 0.6601803881814282
Energy: 0.6590506511742423
Energy: 0.6461612243777672
Energy: 0.6621824329039308
Energy: 0.6462364250386643
Energy: 0.6198779205821875
Energy: 0.6531365492515577
Energy: 0.604196434086368
Energy: 0.658485773524543
Energy: 0.6578380266971698
Energy: 0.6203436614761728
Energy: 0.6478058290984263
Energy: 0.6478238843032926
Energy: 0.6136063894061997
Energy: 0.6376097464308308
Energy: 0.6735385452327056
Energy: 0.6289166465975529
Energy: 0.6550356936306824
Energy: 0.6292119947344827
Energy: 0.6163520538399891
Energy: 0.6439218157735724
Energy: 0.6398836312760858
Energy: 0.6034666674775304
Energy: 0.7150967097289349
Energy: 0.6402722782052703
Energy: 0.6620161906843964
Energy: 0.6079955768695658
Energy: 0.6230684930799215
Energy: 0.69042104662374
Energy: 0.6682700844095311
Energy: 0.6665359971049654
Energy: 0.648448798156586
Energy: 0.6218526701610321
Energy: 0.6128236372853808
Energy: 0.6208798651434292
Energy: 0.6144763042466072
Energy: 0.6408767631656471
Energy: 0.6636618893982847
Energy: 0.6289906914156537
Energy: 0.628330294423438
Energy: 0.6127764404610984
Energy: 0.6425015280179642
Energy: 0.6066571250297491
Energy: 0.609000170506849
Energy: 0.6402203603863268
Energy: 0.6784417720887825
Energy: 0.617464946073643
Energy: 0.6431802550493628
Energy: 0.6308914891128946
Energy: 0.6441061125182133
Energy: 0.6390909320347066
Energy: 0.6552656470979181
Energy: 0.6319551320808326
Energy: 0.6762958262023329
Energy: 0.6063037386394351
Energy: 0.6214154100529482
Energy: 0.6242302172020926
Energy: 0.6068755622471247
Energy: 0.6326050869009019
Energy: 0.6979558399741193
Energy: 0.6536610192240294
Energy: 0.6063958440180521
Energy: 0.6436956044029879
Energy: 0.6080836652277156
Energy: 0.6373399580205056
Energy: 0.6231746892346325
Energy: 0.6159779486412527
Energy: 0.6397728097340941
Energy: 0.6960419693703687
Energy: 0.660802698931167
Energy: 0.6968361524353215
Energy: 0.65754984637906
Energy: 0.6607747594463943
Energy: 0.6613244974612363
Energy: 0.6316737085606858
Energy: 0.6190072552684494
Energy: 0.6927213085034444
Energy: 0.6151035690203701
Energy: 0.639420058455139
Energy: 0.6301326091029157
Energy: 0.625978407878868
Energy: 0.6668434910671118
Energy: 0.7246840987585798
Energy: 0.6245254107157165
Energy: 0.6737826969286526
Energy: 0.6411083188671738
Energy: 0.6573073199163304
Energy: 0.6347067028421638
Energy: 0.6098036158607139
Energy: 0.6244106274672654
Energy: 0.6384180312020803
Energy: 0.6683724053310627
Energy: 0.6332347232040744
Energy: 0.6507034440239173
Energy: 0.6051859583502656
Energy: 0.6066230959606196
Energy: 0.6129666092136727
Energy: 0.665288846809699
Energy: 0.6675313506543199
Energy: 0.6312840523815049
Energy: 0.63274375742704
Energy: 0.661001559028898
Energy: 0.6330025529651586

minimum gb energy = 0.6014637896678975 eV
minimum distance =  2.60420116462372 Angstroms
sigma value = 401


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

Energy: 0.6533658112770684
Energy: 0.617879065420195
Energy: 0.6652454642706896
Energy: 0.6393188004303401
Energy: 0.8132652594998988
Energy: 0.6443801431039916
Energy: 0.6255611477919836
Energy: 0.6208950495398536
Energy: 0.6197429285514746
Energy: 0.6176518029954501
Energy: 0.6324953437061275
Energy: 0.6053042063803137
Energy: 0.6605874821787845
Energy: 0.6280869958059954
Energy: 0.6107682152639373
Energy: 0.6463566302431648
Energy: 0.655625455155433
Energy: 0.6333539023502064
Energy: 0.6512494898595267
Energy: 0.6516825334585771
Energy: 0.6503936710689804
Energy: 0.67211002415755
Energy: 0.6427769589042691
Energy: 0.6186923340286791
Energy: 0.636464270560912
Energy: 0.6057759601305911
Energy: 0.6185928817332832
Energy: 0.6683294257378902
Energy: 0.6818280205931524
Energy: 0.6408211998205903
Energy: 0.6095665324660635
Energy: 0.6209033435472673
Energy: 0.6033430137947098
Energy: 0.597581987715481
Energy: 0.6745130782314914
Energy: 0.6830828103482158
Energy: 0.6494436680857758
Energy: 0.6203910020509389
Energy: 0.6202264827009362
Energy: 0.6099522736060012
Energy: 0.617897628960249
Energy: 0.6592438541938841
Energy: 0.6494677954850459
Energy: 0.6601003821061647
Energy: 0.6180076293648894
Energy: 0.61624192774713
Energy: 0.6185462272665629
Energy: 0.6198359941157768
Energy: 0.6542748129563886
Energy: 0.6266359151892688
Energy: 0.6379234456793014
Energy: 0.6375428774723543
Energy: 0.6088290335023336
Energy: 0.6109924884647925
Energy: 0.6644597262431707
Energy: 0.6486733656717312
Energy: 0.6105437261971743
Energy: 0.6332580236753629
Energy: 0.6277346883828747
Energy: 0.6360193394341509
Energy: 0.6475578727942902
Energy: 0.6273530238604803
Energy: 0.6281059139236174
Energy: 0.618934218357164
Energy: 0.6090777710466591
Energy: 0.6312756654467294
Energy: 0.6011460095507714
Energy: 0.6504018445802443
Energy: 0.6153073151931772
Energy: 0.6251523988712749
Energy: 0.6051456365567445
Energy: 0.641908858589005
Energy: 0.6461919070654715
Energy: 0.6328424322567906
Energy: 0.6486555708382685
Energy: 0.6109467315374416
Energy: 0.6066968814602319
Energy: 0.6146771722942749
Energy: 0.6109995384774652
Energy: 0.6141620094742725
Energy: 0.6186231711861101
Energy: 0.6244516164262666
Energy: 0.619229565757606
Energy: 0.622776887643287
Energy: 0.6099358253894144
Energy: 0.6515454416047436
Energy: 0.6573333980463039
Energy: 0.6097175249012393
Energy: 0.6346242105946109
Energy: 0.6502312448850948
Energy: 0.6217583369928579
Energy: 0.612418632380287
Energy: 0.6392191855742165
Energy: 0.6416357946312119
Energy: 0.6117900555142126
Energy: 0.6363095957353908
Energy: 0.643269647530263
Energy: 0.6208231372693462
Energy: 0.7239414625014833
Energy: 0.6414641170699341
Energy: 0.6264695608853647
Energy: 0.6160978796866691
Energy: 0.6054172227734812
Energy: 0.6151336819518552
Energy: 0.6443779712604519
Energy: 0.696886132582908
Energy: 0.6399370424028838
Energy: 0.6173609567918961
Energy: 0.6131719575406355
Energy: 0.59809188905268
Energy: 0.602203132196298
Energy: 0.6397651190005292
Energy: 0.6478309402276443
Energy: 0.6270405809976308
Energy: 0.6350609617725923
Energy: 0.6157516636985456
Energy: 0.5982246293881363
Energy: 0.6192986503834316
Energy: 0.6235819179108648
Energy: 0.6190648241861963
Energy: 0.6497709238916993
Energy: 0.640633512808174
Energy: 0.6158253446818878
Energy: 0.6263668030451024
Energy: 0.6510379366290977
Energy: 0.651788344868995
Energy: 0.6356558261014762
Energy: 0.6308515765169059
Energy: 0.622223890990203
Energy: 0.6421847686501655
Energy: 0.6318697982995903
Energy: 0.6637040490111913
Energy: 0.6299878596465335
Energy: 0.6151265459430271
Energy: 0.6094590450834368
Energy: 0.6472552460933287
Energy: 0.6009974326777475
Energy: 0.6317666462901614
Energy: 0.6112190500111655
Energy: 0.6095882943958477
Energy: 0.6046023273304963
Energy: 0.6107454697162646
Energy: 0.6586240190613677
Energy: 0.618178366362108
Energy: 0.6418047308207873
Energy: 0.610432556916003
Energy: 0.6215865303011151
Energy: 0.6134915139410213
Energy: 0.6116580564632417
Energy: 0.6500232260682286
Energy: 0.6285234596407906
Energy: 0.6359603819577977
Energy: 0.6200964124001495
Energy: 0.6214373610127564
Energy: 0.6428802861076207
Energy: 0.6463967596441589
Energy: 0.6485620312758773
Energy: 0.6006902603354579
Energy: 0.6164769908906058
Energy: 0.6191082013140944
Energy: 0.6218829705039787
Energy: 0.6145821655653866
Energy: 0.6451419076518639
Energy: 0.6431732641046165
Energy: 0.6346095314584703
Energy: 0.6458344684270415
Energy: 0.634146594718939
Energy: 0.6544195944223132
Energy: 0.7291119731818091
Energy: 0.6565479201609369
Energy: 0.6325657530489255
Energy: 0.61553332887991
Energy: 0.6074825053703922
Energy: 0.6611905168657876
Energy: 0.6433055207234172
Energy: 0.7130380654808638
Energy: 0.6495523541116176
Energy: 0.6218720801480654
Energy: 0.6139881360367797
Energy: 0.5984262141688573
Energy: 0.6020419850284346
Energy: 0.6895908806458546
Energy: 0.6836745375072515
Energy: 0.6547409451824692
Energy: 0.6168176698809849
Energy: 0.6133401414203983
Energy: 0.5976327413854134
Energy: 0.6183502569461755
Energy: 0.6628254716660705
Energy: 0.6556883692238198
Energy: 0.6498785911934809
Energy: 0.6279592228284694
Energy: 0.6220441418744473
Energy: 0.6128589293533226
Energy: 0.6501277225477367
Energy: 0.6514207980114091
Energy: 0.6362340715405126
Energy: 0.6317967471941269
Energy: 0.63975078190956
Energy: 0.6132320484926341
Energy: 0.6128985317423421
Energy: 0.6682057058463993
Energy: 0.6322865093916696
Energy: 0.6313846782652773
Energy: 0.6427176306349961
Energy: 0.648443543040443
Energy: 0.6007094576475075
Energy: 0.6918935100934492
Energy: 0.6110628499217841
Energy: 0.6125468173008408
Energy: 0.6136009121592302
Energy: 0.6118886467655348
Energy: 0.653830644475929
Energy: 0.6246948346504199
Energy: 0.6263657650591915
Energy: 0.612733645970272
Energy: 0.628330166969263
Energy: 0.604607177745047
Energy: 0.6353200714014212
Energy: 0.6494604400872738
Energy: 0.6313727013864713
Energy: 0.6386593061006588
Energy: 0.6167361813406808
Energy: 0.6197273366192375
Energy: 0.6219785161769081
Energy: 0.6081806164709471
Energy: 0.6461387933349698
Energy: 0.6017150763279676
Energy: 0.6031407141676118
Energy: 0.6567253420742046
Energy: 0.6146067053884838
Energy: 0.7189114078187345
Energy: 0.6477689083968033
Energy: 0.6149876225584712
Energy: 0.6182442558412442
Energy: 0.6376536681229148
Energy: 0.614877738293698
Energy: 0.6572379336649631
Energy: 0.6280003911412919
Energy: 0.6606584334127611
Energy: 0.6398843122609437
Energy: 0.6096571878605785
Energy: 0.6155122949043019
Energy: 0.6317385973431828
Energy: 0.6729887492294893
Energy: 0.7114309723160798
Energy: 0.6515926891949144
Energy: 0.6503635279273847
Energy: 0.6279077350120517
Energy: 0.599995859453918
Energy: 0.6033421059091382
Energy: 0.6406587794380608
Energy: 0.6549310634994696
Energy: 0.6637202273359379
Energy: 0.622020511136888
Energy: 0.6163819114155393
Energy: 0.5973993341668714
Energy: 0.619291753506742
Energy: 0.6820764279556378
Energy: 0.6235337437070468
Energy: 0.6564917352826137
Energy: 0.6130765798435948
Energy: 0.6247699087867177
Energy: 0.6161489598534542
Energy: 0.6154710398166392
Energy: 0.6670228110194727
Energy: 0.607922248244152
Energy: 0.6138311433405469
Energy: 0.619601621256489
Energy: 0.6145075383856669
Energy: 0.645265177386008
Energy: 0.6658008987091366
Energy: 0.6358605981809372
Energy: 0.6101683894328431
Energy: 0.6443298435379538
Energy: 0.6712393750830454
Energy: 0.6104431734153412
Energy: 0.6437727039888443
Energy: 0.6094591038647322
Energy: 0.6189906298820608
Energy: 0.6173284181392888
Energy: 0.6190262207324496
Energy: 0.6244673330542873
Energy: 0.614691252318978
Energy: 0.6242552728599517
Energy: 0.6088921587259652
Energy: 0.628198306674008

minimum gb energy = 0.5973993341668714 eV
minimum distance =  2.59095140818039 Angstroms
sigma value = 311


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

Energy: 0.6425953363691164
Energy: 0.6095288066113541
Energy: 0.6751049054963509
Energy: 0.6055502749148463
Energy: 0.6381145324881202
Energy: 0.6230960644680263
Energy: 0.6125657375047298
Energy: 0.6280248595220642
Energy: 0.6333762577060705
Energy: 0.6230072857622565
Energy: 0.6295936377682277
Energy: 0.6147025845840633
Energy: 0.6174527561832163
Energy: 0.6693593301660173
Energy: 0.6228087642927991
Energy: 0.6059173947844764
Energy: 0.6276952486051379
Energy: 0.6365129641939629
Energy: 0.6172075633194375
Energy: 0.6042191542891643
Energy: 0.6256106697999506
Energy: 0.6294862438172356
Energy: 0.6742657713585026
Energy: 0.6321556127581942
Energy: 0.6391096083400983
Energy: 0.6528106756903829
Energy: 0.6458108061716797
Energy: 0.627037266832783
Energy: 0.6137453792017156
Energy: 0.6334476726304311
Energy: 0.6280665092028215
Energy: 0.6177717481647877
Energy: 0.6279784308163715
Energy: 0.6275582558443892
Energy: 0.637180345502056
Energy: 0.6126757073263968
Energy: 0.6264695491398631
Energy: 0.6186228237245864
Energy: 0.6109528066105272
Energy: 0.6149701411433953
Energy: 0.6111165006900193
Energy: 0.6348297001608414
Energy: 0.6384887035188648
Energy: 0.6228012023481453
Energy: 0.6392049064322431
Energy: 0.5959759005383585
Energy: 0.6388019454011086
Energy: 0.6389216458385562
Energy: 0.6440948587616301
Energy: 0.6173443618984858
Energy: 0.6332525434847998
Energy: 0.6384276957899757
Energy: 0.6101823288669194
Energy: 0.6277411492172569
Energy: 0.6171855309560805
Energy: 0.6423545138965977
Energy: 0.626383165259102
Energy: 0.6036573925917119
Energy: 0.6133638888518573
Energy: 0.6210029835358303
Energy: 0.6274961567187705
Energy: 0.6200099987834632
Energy: 0.6253050620486902
Energy: 0.6160433163706629
Energy: 0.649170537330724
Energy: 0.6146613336218102
Energy: 0.6487294679164601
Energy: 0.6522054685222352
Energy: 0.6231147627363286
Energy: 0.6209349044724596
Energy: 0.6284124683274889
Energy: 0.6179739060550477
Energy: 0.6177514677876693
Energy: 0.6269744696713632
Energy: 0.6279642706713696
Energy: 0.6204570868757587
Energy: 0.6287222623950064
Energy: 0.6137771529553732
Energy: 0.6257765715260359
Energy: 0.6120429346373192
Energy: 0.6070831615404949
Energy: 0.6185098626769652
Energy: 0.6232689576614278
Energy: 0.6129930592912026
Energy: 0.6669456597034805
Energy: 0.639994925981512
Energy: 0.6379395024033612
Energy: 0.6114216778404057
Energy: 0.6147897495504862
Energy: 0.6483417298790808
Energy: 0.6592547393969175
Energy: 0.6341865397357143
Energy: 0.679244023941692
Energy: 0.6164409912292821
Energy: 0.6579741576504178
Energy: 0.6870364936250831
Energy: 0.6553032689149758
Energy: 0.681137917987347
Energy: 0.6126112926752811
Energy: 0.6303456594148645
Energy: 0.6311400098354201
Energy: 0.6439456475854756
Energy: 0.6285279274089263
Energy: 0.5961877039672361
Energy: 0.6172803463788823
Energy: 0.6243654582599654
Energy: 0.618205417522437
Energy: 0.6205320563640498
Energy: 0.6138166150044243
Energy: 0.6279521811000887
Energy: 0.6021960965125936
Energy: 0.6262235733303554
Energy: 0.638216990443152
Energy: 0.6303668053680695
Energy: 0.627908598189549
Energy: 0.6253860279223862
Energy: 0.6167684484727
Energy: 0.627849575783546
Energy: 0.6232120114449979
Energy: 0.6091871401571933
Energy: 0.646058124179073
Energy: 0.619005493884104
Energy: 0.6091717897281479
Energy: 0.6260377242262583
Energy: 0.6054211914149495
Energy: 0.6383651463048122
Energy: 0.6417541048035764
Energy: 0.6405864386881068
Energy: 0.6660604445855409
Energy: 0.6323541577864268
Energy: 0.6287707855488092
Energy: 0.6258169834824894
Energy: 0.6463435732170348
Energy: 0.672492267076302
Energy: 0.6742329207310961
Energy: 0.6284203601735882
Energy: 0.6665866315518924
Energy: 0.6601096254406432
Energy: 0.6596176429517928
Energy: 0.7048370029295534
Energy: 0.6195798382367095
Energy: 0.6345922700738639
Energy: 0.6103998056574081
Energy: 0.6344963355423007
Energy: 0.6225584480290998
Energy: 0.634375657330659
Energy: 0.6431693213859706
Energy: 0.6143276227243556
Energy: 0.6197307475657569
Energy: 0.6231746853061847
Energy: 0.629609664938391
Energy: 0.6418292944975168
Energy: 0.6129834463190862
Energy: 0.6212416783431671
Energy: 0.6147634404767339
Energy: 0.6280152029200639
Energy: 0.6243764902260517
Energy: 0.6179670266492477
Energy: 0.6269640766516418
Energy: 0.6315501802372315
Energy: 0.6116194447059354
Energy: 0.6434637325859494
Energy: 0.625639907136528
Energy: 0.6182825218531534
Energy: 0.5967114157987636
Energy: 0.6192196227127639
Energy: 0.6109376195786383
Energy: 0.6264573190740795
Energy: 0.6476203934615452
Energy: 0.633202216124276
Energy: 0.6420062261136321
Energy: 0.6301339056908535
Energy: 0.6207665736413451
Energy: 0.6397207232691101
Energy: 0.6458028193971077
Energy: 0.628584633530453
Energy: 0.6948240748715406
Energy: 0.6162141308368155
Energy: 0.6660260418268149
Energy: 0.6721808352626052
Energy: 0.6670430837186192
Energy: 0.6774934586052802
Energy: 0.6098045931164495
Energy: 0.6437386124798871
Energy: 0.6225268002423865
Energy: 0.6075952533936197
Energy: 0.6242272494072132
Energy: 0.6163036567056711
Energy: 0.6395582615889633
Energy: 0.6289537573906232
Energy: 0.6206013673431442
Energy: 0.6137587050722717
Energy: 0.6025730342542531
Energy: 0.6410747198465797
Energy: 0.6147680265022852
Energy: 0.6143760787869504
Energy: 0.6334926313048749
Energy: 0.6124519214362344
Energy: 0.614870372054093
Energy: 0.6264965135657745
Energy: 0.6265146704164909
Energy: 0.6182860197828073
Energy: 0.6106091195089371
Energy: 0.6095687536071157
Energy: 0.6465823075070073
Energy: 0.6210292747153854
Energy: 0.660218938209908
Energy: 0.6194752378780701
Energy: 0.6188934673208697
Energy: 0.6142936872825995
Energy: 0.6091590638389331
Energy: 0.6066705490347268
Energy: 0.6617122026487797
Energy: 0.6454819248435767
Energy: 0.6194615541122127
Energy: 0.6070744486423338
Energy: 0.6124400133867735
Energy: 0.6327114877642643
Energy: 0.6459374233516942
Energy: 0.6166261590120625
Energy: 0.7050669877612591
Energy: 0.6865006286853685
Energy: 0.6132761125472985
Energy: 0.6162115893492484
Energy: 0.6306697080379015
Energy: 0.6065298956575069
Energy: 0.6183552456399047
Energy: 0.6080949759324925
Energy: 0.6380060746469135
Energy: 0.614705953300961
Energy: 0.6346441584761828
Energy: 0.622424364021569
Energy: 0.637926192976309
Energy: 0.6164537640896698
Energy: 0.6084625004661415
Energy: 0.6256216791882673
Energy: 0.640507210380699
Energy: 0.6138525293474548
Energy: 0.6260231809002995
Energy: 0.6224374577288672
Energy: 0.6260724542109893
Energy: 0.6338499909874835
Energy: 0.6133184326195199
Energy: 0.6182690325095338
Energy: 0.6468632128416667
Energy: 0.6539073222518113
Energy: 0.6014874308852078
Energy: 0.6705083538475102
Energy: 0.6578665938206302
Energy: 0.6445520597331466
Energy: 0.6229111260067448
Energy: 0.6262314254204638

minimum gb energy = 0.5959759005383585 eV
minimum distance =  2.60117566448999 Angstroms
sigma value = 39


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

Energy: 0.5755505195323084
Energy: 0.5626442475313848
Energy: 0.7930995144868288
Energy: 0.7077232492383604
Energy: 0.6463792478351373
Energy: 0.6716433228592488
Energy: 0.5625748134171995
Energy: 0.5618820430267036
Energy: 0.6276433060413756
Energy: 0.6730431106350456
Energy: 0.6509965697583893
Energy: 0.6105785998393204
Energy: 0.6190998973933457
Energy: 0.613841690201412
Energy: 0.6193381741865988
Energy: 0.6009121153663199
Energy: 0.6079068286327313
Energy: 0.6460079832472503
Energy: 0.610842033490244
Energy: 0.61967527690304
Energy: 0.61705399011704
Energy: 0.6174222888351463
Energy: 0.5990954490600228
Energy: 0.6107113341523516
Energy: 0.6093076031302558
Energy: 0.6517318471180519
Energy: 0.6089852410624811
Energy: 0.662245568613324
Energy: 0.6368041498389977
Energy: 0.6092999084142502
Energy: 0.6648368969759268
Energy: 0.6093446922130628
Energy: 0.6454776624374897
Energy: 0.6123457627098767
Energy: 0.6175769409176671
Energy: 0.5621029317917037
Energy: 0.6102515571654218
Energy: 0.6076320317139353
Energy: 0.6012624687213116
Energy: 0.6289278759190939
Energy: 0.6205084473238365
Energy: 0.6276290562556777
Energy: 0.6184144195779715
Energy: 0.6172597364899972
Energy: 0.60524130810095
Energy: 0.7796525088594956
Energy: 0.5637668921241793
Energy: 0.5645924507883433
Energy: 0.6127112009750301
Energy: 0.5636134968717249
Energy: 0.6301867476919898
Energy: 0.6741317656982373
Energy: 0.6002819159725292
Energy: 0.6740911642750487
Energy: 0.6084582859190294
Energy: 0.6672229165419991
Energy: 0.5637637049547325
Energy: 0.6296192678825986
Energy: 0.674957079576428
Energy: 0.6007124394772416
Energy: 0.6087314649388732
Energy: 0.607714738530366
Energy: 0.6254963454217962
Energy: 0.617711821009851
Energy: 0.6185805374706916
Energy: 0.6093160506028518
Energy: 0.6438206819745677
Energy: 0.6099920419801252
Energy: 0.6176099203389493
Energy: 0.6173901521497598
Energy: 0.6195806213228356
Energy: 0.5992309077014845
Energy: 0.6110668601692623
Energy: 0.5987991257772156
Energy: 0.6092608124328247
Energy: 0.6266976837001125
Energy: 0.6648950786063649
Energy: 0.6274801751432343
Energy: 0.6110172345155163
Energy: 0.5973644855395854
Energy: 0.599409849229415
Energy: 0.6508560889733428
Energy: 0.6090167657487615
Energy: 0.62346005223815
Energy: 0.5636419930173706
Energy: 0.6098538291151799
Energy: 0.6750930897451972
Energy: 0.610267651015221
Energy: 0.6644657816548264
Energy: 0.6088508208230506
Energy: 0.6178881803928246
Energy: 0.6186085984483569
Energy: 0.6005894911346169
Energy: 0.6074017553844896
Energy: 0.6644420766658957
Energy: 0.5630109771503989
Energy: 0.5647957963190239
Energy: 0.6145130500566063
Energy: 0.5619370680896304
Energy: 0.6154073410481053
Energy: 0.6076858204143148
Energy: 0.651729495425058
Energy: 0.5622485953989852
Energy: 0.5624185064411186
Energy: 0.6144197461195492
Energy: 0.5757741762426705
Energy: 0.6485520991520826
Energy: 0.6299987388616747
Energy: 0.6081312763642764
Energy: 0.6458937312624324
Energy: 0.6716870498864335
Energy: 0.5624822890920622
Energy: 0.6228828171485894
Energy: 0.62620523181115
Energy: 0.6730553600513184
Energy: 0.6515064535012173
Energy: 0.6101964265042698
Energy: 0.6198525040879815
Energy: 0.6142291439960675
Energy: 0.6199116554555125
Energy: 0.6010243159351853
Energy: 0.6091317728655238
Energy: 0.6459228255270053
Energy: 0.6108543634203002
Energy: 0.6195663828854175
Energy: 0.6168584718469219
Energy: 0.6173773353127658
Energy: 0.5995989410552404
Energy: 0.6095831203933452
Energy: 0.6097495487172095
Energy: 0.6517037195806309
Energy: 0.6074548166210303
Energy: 0.7015032343042968
Energy: 0.6192204975789771
Energy: 0.6095690447653893
Energy: 0.6647916858493054
Energy: 0.6093898552106439
Energy: 0.6460151774731556
Energy: 0.612637800116994
Energy: 0.6216094028798808
Energy: 0.5621101775831717
Energy: 0.6102971142046874
Energy: 0.6070889510654819
Energy: 0.6013658586622875
Energy: 0.6281622662879496
Energy: 0.5621618879765778
Energy: 0.6159300184504887
Energy: 0.6181443320709212
Energy: 0.6167562045931864
Energy: 0.6050914251952256
Energy: 0.7800013528022746
Energy: 0.5637630403179211
Energy: 0.5647804038199374
Energy: 0.6127599110565441
Energy: 0.5633503173091
Energy: 0.6289076553314574
Energy: 0.7067361884165425
Energy: 0.6009160574832072
Energy: 0.6738296041554825
Energy: 0.6086611063604701
Energy: 0.6171690777063896
Energy: 0.5639843333368217
Energy: 0.6294154348467942
Energy: 0.6635977020422437
Energy: 0.600406670132356
Energy: 0.6089221627245459
Energy: 0.6080871655478404
Energy: 0.6254071959449125
Energy: 0.6178885427192008
Energy: 0.6183739998159021
Energy: 0.6092944095136096
Energy: 0.6438147918164164
Energy: 0.6098084949077672
Energy: 0.6182817293889538
Energy: 0.6172825326494327
Energy: 0.6191781900726294
Energy: 0.599154076243849
Energy: 0.6111523445500487
Energy: 0.5991112811654172
Energy: 0.608953359862545
Energy: 0.6073128588193197
Energy: 0.6650308843333067
Energy: 0.6275828538131649
Energy: 0.610798136745367
Energy: 0.5974160417405489
Energy: 0.5994275939528223
Energy: 0.6511217715187753
Energy: 0.6067256568926742
Energy: 0.6235607060196792
Energy: 0.5640677371339821
Energy: 0.6094821760495659
Energy: 0.6750385401369589
Energy: 0.6106913847094372
Energy: 0.6645718794548857
Energy: 0.6092563492302051
Energy: 0.6202540031373626
Energy: 0.6183769188083927
Energy: 0.6008991227872603
Energy: 0.6072589937051034
Energy: 0.6441924575714787
Energy: 0.56327423868447
Energy: 0.5644919010861567
Energy: 0.6144684981420605
Energy: 0.5617404209980877
Energy: 0.6154693386134256
Energy: 0.6116149134470616
Energy: 0.6008668401109452
Energy: 0.5625213247896375
Energy: 0.5625198642167586
Energy: 0.6143522755848105

minimum gb energy = 0.5617404209980877 eV
minimum distance =  2.64362116702619 Angstroms
sigma value = 21


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

Energy: 0.7367599265412639
Energy: 0.7205104938579993
Energy: 0.6375645919212414
Energy: 0.8051835681937294
Energy: 0.5926599027086019
Energy: 0.5898147489240223
Energy: 0.7200803497933926
Energy: 0.611162241079989
Energy: 0.5782676536879258
Energy: 0.6126590073581907
Energy: 0.6146901005248209
Energy: 0.5677009531807575
Energy: 0.5932842584841148
Energy: 0.6202844499791312
Energy: 0.59017503443559
Energy: 0.6006546367412304
Energy: 0.6276068296845001
Energy: 0.5947194373990957
Energy: 0.5574084066213598
Energy: 0.5978286726396617
Energy: 0.676695350137824
Energy: 0.7481129126451972
Energy: 0.5694454216209917
Energy: 0.6093476303935911
Energy: 0.6124572605115429
Energy: 0.5736252567859673
Energy: 0.6323232987112752
Energy: 0.6080839178825956
Energy: 0.5860284326730785
Energy: 0.5574903688325817
Energy: 0.6108303641885703
Energy: 0.5793802261477736
Energy: 0.5579550260938184
Energy: 0.6089084745533819
Energy: 0.607596138613241
Energy: 0.568585642812092
Energy: 0.5632654852332052
Energy: 0.6145250976755509
Energy: 0.5803480537249849
Energy: 0.5811605091073668
Energy: 0.6018145594601738
Energy: 0.6046124334032537
Energy: 0.595665083904081
Energy: 0.5784360899074306
Energy: 0.5900908999469644
Energy: 0.5949862504941945
Energy: 0.5694098824250656
Energy: 0.5723629567220931
Energy: 0.6045540949250862
Energy: 0.5920585362647843
Energy: 0.5823395169531934
Energy: 0.6288649990527582
Energy: 0.6291734581462439
Energy: 0.5746734365833498
Energy: 0.5857294882812335
Energy: 0.607987471732197
Energy: 0.5955264746359784
Energy: 0.5801287198095684
Energy: 0.6148863547767448
Energy: 0.6150650538039142
Energy: 0.6014745567718878
Energy: 0.6085275598708452
Energy: 0.6170445988302791
Energy: 0.5962767044915908
Energy: 0.6369477272041199
Energy: 0.6096792712589514
Energy: 0.6337118798720179
Energy: 0.5916622532509859
Energy: 0.5898714733286191
Energy: 0.5947006163318886
Energy: 0.5961188419389833
Energy: 0.5874901794163288
Energy: 0.6089331650547547
Energy: 0.6278705949958281
Energy: 0.568470187997328
Energy: 0.5691355130315966
Energy: 0.6030447797178203
Energy: 0.6334028461985641
Energy: 0.672720933601801
Energy: 0.6164478085214758
Energy: 0.6264838197240586
Energy: 0.5680452125458043
Energy: 0.7205658750621591
Energy: 0.6867279318476509
Energy: 0.7188950289520838
Energy: 0.6328498149638134
Energy: 0.6211771031455667
Energy: 0.6163784131509047
Energy: 0.5744295506832744
Energy: 0.5883377407330926
Energy: 0.5691836534366694
Energy: 0.7160043866849304
Energy: 0.6472029216930357
Energy: 0.6090873450450456
Energy: 0.5845604758264716
Energy: 0.6255877010306475
Energy: 0.622224858866322
Energy: 0.6090878097400707
Energy: 0.5896527111667634
Energy: 0.564266253968941
Energy: 0.610429894464512
Energy: 0.5942587577403726
Energy: 0.7560780098463626
Energy: 0.5977976599316546
Energy: 0.6882807522909961
Energy: 0.7401591998646897
Energy: 0.582403112268687
Energy: 0.6271365085051596
Energy: 0.6408599452938696
Energy: 0.5753531727792996
Energy: 0.6273089682329077
Energy: 0.6166528300951464
Energy: 0.5854774151812503
Energy: 0.6078728807986596
Energy: 0.6094920860074141
Energy: 0.581583186603702
Energy: 0.5356645559158204
Energy: 0.5954915920284667
Energy: 0.6095858281115536
Energy: 0.5688349785867804
Energy: 0.5571069421951043
Energy: 0.637178874731885
Energy: 0.5793857256622263
Energy: 0.6406649501917433
Energy: 0.6047393470206738
Energy: 0.6155122120520261
Energy: 0.5681471304906253
Energy: 0.6033810183472696
Energy: 0.608984350352301
Energy: 0.6367500575195778
Energy: 0.5780535789896163
Energy: 0.568967160220471
Energy: 0.6053364967571868
Energy: 0.5970470146562138
Energy: 0.5824344876116253
Energy: 0.6243367298306257
Energy: 0.6379157651578561
Energy: 0.5624237646923144
Energy: 0.5856815553393143
Energy: 0.6046720804574294
Energy: 0.5906743302881725
Energy: 0.5787986905142456
Energy: 0.6230533804601922
Energy: 0.688598165092447
Energy: 0.5788741013206412
Energy: 0.6070709710327296
Energy: 0.6147721462688116
Energy: 0.596608278625259
Energy: 0.5755886831241851
Energy: 0.6094108754042302
Energy: 0.61926661624959
Energy: 0.5726997958901425
Energy: 0.5960174498446991
Energy: 0.6018478294792488
Energy: 0.7474975105888403
Energy: 0.5789242501997921
Energy: 0.581665959156799
Energy: 0.6380762870792318
Energy: 0.6206316262855213
Energy: 0.6132956208833861
Energy: 0.6104139028305734
Energy: 0.5893990979484208
Energy: 0.5785556907049977
Energy: 0.5888678686153098
Energy: 0.5820428253418967
Energy: 0.7182358539077345
Energy: 0.718627001018232
Energy: 0.6874853700454061
Energy: 0.7159142420770391
Energy: 0.6184887907093184
Energy: 0.5953838938850328
Energy: 0.6714704774177026
Energy: 0.6397977346461536
Energy: 0.6285609858174235
Energy: 0.6101677895907525

minimum gb energy = 0.5356645559158204 eV
minimum distance =  2.625408105006 Angstroms
sigma value = 113


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

Energy: 0.7289475994766175
Energy: 0.7270986520216265
Energy: 0.796086196708177
Energy: 0.6592242033520395
Energy: 0.7325835809655925
Energy: 0.7297025804442502
Energy: 0.6654001327879406
Energy: 0.6786747222408092
Energy: 0.6142748022572333
Energy: 0.6650428644769909
Energy: 0.6160977082642344
Energy: 0.7113160619392745
Energy: 0.5860383614259975
Energy: 0.7317942050610532
Energy: 0.7346408244263213
Energy: 0.6660952089642422
Energy: 0.699338623541326
Energy: 0.6598786404518218
Energy: 0.7142734961177402
Energy: 0.6078294890136636
Energy: 0.7024614730753322
Energy: 0.7222117991203434
Energy: 0.6680001950734823
Energy: 0.6943004677875827
Energy: 0.7496259657604808
Energy: 0.7387441462734651
Energy: 0.6912313364205617
Energy: 0.7022052899279321
Energy: 0.5779560127862678
Energy: 0.6146493608565837
Energy: 0.6367965366555403
Energy: 0.6634431466788738
Energy: 0.6417251165529194
Energy: 0.6847226613784715
Energy: 0.7180399417442694
Energy: 0.6382947383565976
Energy: 0.6687513546505238
Energy: 0.6770359184139452
Energy: 0.6687613536437048
Energy: 0.6689758257996291
Energy: 0.6773617145602175
Energy: 0.6774158399403697
Energy: 0.6625029967516051
Energy: 0.5905878090962943
Energy: 0.6998488517322312
Energy: 0.6192893876185178
Energy: 0.6959440291885862
Energy: 0.6689886494039428
Energy: 0.6705307267105381
Energy: 0.6449529463138665
Energy: 0.6189502344172135
Energy: 0.5963578865267285
Energy: 0.6181755340624993
Energy: 0.6514314711953949
Energy: 0.594021226613166
Energy: 0.5819950402762426
Energy: 0.5820069038643356
Energy: 0.6577629907529259
Energy: 0.647187245116497
Energy: 0.5900887622629252
Energy: 0.6841522485081262
Energy: 0.7549620612784086
Energy: 0.6420975476591584
Energy: 0.7143274565706774
Energy: 0.6289182156691716
Energy: 0.5921255314540103
Energy: 0.6236840759002593
Energy: 0.60644832133325
Energy: 0.6092372682745789
Energy: 0.6065974697014087
Energy: 0.6369988772523992
Energy: 0.6076046729613775
Energy: 0.5916745803688637
Energy: 0.5729886627197887
Energy: 0.6295778569039276
Energy: 0.6697205826900218
Energy: 0.6410031829811669
Energy: 0.6093134680127051
Energy: 0.5925577255142496
Energy: 0.678108165752153
Energy: 0.6808608381195007
Energy: 0.6506628677547994
Energy: 0.7064196386214313
Energy: 0.5972700041120949
Energy: 0.6826878449902033
Energy: 0.6061596721284473
Energy: 0.6281172844273466
Energy: 0.6271105431639132
Energy: 0.6357696683549431
Energy: 0.6291303145368019
Energy: 0.5959165584646675
Energy: 0.6803655490509577
Energy: 0.5946510908183533
Energy: 0.6677617918787887
Energy: 0.6216059192901856
Energy: 0.602434873106402
Energy: 0.6714136322167658
Energy: 0.6131787835376765
Energy: 0.5979120176359489
Energy: 0.7474320665990958
Energy: 0.6476408198772824
Energy: 0.6231660144100549
Energy: 0.6338201328092321
Energy: 0.6526288595713546
Energy: 0.635194915831135
Energy: 0.5751626647709686
Energy: 0.6200681604849418
Energy: 0.6566659048833456
Energy: 0.6457226313906779
Energy: 0.6099129399757207
Energy: 0.6814234248636148
Energy: 0.6817077891671643
Energy: 0.6643175598495424
Energy: 0.6926042656965369
Energy: 0.6560201738879065
Energy: 0.7204571209555333
Energy: 0.7028883182452837
Energy: 0.7244236292053469
Energy: 0.5909879019101139
Energy: 0.6497933276553682
Energy: 0.7102935582658522
Energy: 0.6959658898497946
Energy: 0.7387115438447698
Energy: 0.7183792712389887
Energy: 0.6801993145786855
Energy: 0.7238915014717645
Energy: 0.6695593568129874
Energy: 0.7100378744024869
Energy: 0.622277402191186
Energy: 0.6690094742875486
Energy: 0.6486236392566667
Energy: 0.6444490547341188
Energy: 0.674510911165003
Energy: 0.6084871596725033
Energy: 0.6673259669695931
Energy: 0.7445757363253647
Energy: 0.6720700912604459
Energy: 0.7334505072813564
Energy: 0.6911974865648084
Energy: 0.7234315090390417
Energy: 0.6983474804765962
Energy: 0.6122902620841463
Energy: 0.6208289397075214
Energy: 0.6622580887629742
Energy: 0.7338810237465103
Energy: 0.7172600334100576
Energy: 0.7293855923815409
Energy: 0.699462763616508
Energy: 0.6743421322507802
Energy: 0.699338026573786
Energy: 0.6986229181932393
Energy: 0.7411021910155046
Energy: 0.7174281905673755
Energy: 0.7232400597869278
Energy: 0.7278122747472721
Energy: 0.6600205414498566
Energy: 0.791578339178915
Energy: 0.7593128564315184
Energy: 0.7320879554264826
Energy: 0.6910913598415981
Energy: 0.6695818256958358
Energy: 0.6908675976477168
Energy: 0.7190150626150387
Energy: 0.6284812254425417
Energy: 0.6617890984952888
Energy: 0.6514150670168349
Energy: 0.5838284686598835
Energy: 0.7318265798744277
Energy: 0.6512493427183957
Energy: 0.6663013136480886
Energy: 0.6877852754541071
Energy: 0.6221452937894674
Energy: 0.7412090313207375
Energy: 0.6795528704682917
Energy: 0.7451428481030847
Energy: 0.700324062189358
Energy: 0.6653932879271794
Energy: 0.6947017957817038
Energy: 0.7502929603028974
Energy: 0.7157133265707676
Energy: 0.691111046453637
Energy: 0.5974533680667576
Energy: 0.6203726159791657
Energy: 0.6294694946514671
Energy: 0.7110011787886346
Energy: 0.6634687774272978
Energy: 0.6199438033506827
Energy: 0.68881396387729
Energy: 0.652698056215197
Energy: 0.6378160960060496
Energy: 0.6396616111051269
Energy: 0.656414591113193
Energy: 0.6342439895303098
Energy: 0.6542748921167457
Energy: 0.6782873092109479
Energy: 0.7084264708723643
Energy: 0.664808700276528
Energy: 0.5900312974492294
Energy: 0.6643600391458298
Energy: 0.6764493086157403
Energy: 0.6805226441133422
Energy: 0.6693058769264963
Energy: 0.6469763127433046
Energy: 0.682256654590939
Energy: 0.6162026512440776
Energy: 0.6275176915930258
Energy: 0.6298432446825969
Energy: 0.6682305336574613
Energy: 0.6251834204501292
Energy: 0.5828769327525039
Energy: 0.5833213292325937
Energy: 0.6384452405571962
Energy: 0.648030344085507
Energy: 0.6231897260521205
Energy: 0.6694350204393589
Energy: 0.6773396162495559
Energy: 0.6758695960449739
Energy: 0.6075146836774356
Energy: 0.6407870336527508
Energy: 0.5912726947457643
Energy: 0.5977052984103605
Energy: 0.5940459427176982
Energy: 0.6118014014818481
Energy: 0.6056628297791016
Energy: 0.6352750957200616
Energy: 0.6012783906366193
Energy: 0.6116994151680801
Energy: 0.636484556144899
Energy: 0.6394356332386435
Energy: 0.6246014742165077
Energy: 0.6394420804422299
Energy: 0.5864327366774132
Energy: 0.5933904669239766
Energy: 0.6778774970555942
Energy: 0.7009789612454115
Energy: 0.6985302803091789
Energy: 0.7072269009142577
Energy: 0.6424317186669983
Energy: 0.6843951362338547
Energy: 0.6057564219197343
Energy: 0.6284711417554454
Energy: 0.627161009468715
Energy: 0.6117408551717232
Energy: 0.6382975255007338
Energy: 0.5956876503374054
Energy: 0.6790165921630203
Energy: 0.6175124544580579
Energy: 0.6670140548235691
Energy: 0.6284519389284148
Energy: 0.6043149760978757
Energy: 0.6636162288870187
Energy: 0.6130228449996088
Energy: 0.6097735381288432
Energy: 0.6460654313460868
Energy: 0.647031692186784
Energy: 0.5899132316452634
Energy: 0.633047849608289
Energy: 0.652383306943068
Energy: 0.63890251483363
Energy: 0.5763735850886355
Energy: 0.6158707989551595
Energy: 0.6543751228477875
Energy: 0.646230520835713
Energy: 0.6205797466935953
Energy: 0.6563839041377256
Energy: 0.6781809583201983
Energy: 0.6619082561864366
Energy: 0.6653058590177895
Energy: 0.6557951151276695
Energy: 0.6993394087028543
Energy: 0.7025184490472152
Energy: 0.6821471834419408
Energy: 0.6203144196671352
Energy: 0.651363281967829
Energy: 0.6893105997827347
Energy: 0.6965750451092324
Energy: 0.6622363579883755
Energy: 0.6762259953129529
Energy: 0.6107787625547921
Energy: 0.685025308094942
Energy: 0.7151493303769125
Energy: 0.753520621891909
Energy: 0.6892816119550041
Energy: 0.7004730998979651
Energy: 0.5915760750626952
Energy: 0.6009501614416761
Energy: 0.702055399437889
Energy: 0.6815538201098653
Energy: 0.6675222672557928
Energy: 0.7446178214499154
Energy: 0.6284967920637043
Energy: 0.7324893264441873
Energy: 0.7231802895531129
Energy: 0.6768884401039141
Energy: 0.6991456285026323
Energy: 0.6069848725908941
Energy: 0.622377900777394
Energy: 0.6592434048561536
Energy: 0.7483127557769593
Energy: 0.7166176831118685
Energy: 0.7018589981101281
Energy: 0.6983214776082746
Energy: 0.679579902148464
Energy: 0.6992796935205327
Energy: 0.6996978924798474
Energy: 0.7459836567461611
Energy: 0.7175066137876709
Energy: 0.6949277391351839
Energy: 0.719368239760623
Energy: 0.6838682301015118
Energy: 0.7915793309805421
Energy: 0.7648995853762552
Energy: 0.7131371423997008
Energy: 0.6916211969551332
Energy: 0.669679305281778

minimum gb energy = 0.5729886627197887 eV
minimum distance =  2.60551070003286 Angstroms
sigma value = 365


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

Energy: 0.6429571718169194
Energy: 0.6347202946189225
Energy: 0.6328881509097735
Energy: 0.5749227783979864
Energy: 0.5740891697953944
Energy: 0.6296233291897159
Energy: 0.6353406409712853
Energy: 0.6404783518737059
Energy: 0.6911623284844387
Energy: 0.5744972061909734
Energy: 0.5756408442071308
Energy: 0.5752232711853713
Energy: 0.5749114801683336
Energy: 0.691047568348724
Energy: 0.6190757901519416
Energy: 0.6895929916118476
Energy: 0.5753962134234972
Energy: 0.5747419681389254
Energy: 0.5753440461224913
Energy: 0.5751373845596744
Energy: 0.5753416078802016
Energy: 0.6197205880081014
Energy: 0.6901179665821122
Energy: 0.5750057840404066
Energy: 0.5748959651306723
Energy: 0.5747076846420464
Energy: 0.5751172593025986
Energy: 0.5771597000597681
Energy: 0.6395570125777467
Energy: 0.6914375561891917
Energy: 0.6183090799197837
Energy: 0.6900999664724697
Energy: 0.5748287940508681
Energy: 0.617112854087464
Energy: 0.6907801916713514
Energy: 0.6245079459810577
Energy: 0.7630203619090498
Energy: 0.5745513766852655
Energy: 0.5741584282199242
Energy: 0.574086848221049
Energy: 0.5745247630662054
Energy: 0.6359649305522559
Energy: 0.6194409360955275
Energy: 0.6901764818490266
Energy: 0.5746262870784287
Energy: 0.575666535585648
Energy: 0.5753323280724421
Energy: 0.5748920526428417
Energy: 0.6904251328021997
Energy: 0.6195863538671237
Energy: 0.6901026253167717
Energy: 0.5753564170247343
Energy: 0.5750571495441794
Energy: 0.5755256077534596
Energy: 0.5752221005584647
Energy: 0.6904739068623434
Energy: 0.6215627011902928
Energy: 0.7623860694153228
Energy: 0.5744094240962531
Energy: 0.5744162682484214
Energy: 0.574474943806975
Energy: 0.5746864398401353
Energy: 0.6368913294791826
Energy: 0.6392924452850411
Energy: 0.6913275265687338
Energy: 0.6181914124184695
Energy: 0.6905350959991472
Energy: 0.7775448780811378
Energy: 0.6173341165874086
Energy: 0.690670724934039
Energy: 0.6207513636051514
Energy: 0.6909371111166458
Energy: 0.5749046332156665
Energy: 0.5743058376817124
Energy: 0.5748327769786351
Energy: 0.574630515402039
Energy: 0.6380156097774363
Energy: 0.6190780187366733
Energy: 0.6902485016052289
Energy: 0.5752854514436154
Energy: 0.5753155261193802
Energy: 0.57492061968831
Energy: 0.575513603228017
Energy: 0.6903230758887852
Energy: 0.6200061784151989
Energy: 0.6900497543094339
Energy: 0.5745948137562201
Energy: 0.5753880262417382
Energy: 0.5756261599448537
Energy: 0.5749776547911066
Energy: 0.690815673455825
Energy: 0.6226307915894992
Energy: 0.7637417163909123
Energy: 0.5749618188077901
Energy: 0.574194148077469
Energy: 0.5741973844414343
Energy: 0.5745754929250622
Energy: 0.6355036568627528
Energy: 0.6398197957065476
Energy: 0.6914717987301585
Energy: 0.6181201200729262
Energy: 0.5746439249303417
Energy: 0.5750587336849703
Energy: 0.5743589073039451
Energy: 0.6905001036736298
Energy: 0.6196378490510445
Energy: 0.6895155701131402
Energy: 0.5753231397037937
Energy: 0.5748219677378098
Energy: 0.5750796091541971
Energy: 0.5749166736524207
Energy: 0.5753421013953002
Energy: 0.6193340737471484
Energy: 0.6897267807954857
Energy: 0.5751919679502803
Energy: 0.5750870833015149
Energy: 0.5748445091734873
Energy: 0.575440982715683
Energy: 0.5754711100166715
Energy: 0.6400547064334057
Energy: 0.6911890599941531
Energy: 0.5739735818577947
Energy: 0.5752302372820414
Energy: 0.5752705482563035
Energy: 0.5745571596327862
Energy: 0.6905570978375097
Energy: 0.6342827874706094
Energy: 0.7628458093298113
Energy: 0.576254069737597
Energy: 0.573790406287836
Energy: 0.5750768671594224
Energy: 0.576340781234853
Energy: 0.6353532935198488
Energy: 0.6197274043107465
Energy: 0.6906287888466197
Energy: 0.5746570390605363
Energy: 0.5757528798071889
Energy: 0.5754635344929961
Energy: 0.574941510631718
Energy: 0.6908649283466045

minimum gb energy = 0.573790406287836 eV
minimum distance =  2.69056202464745 Angstroms
sigma value = 23