Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000
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=4.080053436756135
cohesive_energy=3.930314120603696
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]
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: 0.014573331857281635
Energy: 0.2059106482384687
Energy: 0.20534307508100386
Energy: 0.4943904520402874
Energy: 0.4898368411165605
Energy: 0.17823625806876545
Energy: 0.015163419281164076
Energy: 0.05865046331110451
Energy: 0.4068607753207975
Energy: 0.1400447741310686
Energy: 0.20486458873277202
Energy: 0.3619142903860789
Energy: 0.015688132784482403
Energy: 0.05971626611455105
Energy: 0.014963785005143103
Energy: 0.4073312441703498
Energy: 0.13818768669977657
Energy: 0.20527377756960402
Energy: 0.36156473247792126
Energy: 0.05855145403755179
Energy: 0.059702448479293034
Energy: 0.01646367239868446
Energy: 0.20554685303030473
Energy: 0.2058590475962362
Energy: 0.6272645736796072
Energy: 0.49001934831084004
Energy: 0.05886532298076284
Energy: 0.015184213613589034
Energy: 0.059479019995503354
Energy: 0.4950703940628041
Energy: 0.14262934070628816
Energy: 0.2048780852550586
Energy: 0.36204174337415157
Energy: 0.015387500955907091
Energy: 0.0592341540429303
Energy: 0.014905630600545821
Energy: 0.36119794258824006
Energy: 0.2078587800151335
Energy: 0.20520697620440456
Energy: 0.20506351145353094
Energy: 0.05851097639483048
Energy: 0.05947329407911986

minimum gb energy = 0.014573331857281635 eV
minimum distance =  2.8569940313384 Angstroms
sigma value = 5


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

Energy: 0.6875851646703102
Energy: 0.7331073870001504
Energy: 0.6997281511072673
Energy: 0.6441146703252199
Energy: 0.6446620495697009
Energy: 0.6452719236027245
Energy: 0.6105693551349998
Energy: 0.6067728328576947
Energy: 0.6363251907326417
Energy: 0.6105706113969225
Energy: 0.659235837831707
Energy: 0.6282476168753648
Energy: 0.6142735211159196
Energy: 0.6539702556679131
Energy: 0.6014597583497766
Energy: 0.6643915822812895
Energy: 0.6719306368690289
Energy: 0.6223157370677574
Energy: 0.6402678542944612
Energy: 0.6630642067679489
Energy: 0.6341339847569902
Energy: 0.6105694865809079
Energy: 0.635801975711626
Energy: 0.6195050794945194
Energy: 0.6248510131986501
Energy: 0.6253999099412605
Energy: 0.6130322088713774
Energy: 0.6344208512992362
Energy: 0.6455829222640044
Energy: 0.6187114211176853
Energy: 0.6404948281760721
Energy: 0.6245183740581937
Energy: 0.6493390752134961
Energy: 0.6494350915460289
Energy: 0.6373394162500186
Energy: 0.6320196856665566
Energy: 0.6430235186830702
Energy: 0.6094628185562498
Energy: 0.6084968939948315
Energy: 0.6397994057046721
Energy: 0.6103724660983725
Energy: 0.6315487060240369
Energy: 0.6622747535608619
Energy: 0.638629478463707
Energy: 0.6774580157813364
Energy: 0.6225037653394009
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Energy: 0.6770325000348696
Energy: 0.6265332554816153
Energy: 0.6346914919846448
Energy: 0.6334009954709188
Energy: 0.6405294616115628
Energy: 0.6391645137829989
Energy: 0.6260035507337609
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Energy: 0.6151879409234745
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Energy: 0.6465484261626643
Energy: 0.6213646443108786
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Energy: 0.6259173008566701
Energy: 0.6846894035871699
Energy: 0.6447828212950035
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Energy: 0.6212589775766882
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Energy: 0.626941376738545
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Energy: 0.641134787446742
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Energy: 0.6381756429269652
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Energy: 0.6127739173953396
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Energy: 0.6784393034399488
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Energy: 0.6431777785651636
Energy: 0.6308899851136414
Energy: 0.6441037247053444
Energy: 0.6390884140358858
Energy: 0.6552631646443444
Energy: 0.6319526259748913
Energy: 0.6762931134879537
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Energy: 0.62141469921457
Energy: 0.6242290114590936
Energy: 0.606873085178014
Energy: 0.6326026242555348
Energy: 0.6979532674416652
Energy: 0.6536616805886691
Energy: 0.6063928436777564
Energy: 0.6436930249083407
Energy: 0.6080812794646453
Energy: 0.6373374164099606
Energy: 0.6231721898837925
Energy: 0.615975468608575
Energy: 0.6397684895994162
Energy: 0.6960404201739037
Energy: 0.6607995367973559
Energy: 0.6968336565250546
Energy: 0.657547365809701
Energy: 0.6607722835115075
Energy: 0.6613220174037627
Energy: 0.6316785026303872
Energy: 0.6190047761671319
Energy: 0.6927188533191567
Energy: 0.615101034730829
Energy: 0.6394175457529097
Energy: 0.6301295572394671
Energy: 0.6259759641891874
Energy: 0.6668430413312101
Energy: 0.7246816195447254
Energy: 0.6245230386323259
Energy: 0.673780172467271
Energy: 0.641503698187145
Energy: 0.657304970538518
Energy: 0.6347042808238137
Energy: 0.6098011050918354
Energy: 0.624408121208582
Energy: 0.6384180616388532
Energy: 0.6683699830254713
Energy: 0.6330466239554688
Energy: 0.6507142734811135
Energy: 0.605183486211215
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Energy: 0.6652858950742898
Energy: 0.6675289063968274
Energy: 0.6312817159291294
Energy: 0.6327411446102499
Energy: 0.6609990935073085
Energy: 0.6330000856601725

minimum gb energy = 0.6014597583497766 eV
minimum distance =  2.60420269680187 Angstroms
sigma value = 401


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

Energy: 0.6843189984593124
Energy: 0.7269474811553965
Energy: 0.6489060014845789
Energy: 0.6397513998436561
Energy: 0.6291652789232247
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Energy: 0.6176446801678948
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Energy: 0.6062652663938625
Energy: 0.5981624460693514
Energy: 0.6185723269843538
Energy: 0.6649945272622563
Energy: 0.6301780114581973
Energy: 0.6691366616739532
Energy: 0.6201480482599419
Energy: 0.6204150343466345
Energy: 0.6146361348411755
Energy: 0.6486901822599561
Energy: 0.6538388614232019
Energy: 0.6108449110563601
Energy: 0.6305560003417392
Energy: 0.6439799774867645
Energy: 0.7107482444784251
Energy: 0.6307748887077673
Energy: 0.7000232622656777
Energy: 0.6475351522078006
Energy: 0.6516212150156028
Energy: 0.6484320501232816
Energy: 0.6413252776531834
Energy: 0.619275233107927
Energy: 0.6315571304719724
Energy: 0.6194310461338934
Energy: 0.630872958421344
Energy: 0.6118012403944615
Energy: 0.6274974753067724
Energy: 0.6470955157232169
Energy: 0.6267216722303829
Energy: 0.61794138368891
Energy: 0.6229654004379349
Energy: 0.6254018347537151
Energy: 0.6105269577873478
Energy: 0.6209075112117429
Energy: 0.6403540092021419
Energy: 0.6281632270776032
Energy: 0.6370956192283467
Energy: 0.6271194801970243
Energy: 0.6253287962768916
Energy: 0.6307921767959023
Energy: 0.6282270892278898
Energy: 0.6375154130869238
Energy: 0.6087641729912564
Energy: 0.6030199008745675
Energy: 0.6622629071260677
Energy: 0.6383595107608345
Energy: 0.7395008152311181
Energy: 0.6400173444439708
Energy: 0.6160917608290121
Energy: 0.6370171933191506
Energy: 0.6306651514329807
Energy: 0.6188381893947631
Energy: 0.6662030358638686
Energy: 0.6202851233923393
Energy: 0.6382626820872145
Energy: 0.6357024072268297
Energy: 0.6176548369268913
Energy: 0.6191957048462545
Energy: 0.6353180233931356
Energy: 0.6629091935558505
Energy: 0.7163681696749753
Energy: 0.6561221908664348
Energy: 0.6330715973797686
Energy: 0.6267838277716126
Energy: 0.5999694080510805
Energy: 0.6094141778875338
Energy: 0.6495902840746738
Energy: 0.6573299057634925
Energy: 0.6672478647595925
Energy: 0.622439329262494
Energy: 0.6174710064420968
Energy: 0.5980380747611161
Energy: 0.6201810501640418
Energy: 0.6834687674511758
Energy: 0.6212822429471633
Energy: 0.6497154823737157
Energy: 0.6143250573253966
Energy: 0.6259163544243131
Energy: 0.6167491360650108
Energy: 0.6191578528861115
Energy: 0.6670335668617898
Energy: 0.6093306542125265
Energy: 0.6210361861196141
Energy: 0.6202885556439968
Energy: 0.6161311309081198
Energy: 0.6353148385121294
Energy: 0.6818674910782061
Energy: 0.642223321087118
Energy: 0.6124396337859997
Energy: 0.6340734698759837
Energy: 0.6413852869181614
Energy: 0.6116542712811979
Energy: 0.6489425755815518
Energy: 0.6312330357053559
Energy: 0.6204748932678487
Energy: 0.6178566531311077
Energy: 0.6301728292023061
Energy: 0.6264442394786742
Energy: 0.615960850094821
Energy: 0.6237983050667045
Energy: 0.6159865538688292
Energy: 0.6231998636140457

minimum gb energy = 0.5949930097160533 eV
minimum distance =  2.58548979340897 Angstroms
sigma value = 311


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

Energy: 0.6341833882732025
Energy: 0.6070319615585283
Energy: 0.665706444319233
Energy: 0.620392276080028
Energy: 0.61551222276313
Energy: 0.6112235329957018
Energy: 0.6045419219408344
Energy: 0.620375067711952
Energy: 0.6193615050808522
Energy: 0.6430685075866955
Energy: 0.624330532124121
Energy: 0.6360795913653924
Energy: 0.6218011795309135
Energy: 0.6210662180875804
Energy: 0.6057180317696814
Energy: 0.5972280801710463
Energy: 0.6281842915981967
Energy: 0.6074848243453619
Energy: 0.6423848405818061
Energy: 0.6085334638753706
Energy: 0.6160888483175052
Energy: 0.6292181432238992
Energy: 0.6308360338600867
Energy: 0.6099066721146351
Energy: 0.6459463825397455
Energy: 0.6142714381440572
Energy: 0.6110073338433363
Energy: 0.6159864531516058
Energy: 0.6360632127053769
Energy: 0.618368116278193
Energy: 0.6183478695890458
Energy: 0.6751854411112732
Energy: 0.6400690481107827
Energy: 0.6308204976666079
Energy: 0.6519467246312556
Energy: 0.6241744181526163
Energy: 0.6388974728672538
Energy: 0.6182728933726919
Energy: 0.5963471264298231
Energy: 0.6126542524494958
Energy: 0.6166604319339666
Energy: 0.6236828054371096
Energy: 0.6155146599029593
Energy: 0.6223100314240186
Energy: 0.6114071963743446
Energy: 0.6208058850588953
Energy: 0.6051978215901553
Energy: 0.613419131598473
Energy: 0.6030200928554936
Energy: 0.6338212834960083
Energy: 0.6535003039250635
Energy: 0.644328527107018
Energy: 0.6191132447359697
Energy: 0.6272449755016768
Energy: 0.6221983149816604
Energy: 0.6060619576278006
Energy: 0.6167433616459831
Energy: 0.6389075002859379
Energy: 0.6231526950946271
Energy: 0.6230052916114573
Energy: 0.6454427549980309
Energy: 0.6037819396670537
Energy: 0.5937934368613452
Energy: 0.6075709821896794
Energy: 0.6138321736686234
Energy: 0.626019849379661
Energy: 0.6328485659827328
Energy: 0.63867934739967
Energy: 0.6097821818841761
Energy: 0.6059445753140141
Energy: 0.6401159617744446
Energy: 0.6152035135879719
Energy: 0.6287848348899312
Energy: 0.6407997166143404
Energy: 0.652405226683122
Energy: 0.6275202558830023
Energy: 0.6306779184941725
Energy: 0.6273532160667457
Energy: 0.6115431351629936
Energy: 0.6091020058892698
Energy: 0.6150222536752447
Energy: 0.6383025700489623
Energy: 0.6201862952430138
Energy: 0.644809209250224
Energy: 0.6148957257585889
Energy: 0.596888108862392
Energy: 0.621207540900412
Energy: 0.6046163208471029
Energy: 0.6472116266599215
Energy: 0.6118818274314723
Energy: 0.6395836079070433
Energy: 0.6388364649197382
Energy: 0.63555597902806
Energy: 0.6215293875498517
Energy: 0.6581911727174202
Energy: 0.7032130024131018
Energy: 0.6689574899445122
Energy: 0.6221166789951713
Energy: 0.6255607376688839
Energy: 0.6104792813987293
Energy: 0.6214010860190142
Energy: 0.6115128161417042
Energy: 0.6376268825310394
Energy: 0.6357373537706771
Energy: 0.60913490670273
Energy: 0.6169075022334787
Energy: 0.6227340376417877
Energy: 0.6240780850824744
Energy: 0.6195864143657677
Energy: 0.6304639996537224
Energy: 0.6195804436325385
Energy: 0.6271518379082371
Energy: 0.6454362640931592
Energy: 0.6067194396339584
Energy: 0.6461175472626529
Energy: 0.6292991906376977
Energy: 0.6554878586012881
Energy: 0.6363546804495458
Energy: 0.6364556240896392
Energy: 0.6052891922308189
Energy: 0.6059000789198964
Energy: 0.6184225555540454
Energy: 0.6005673108685634
Energy: 0.6189987160769307
Energy: 0.6125204679089643
Energy: 0.6399573119072354
Energy: 0.6287553605873103
Energy: 0.6424970062846934
Energy: 0.6104185273203679
Energy: 0.5990018987051257
Energy: 0.6178623554585324
Energy: 0.6137323847861503
Energy: 0.647482194140117
Energy: 0.6591648678167962
Energy: 0.6549981903744463
Energy: 0.6431158629547111
Energy: 0.6618966446627822
Energy: 0.686767623227716
Energy: 0.6634438055444518
Energy: 0.6964413328762806
Energy: 0.6130417651352885
Energy: 0.6374078234313815
Energy: 0.6253046049436294
Energy: 0.5940863035142223
Energy: 0.6259752241446765
Energy: 0.6296431538778201
Energy: 0.6159289034645428
Energy: 0.6281509389969752
Energy: 0.6041998947296762
Energy: 0.6045090380009394
Energy: 0.6036110637343072
Energy: 0.6190536578234993
Energy: 0.5987174407057737
Energy: 0.6568017142941522
Energy: 0.6430095918816814
Energy: 0.6375848826623469
Energy: 0.6164282229337027
Energy: 0.6176696989049021
Energy: 0.6521256512553507
Energy: 0.6322125018978625
Energy: 0.6349636686312274
Energy: 0.6128019867365294
Energy: 0.6056433647441748
Energy: 0.6045751633934751
Energy: 0.6061332744373081
Energy: 0.612788733511952
Energy: 0.6078438564093919
Energy: 0.6386021649367694
Energy: 0.6371147613552275
Energy: 0.6613241515306907
Energy: 0.6114451984520031
Energy: 0.6330427723511604
Energy: 0.6173481651726249
Energy: 0.6334346458148148
Energy: 0.6275854962340535
Energy: 0.6340190580696942
Energy: 0.6824993356394141
Energy: 0.6795584901289247
Energy: 0.6610953621430712
Energy: 0.7217785085155569
Energy: 0.6564027199930643
Energy: 0.6058459288064127
Energy: 0.6132903919064256
Energy: 0.6464492333090585
Energy: 0.6167077243892363
Energy: 0.6172114084500672
Energy: 0.6666115537837087
Energy: 0.6023261095398735
Energy: 0.6199503980468452
Energy: 0.6128257191644911
Energy: 0.6609785781296267
Energy: 0.6530442753981733
Energy: 0.60000898625187
Energy: 0.623239206972465
Energy: 0.6024951592819408
Energy: 0.604369052695248
Energy: 0.6236272104185971
Energy: 0.6168224588188158
Energy: 0.6305772125448434
Energy: 0.61535192853281
Energy: 0.6537555370020494
Energy: 0.6210922572331998
Energy: 0.631418374527651
Energy: 0.6087456191311713
Energy: 0.6029546042314845
Energy: 0.6406803207461368
Energy: 0.6414385575670561
Energy: 0.635650528043769
Energy: 0.6309313572532934
Energy: 0.6060626481206645
Energy: 0.6241495766165823
Energy: 0.605979994382251
Energy: 0.6243214284618235
Energy: 0.6117730690586497
Energy: 0.6347737869603138
Energy: 0.6065653667783492
Energy: 0.6258610847287981
Energy: 0.6237891936906422
Energy: 0.6398999257459999
Energy: 0.6203605505262171
Energy: 0.658099046056964
Energy: 0.7044196509834122
Energy: 0.6270307509376166
Energy: 0.6083738467336176
Energy: 0.6269207671826337
Energy: 0.594069433500034
Energy: 0.6214996615724416
Energy: 0.6095108187584646
Energy: 0.6487781406259507
Energy: 0.6174216055610671
Energy: 0.6045884736901735
Energy: 0.6122074527947884
Energy: 0.6124582180268594
Energy: 0.6282544329829374
Energy: 0.627225939608878
Energy: 0.6433842376392933
Energy: 0.6417747881912599
Energy: 0.628505807125755
Energy: 0.6354323411846884
Energy: 0.619979299491772
Energy: 0.64867974904968
Energy: 0.7148936715896987
Energy: 0.644831749754179
Energy: 0.6922451163389832
Energy: 0.663337291247607
Energy: 0.631362223077582
Energy: 0.6357420451103202
Energy: 0.6856779893019644
Energy: 0.6391434953407228
Energy: 0.6313200208370043
Energy: 0.609978078967591
Energy: 0.6147406903243404

minimum gb energy = 0.5937934368613452 eV
minimum distance =  2.60276951428304 Angstroms
sigma value = 39


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

Energy: 0.5755489203782813
Energy: 0.6795224482392431
Energy: 0.7930979254526863
Energy: 0.7077216461842277
Energy: 0.646377651635043
Energy: 0.6716417259544029
Energy: 0.5625732125370924
Energy: 0.6221210733119898
Energy: 0.6276417081289472
Energy: 0.6730415058223123
Energy: 0.6509949732728757
Energy: 0.6105769972236866
Energy: 0.6190982943351765
Energy: 0.6138400870533458
Energy: 0.619037306553872
Energy: 0.6009105264537946
Energy: 0.6079052301109932
Energy: 0.6460063859126391
Energy: 0.6108404306483545
Energy: 0.6196736735173951
Energy: 0.6170524301983435
Energy: 0.617420694614902
Energy: 0.5990938763421385
Energy: 0.6107096557870496
Energy: 0.6093059995563503
Energy: 0.6517302495443024
Energy: 0.6089836465700302
Energy: 0.6622439713346085
Energy: 0.6368025538058906
Energy: 0.6092983055210469
Energy: 0.6648353361627248
Energy: 0.6093430940976766
Energy: 0.6454761071969802
Energy: 0.6123441674270826
Energy: 0.6177660242894912
Energy: 0.5621013352078696
Energy: 0.6102499538976477
Energy: 0.607630428513552
Energy: 0.6012609641345179
Energy: 0.628926268018998
Energy: 0.620507100387158
Energy: 0.6276274482898494
Energy: 0.6184125063729535
Energy: 0.617258476420423
Energy: 0.6052397087968235
Energy: 0.7796509036885296
Energy: 0.5637652925773666
Energy: 0.5645908508066634
Energy: 0.6127095926184983
Energy: 0.5636118968153282
Energy: 0.630185087251092
Energy: 0.6741734914164155
Energy: 0.6000881799363768
Energy: 0.6740895810847246
Energy: 0.6084566883374478
Energy: 0.667221278736131
Energy: 0.5637621051676115
Energy: 0.6296176703253754
Energy: 0.6749567916749871
Energy: 0.6007108553359506
Energy: 0.6087298436789005
Energy: 0.6077131395855956
Energy: 0.6254947668369806
Energy: 0.6177102257454232
Energy: 0.6185789210088011
Energy: 0.6093144538581595
Energy: 0.6438190830882196
Energy: 0.6099904361243876
Energy: 0.6176083169171153
Energy: 0.6173884991255312
Energy: 0.6195790261633953
Energy: 0.5992293097407337
Energy: 0.6110652587374172
Energy: 0.5987975190056237
Energy: 0.6092592087893094
Energy: 0.6266960852910257
Energy: 0.6648933487882854
Energy: 0.6274579643392115
Energy: 0.6110156315960977
Energy: 0.5973627987817101
Energy: 0.599408242702771
Energy: 0.6508544931317876
Energy: 0.6090151943657064
Energy: 0.6234581182133703
Energy: 0.5636403933753794
Energy: 0.60985222666579
Energy: 0.675091507215312
Energy: 0.6102661731188475
Energy: 0.6644642157184616
Energy: 0.608849217674326
Energy: 0.6178865759013036
Energy: 0.6186069768962649
Energy: 0.6005878924133528
Energy: 0.6074001203776835
Energy: 0.6644404690804337
Energy: 0.563009381186207
Energy: 0.564794195848096
Energy: 0.6145114506220838
Energy: 0.561935458675563
Energy: 0.6154057447923978
Energy: 0.6076842324766826
Energy: 0.6517279299041229
Energy: 0.5622469465066318
Energy: 0.5624169047651356
Energy: 0.6144181437968941
Energy: 0.5757725774512641
Energy: 0.6485506193955707
Energy: 0.6299950802897734
Energy: 0.6081296853804424
Energy: 0.6458921322617165
Energy: 0.6716854596716798
Energy: 0.5624806917201634
Energy: 0.6228810042141456
Energy: 0.6262036324654013
Energy: 0.6730543970523647
Energy: 0.6515048554255765
Energy: 0.6101948237699731
Energy: 0.619850924603194
Energy: 0.6142275406882989
Energy: 0.6176246437137483
Energy: 0.601022713192464
Energy: 0.6091301738093488
Energy: 0.6459212281384004
Energy: 0.6108527604336212
Energy: 0.619564779550575
Energy: 0.6170071355678786
Energy: 0.6173757413660039
Energy: 0.599597325988209
Energy: 0.6095818318630404
Energy: 0.6096175280286166
Energy: 0.651702121908851
Energy: 0.6074533564525365
Energy: 0.7015016380873866
Energy: 0.6192188935220797
Energy: 0.609567440319949
Energy: 0.6647901277689116
Energy: 0.6093882645621032
Energy: 0.6460135728848053
Energy: 0.6126362144998622
Energy: 0.6216078098986842
Energy: 0.5621085768732198
Energy: 0.6102955109014051
Energy: 0.6070873013041244
Energy: 0.601364107425597
Energy: 0.6281606625772386
Energy: 0.56216028447423
Energy: 0.615928426377918
Energy: 0.6181427358030847
Energy: 0.6167549357720671
Energy: 0.6055307120555038
Energy: 0.7799997595555479
Energy: 0.5637614392643763
Energy: 0.5647788040632652
Energy: 0.6127583271323438
Energy: 0.5633487173653393
Energy: 0.6289060623051875
Energy: 0.7067345667913454
Energy: 0.6008978423498995
Energy: 0.6738280364044033
Energy: 0.6086595073955717
Energy: 0.6171674717951906
Energy: 0.5639827330523892
Energy: 0.6294138381073943
Energy: 0.6635966382556661
Energy: 0.6004050522771986
Energy: 0.6089205801347367
Energy: 0.608085524623379
Energy: 0.6254055930862942
Energy: 0.6178867312744547
Energy: 0.6183724251455981
Energy: 0.6092931422472134
Energy: 0.6438131953572942
Energy: 0.6098068901087788
Energy: 0.6182801272120906
Energy: 0.6172798735403376
Energy: 0.6191765947249099
Energy: 0.5991524700635469
Energy: 0.6111507355506779
Energy: 0.5991096744730633
Energy: 0.6089517565034265
Energy: 0.6073112686882176
Energy: 0.6650292330561516
Energy: 0.6275812457910813
Energy: 0.6107965340285145
Energy: 0.5974144514519162
Energy: 0.5994259860778397
Energy: 0.6511201717082696
Energy: 0.6067240332641084
Energy: 0.6235591009526916
Energy: 0.5640661375717816
Energy: 0.6094805719699797
Energy: 0.6750369578275787
Energy: 0.610689961302642
Energy: 0.6645692182431717
Energy: 0.6092545024242819
Energy: 0.6202524838974268
Energy: 0.6183753232561574
Energy: 0.6008975177565773
Energy: 0.6072573978500453
Energy: 0.64419087243482
Energy: 0.5632726387460266
Energy: 0.5644903010738617
Energy: 0.6144668956522266
Energy: 0.5617388201397647
Energy: 0.615467738831914
Energy: 0.6116133049875011
Energy: 0.6008655208385092
Energy: 0.5625197304532785
Energy: 0.5625182720864381
Energy: 0.6143506731474327

minimum gb energy = 0.5617388201397647 eV
minimum distance =  2.64362113975498 Angstroms
sigma value = 21


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

Energy: 0.7367586212315286
Energy: 0.7521843058888265
Energy: 0.6375632844121755
Energy: 0.8051820950273516
Energy: 0.5925261132390582
Energy: 0.5898119126510164
Energy: 0.7200790390290707
Energy: 0.5963589681862536
Energy: 0.5782669375986342
Energy: 0.6130253815905934
Energy: 0.614688751253481
Energy: 0.5676991445854516
Energy: 0.5932829544917819
Energy: 0.6202819873113783
Energy: 0.5901718869320988
Energy: 0.6006533513298276
Energy: 0.6276054720955182
Energy: 0.5947181241782834
Energy: 0.5574583398406058
Energy: 0.5978203761653084
Energy: 0.67669393121617
Energy: 0.7481116039461306
Energy: 0.5694437499867318
Energy: 0.609346344437971
Energy: 0.612454646848256
Energy: 0.5736239432487412
Energy: 0.6323219900728422
Energy: 0.6080826286034315
Energy: 0.5860271157098176
Energy: 0.557489032892872
Energy: 0.6108294638244054
Energy: 0.5793785368888748
Energy: 0.5579563142131636
Energy: 0.6089071737089796
Energy: 0.607594859556609
Energy: 0.5685843283822908
Energy: 0.5632641668678834
Energy: 0.6145238591665572
Energy: 0.5803471187227437
Energy: 0.5814185884785914
Energy: 0.6018132150483385
Energy: 0.6046111337731744
Energy: 0.5956998961444093
Energy: 0.5784347679964968
Energy: 0.5900895340990678
Energy: 0.5949849299508129
Energy: 0.5694085674137178
Energy: 0.5723616428613701
Energy: 0.6045527878057575
Energy: 0.5920571921817416
Energy: 0.5823382036496274
Energy: 0.6288636679021748
Energy: 0.6291193091786121
Energy: 0.574671917182681
Energy: 0.5857281683958524
Energy: 0.607986146979486
Energy: 0.5955251648932606
Energy: 0.580129688672799
Energy: 0.6146769903872522
Energy: 0.6150637258429743
Energy: 0.6014732246693995
Energy: 0.6081750491564005
Energy: 0.6170432686716399
Energy: 0.5962754784920348
Energy: 0.6369463531894834
Energy: 0.6096779354077654
Energy: 0.6337114061126718
Energy: 0.5916609421777727
Energy: 0.5898699593767492
Energy: 0.5947747682047345
Energy: 0.5961182446864768
Energy: 0.5874893111092017
Energy: 0.60893185250295
Energy: 0.6278679708139869
Energy: 0.5684774583798834
Energy: 0.5692287259457979
Energy: 0.6030434552506654
Energy: 0.6334019745899436
Energy: 0.6727196106197246
Energy: 0.6164462631021449
Energy: 0.6264818689952434
Energy: 0.5681730574975844
Energy: 0.7205646594782849
Energy: 0.6867265239002628
Energy: 0.7188937158215446
Energy: 0.6328482522723373
Energy: 0.6211813567387175
Energy: 0.6163763778151211
Energy: 0.5744282239661737
Energy: 0.5883371098489667
Energy: 0.5691820390254837
Energy: 0.7160030701105098
Energy: 0.6472015947647801
Energy: 0.6090860784478505
Energy: 0.5845588374581436
Energy: 0.6255864005581626
Energy: 0.6222197070436011
Energy: 0.6090865108417737
Energy: 0.5896524047311804
Energy: 0.5642649444842397
Energy: 0.6104289808534189
Energy: 0.5942574471758953
Energy: 0.7560767042064916
Energy: 0.5973881216658246
Energy: 0.6882794414651296
Energy: 0.7401588000552657
Energy: 0.5824018146957607
Energy: 0.6271351951227163
Energy: 0.6409459077559063
Energy: 0.575350157727772
Energy: 0.6273078432740963
Energy: 0.61665149824134
Energy: 0.5854761099964351
Energy: 0.6078715631234106
Energy: 0.6094908951470426
Energy: 0.5815818735283939
Energy: 0.5356633084608856
Energy: 0.5954902834669852
Energy: 0.6095845064639861
Energy: 0.5688336644730808
Energy: 0.557105842716521
Energy: 0.6371775265056224
Energy: 0.5793803200544434
Energy: 0.6406636222923688
Energy: 0.6047380231693571
Energy: 0.6155108978452112
Energy: 0.568145792118193
Energy: 0.6033797125191093
Energy: 0.6089834750190011
Energy: 0.6367487340398249
Energy: 0.5780522600000063
Energy: 0.5689658461505508
Energy: 0.60533520038556
Energy: 0.5970456499893607
Energy: 0.5824328431889443
Energy: 0.6243354618948944
Energy: 0.637914405968695
Energy: 0.562422499225994
Energy: 0.5856802418134696
Energy: 0.6046707580645593
Energy: 0.5906730152456197
Energy: 0.5787973587063059
Energy: 0.6230522054923026
Energy: 0.6885968637254228
Energy: 0.5788729073757249
Energy: 0.6070806067075022
Energy: 0.6147708397575937
Energy: 0.5966041445499527
Energy: 0.5755872425956691
Energy: 0.60940955234261
Energy: 0.6192652479965254
Energy: 0.5726984711568307
Energy: 0.5960161367542172
Energy: 0.6018466118809841
Energy: 0.7474961742058274
Energy: 0.5789216220893993
Energy: 0.581629635745059
Energy: 0.6380750446203943
Energy: 0.6206294799204419
Energy: 0.613294846925815
Energy: 0.6104125809391748
Energy: 0.5893984804487509
Energy: 0.5786765806419206
Energy: 0.5888617276581052
Energy: 0.5820828388752073
Energy: 0.718234288888629
Energy: 0.7186258495760701
Energy: 0.6874831183065736
Energy: 0.7159129335317697
Energy: 0.6184874727293084
Energy: 0.5953854026477698
Energy: 0.6713168077395474
Energy: 0.6397899710177478
Energy: 0.6285599229664997
Energy: 0.6103056984124295

minimum gb energy = 0.5356633084608856 eV
minimum distance =  2.62260891781629 Angstroms
sigma value = 113


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

Energy: 0.728945237975555
Energy: 0.8221568837190051
Energy: 0.7960838418197624
Energy: 0.6592216260211602
Energy: 0.7325651517080356
Energy: 0.7297001815348023
Energy: 0.6654142521370155
Energy: 0.6240702332956485
Energy: 0.614099098434761
Energy: 0.6650406975083741
Energy: 0.6158602523054264
Energy: 0.7113136939172482
Energy: 0.5857910458643085
Energy: 0.7317199458348844
Energy: 0.7348733440049552
Energy: 0.6661110416055793
Energy: 0.6993362565850288
Energy: 0.6598845685004558
Energy: 0.7142710598758218
Energy: 0.6078469383158115
Energy: 0.702685322424186
Energy: 0.7222094406177855
Energy: 0.6680742999974234
Energy: 0.6942980759282036
Energy: 0.7496236034065554
Energy: 0.7387418345460477
Energy: 0.691228989634144
Energy: 0.7024079938969324
Energy: 0.5779536476450682
Energy: 0.6145679487463547
Energy: 0.6365798210490017
Energy: 0.6634408275280922
Energy: 0.6417136884576465
Energy: 0.6847227863702909
Energy: 0.7180375754508217
Energy: 0.6382923690242644
Energy: 0.6687489896653844
Energy: 0.6770335229838721
Energy: 0.6687582315516944
Energy: 0.6689736808242339
Energy: 0.6773593275633366
Energy: 0.6774134707475113
Energy: 0.6625001353834038
Energy: 0.5908701746157197
Energy: 0.6998464859315024
Energy: 0.6192870197100212
Energy: 0.6959416635496103
Energy: 0.6689862650844011
Energy: 0.6705274159548297
Energy: 0.6449103739870554
Energy: 0.6189478155983879
Energy: 0.5963555056058975
Energy: 0.6179556438769681
Energy: 0.6514126850519052
Energy: 0.5940116239495395
Energy: 0.5817231369627043
Energy: 0.5820042925475121
Energy: 0.6579510891466938
Energy: 0.647184730287454
Energy: 0.5900880541944805
Energy: 0.6841498831888718
Energy: 0.7549596993307458
Energy: 0.6420939722375144
Energy: 0.7143251386301304
Energy: 0.628915583450339
Energy: 0.5921142420778217
Energy: 0.6236819579328183
Energy: 0.6064439850917025
Energy: 0.6092412036834645
Energy: 0.6065799022151862
Energy: 0.6369965055919513
Energy: 0.6075956823549741
Energy: 0.5916733135648855
Energy: 0.5728426649539696
Energy: 0.6292406747168927
Energy: 0.6696960207399533
Energy: 0.6410008145720817
Energy: 0.6093111343050829
Energy: 0.592555206873248
Energy: 0.6781058014473544
Energy: 0.6808584419071227
Energy: 0.650660462579406
Energy: 0.7064172733527001
Energy: 0.5970502725350966
Energy: 0.68268510426549
Energy: 0.6061573003952858
Energy: 0.628114916068635
Energy: 0.627108022614422
Energy: 0.6357672831963518
Energy: 0.6291279477466446
Energy: 0.5959142327709976
Energy: 0.6803631740806251
Energy: 0.5946481595696009
Energy: 0.6677556115728517
Energy: 0.6216038065725586
Energy: 0.6024333525681616
Energy: 0.6714106351740496
Energy: 0.6132141900460688
Energy: 0.5979096282124435
Energy: 0.7474296911931292
Energy: 0.6476384730063733
Energy: 0.6231559221422446
Energy: 0.633817771010542
Energy: 0.6526264614967657
Energy: 0.6351926430099519
Energy: 0.5751605096846867
Energy: 0.6200661343000896
Energy: 0.6566625323683616
Energy: 0.6457416682232809
Energy: 0.6099104809930318
Energy: 0.6814210514554859
Energy: 0.6817054235555853
Energy: 0.6643150442524034
Energy: 0.6926040626755257
Energy: 0.6560177944586598
Energy: 0.7204547684900159
Energy: 0.7028859502776336
Energy: 0.7244212625926009
Energy: 0.5911543350513045
Energy: 0.6497908263104338
Energy: 0.7102911753543802
Energy: 0.6959635352043557
Energy: 0.7387092965899639
Energy: 0.7183769085173577
Energy: 0.6801970069940951
Energy: 0.7238893160126878
Energy: 0.6695570119213323
Energy: 0.7100355747591541
Energy: 0.6222732714509677
Energy: 0.6690070459161516
Energy: 0.6487964993324442
Energy: 0.6441796937314169
Energy: 0.6745070262462725
Energy: 0.6087730179082287
Energy: 0.66732388392502
Energy: 0.7445733752983523
Energy: 0.6720715151816541
Energy: 0.7334482311233678
Energy: 0.6912096295697818
Energy: 0.7234734533855135
Energy: 0.6983457213404433
Energy: 0.6122653440967873
Energy: 0.6208362839874786
Energy: 0.6620126670136384
Energy: 0.733878632299019
Energy: 0.7172576722511926
Energy: 0.7293710065835866
Energy: 0.6994623371789119
Energy: 0.674340994680132
Energy: 0.6993356316511035
Energy: 0.6985919357905749
Energy: 0.7411002379179576
Energy: 0.7174258211952925
Energy: 0.7232378920082426
Energy: 0.727809912180861
Energy: 0.6600640812018819
Energy: 0.7915759843565419
Energy: 0.759310479625324
Energy: 0.7320856961719925
Energy: 0.6910898766500316
Energy: 0.6646037714079295
Energy: 0.690865567327774
Energy: 0.7190126326760373
Energy: 0.6284800427699804
Energy: 0.6618062727100278
Energy: 0.6515946811760691
Energy: 0.5799136318693162
Energy: 0.7318238932134192
Energy: 0.6512529470448708
Energy: 0.6663735301172786
Energy: 0.6877829848845888
Energy: 0.6228695430706689
Energy: 0.7412066694365328
Energy: 0.6795505076927378
Energy: 0.74514129123911
Energy: 0.700321711583901
Energy: 0.6653912188574662
Energy: 0.6946994648088934
Energy: 0.7502906408905009
Energy: 0.715710958470113
Energy: 0.691108688145865
Energy: 0.5974552002754623
Energy: 0.6203701953037765
Energy: 0.6294671417366156
Energy: 0.7109988238320136
Energy: 0.6634663904164632
Energy: 0.6199414291758915
Energy: 0.688811679721399
Energy: 0.6526949344228559
Energy: 0.6378137309819059
Energy: 0.6396642929891199
Energy: 0.6564122452404076
Energy: 0.6343650248265056
Energy: 0.6542725881365703
Energy: 0.6782849610751529
Energy: 0.7084249123393133
Energy: 0.6648063484639188
Energy: 0.5902617602463446
Energy: 0.6643609955483467
Energy: 0.6764469377796192
Energy: 0.6805201102281117
Energy: 0.6693035121152443
Energy: 0.6469739725820512
Energy: 0.6822542516740593
Energy: 0.6162003597948429
Energy: 0.6275153274108491
Energy: 0.6298387742357161
Energy: 0.668231997743239
Energy: 0.6251810514651319
Energy: 0.5827249147617661
Energy: 0.5833182381928552
Energy: 0.6384428307010745
Energy: 0.6480279928570816
Energy: 0.6231872501304093
Energy: 0.6694326552197127
Energy: 0.6773372862286094
Energy: 0.6758672239098812
Energy: 0.6075226633811754
Energy: 0.6407846684221273
Energy: 0.5912766925916096
Energy: 0.5977076906120327
Energy: 0.5940493214025058
Energy: 0.6118265447888561
Energy: 0.6056573439751819
Energy: 0.6352727113114863
Energy: 0.6012760384435194
Energy: 0.6116978934647878
Energy: 0.6364821735945151
Energy: 0.6394333473619637
Energy: 0.6245993576922517
Energy: 0.639446531527346
Energy: 0.5864061507505177
Energy: 0.5933882086285597
Energy: 0.6778751481387781
Energy: 0.7009766345539471
Energy: 0.6985278953471918
Energy: 0.7072245334996465
Energy: 0.6424289894668052
Energy: 0.6843937958006644
Energy: 0.6057539543985774
Energy: 0.6284687741486114
Energy: 0.6275068926751071
Energy: 0.6117381707592839
Energy: 0.638295153887359
Energy: 0.5956853494619787
Energy: 0.6790142313421538
Energy: 0.6175745237130226
Energy: 0.6670120063296011
Energy: 0.6284530190015281
Energy: 0.6043146456152921
Energy: 0.6636139033333637
Energy: 0.613020559217369
Energy: 0.6097711781228119
Energy: 0.6460629360441859
Energy: 0.647029332648926
Energy: 0.5899108467095363
Energy: 0.6330459243931632
Energy: 0.6523809275713237
Energy: 0.638958010120725
Energy: 0.5763712377603901
Energy: 0.6158684406823679
Energy: 0.6543729932724365
Energy: 0.6462281282502016
Energy: 0.620577368160578
Energy: 0.656381650623399
Energy: 0.6781785663649768
Energy: 0.6619066206221771
Energy: 0.6654406578670147
Energy: 0.655785251789135
Energy: 0.6993370592935114
Energy: 0.7025160551706473
Energy: 0.682144824521563
Energy: 0.6203827346186
Energy: 0.651360900875521
Energy: 0.6893099013002338
Energy: 0.6965725759917222
Energy: 0.6622263673585694
Energy: 0.6762236318775557
Energy: 0.6105426808707906
Energy: 0.6850234015903199
Energy: 0.7151469742516346
Energy: 0.7535182493867014
Energy: 0.6892792555569206
Energy: 0.7004732485713188
Energy: 0.5912792155748225
Energy: 0.6008981196687422
Energy: 0.7020657648768259
Energy: 0.6815476370606258
Energy: 0.6675233003136711
Energy: 0.74461546118873
Energy: 0.6281384468967889
Energy: 0.7324870007335441
Energy: 0.7231701772320591
Energy: 0.6770304855492618
Energy: 0.6991440032638534
Energy: 0.6070352395895693
Energy: 0.6223759747696175
Energy: 0.6593583740154642
Energy: 0.7483103958960206
Energy: 0.7166153149850701
Energy: 0.7020028953877516
Energy: 0.6984390573091294
Energy: 0.6795786895727366
Energy: 0.6992775290934871
Energy: 0.6996956376136804
Energy: 0.745981329035525
Energy: 0.7175042490260324
Energy: 0.6949406243231868
Energy: 0.7193658847248807
Energy: 0.6838319434744321
Energy: 0.7915769762588117
Energy: 0.764897244252799
Energy: 0.7131314310316929
Energy: 0.6916177076771042
Energy: 0.669677312406157

minimum gb energy = 0.5728426649539696 eV
minimum distance =  2.60539186309816 Angstroms
sigma value = 365


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

Energy: 0.6429557466568797
Energy: 0.796935490191964
Energy: 0.6328867435203247
Energy: 0.5749214457467781
Energy: 0.5740877460506041
Energy: 0.6296219200814125
Energy: 0.6353392387461684
Energy: 0.6199205382641783
Energy: 0.691160925061325
Energy: 0.5744197260629933
Energy: 0.5756394621072887
Energy: 0.5752218538556846
Energy: 0.5749103304205193
Energy: 0.6910461577539037
Energy: 0.6190743866768263
Energy: 0.6895915713342647
Energy: 0.5753947783026213
Energy: 0.5747405639295033
Energy: 0.5753426337137416
Energy: 0.5751360529415146
Energy: 0.5753401936310519
Energy: 0.6197191854333444
Energy: 0.6901168742087064
Energy: 0.5750043710528734
Energy: 0.5748945635853382
Energy: 0.5747062878729762
Energy: 0.5751158541615827
Energy: 0.5771588781131161
Energy: 0.6395556179713149
Energy: 0.6914342677194438
Energy: 0.6183076764122456
Energy: 0.6900968116559313
Energy: 0.5748273894451661
Energy: 0.617111462307899
Energy: 0.6907788272120112
Energy: 0.6245065495173084
Energy: 0.7630189687498254
Energy: 0.5745499676153547
Energy: 0.5741570174887445
Energy: 0.5740854337034129
Energy: 0.574523353130658
Energy: 0.6359635236168526
Energy: 0.619439531425942
Energy: 0.69017507100488
Energy: 0.5746248785000165
Energy: 0.5756651249808167
Energy: 0.5753309201385994
Energy: 0.5748906466312446
Energy: 0.690423732180116
Energy: 0.6195849494874325
Energy: 0.6901012137122935
Energy: 0.5753550867062612
Energy: 0.5750557386025843
Energy: 0.5755242129580384
Energy: 0.5752206929799938
Energy: 0.6904725243518041
Energy: 0.6215613016310358
Energy: 0.7623846832397136
Energy: 0.5744080206539866
Energy: 0.5744148566878696
Energy: 0.5744735378212474
Energy: 0.5746850374303546
Energy: 0.6368899238415655
Energy: 0.6392910506689965
Energy: 0.6913501287462668
Energy: 0.6181900141786008
Energy: 0.6905333323845204
Energy: 0.7775434817566664
Energy: 0.6173326747000223
Energy: 0.6914475233043545
Energy: 0.620749962565871
Energy: 0.6919006664277438
Energy: 0.5749032246931821
Energy: 0.5743044262899352
Energy: 0.574831372782488
Energy: 0.5746288297558859
Energy: 0.6380142082441381
Energy: 0.619076614911132
Energy: 0.6902471131636148
Energy: 0.5752840527163992
Energy: 0.5753141213564577
Energy: 0.5749191707871005
Energy: 0.5755122351424299
Energy: 0.6903215407574034
Energy: 0.6200047735605523
Energy: 0.690048344509829
Energy: 0.5745933940708016
Energy: 0.5753865971027073
Energy: 0.5756247567819333
Energy: 0.574976245625251
Energy: 0.6908142050803688
Energy: 0.6226293529068863
Energy: 0.763740466011043
Energy: 0.5749604224297372
Energy: 0.5741927391059356
Energy: 0.5741959698378128
Energy: 0.5745740984537568
Energy: 0.6355022556692269
Energy: 0.6398184018355941
Energy: 0.6914857453004768
Energy: 0.6181187311773961
Energy: 0.5746314770704745
Energy: 0.5750573214651057
Energy: 0.5743570447445042
Energy: 0.6905050967815126
Energy: 0.6196364550853154
Energy: 0.6895140327917618
Energy: 0.575312892220894
Energy: 0.5748205695234606
Energy: 0.5750781258580864
Energy: 0.5749152580416984
Energy: 0.5753407203046123
Energy: 0.6193326704136203
Energy: 0.6897253186735967
Energy: 0.5751901576342309
Energy: 0.5750856796557471
Energy: 0.574843109108084
Energy: 0.5754395799015148
Energy: 0.5754697025460548
Energy: 0.640053312260471
Energy: 0.6911876440688037
Energy: 0.5739705707459427
Energy: 0.5752290889864194
Energy: 0.5752692372037177
Energy: 0.5745557159907213
Energy: 0.6905499910303149
Energy: 0.6342813936969822
Energy: 0.7628444177695786
Energy: 0.5762526322846555
Energy: 0.5737889922258586
Energy: 0.5750754484906458
Energy: 0.5763398287476297
Energy: 0.6353518927089239
Energy: 0.6197259976499904
Energy: 0.6906273908310202
Energy: 0.5746556298194234
Energy: 0.5757514716445522
Energy: 0.5754610483152522
Energy: 0.5749400829673005
Energy: 0.6908632036219464

minimum gb energy = 0.5737889922258586 eV
minimum distance =  2.69050370797574 Angstroms
sigma value = 23