Model name: model_name=EAM_Dynamo_ZhouZimmermanWong_2008_PdH__MO_114797992931_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.884858903288844
cohesive_energy=3.9107257844470262
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[9.87708249151686e-20, 1.6354698644545198e-19, 2.2192229210524197e-19, 2.7662701109653797e-19, 3.24194033183364e-19, 3.6551256639759e-19, 4.0101359625376197e-19, 4.31262691103682e-19, 4.56935969486898e-19, 4.786823129401799e-19, 4.97056074578892e-19, 5.12497852977384e-19, 5.305335553463219e-19, 5.482408115052899e-19, 5.641504254809099e-19, 5.78010855541644e-19, 5.899086192257279e-19, 5.999831059003199e-19, 6.08335252693362e-19, 6.15037157553384e-19, 6.201497031924779e-19, 6.237289657928339e-19, 6.258310215366419e-19, 6.265183553126279e-19, 6.25776547531086e-19, 6.233796912866219e-19, 6.190265773720439e-19, 6.120843460169219e-19, 6.03208287464562e-19, 5.918857051920839e-19, 5.76985462495884e-19, 5.57528629452588e-19, 5.32470586896828e-19, 5.00547217464378e-19, 4.60141924931532e-19, 4.0918469708716194e-19, 3.45075201254286e-19, 2.64597868928466e-19, 1.6383537823957198e-19, 4.0695446721263395e-20, -1.140432532434468e-19, -3.08391765042222e-19, -5.5368821206089e-19, -8.672437923944939e-19, -1.272810774642084e-18, -1.80598952361114e-18, -2.5183012333212e-18, -3.5006918582246395e-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: 0.014775068906980745
Energy: 4.330287568171828
Energy: 0.08791287384480236
Energy: 0.08764866249559425
Energy: 0.01737286987876598
Energy: 0.015911294717387336
Energy: 4.310516109959038
Energy: 0.08848216436852559
Energy: 0.08784962634101398
Energy: 0.016805071549474516
Energy: 4.296038270970542
Energy: 4.359608145706392
Energy: 0.087582727838514
Energy: 0.08834919674479752
Energy: 0.08818348616548335
Energy: 4.420141395663289
Energy: 4.381200097203021
Energy: 0.08768791163326382
Energy: 0.08806684142215332
Energy: 0.08811983880779213
Energy: 0.08868660129778909
Energy: 0.0173432547502344
Energy: 0.015147368267572217
Energy: 0.0868475041998074
Energy: 0.0877976532681904
Energy: 0.08850490986580314
Energy: 0.016739069516512516
Energy: 0.015218177903037429
Energy: 0.08677542018518859
Energy: 0.08837924378183795
Energy: 0.08790665274629265
Energy: 0.015848610365744368
Energy: 0.015756351351408106
Energy: 0.08643375193231471
Energy: 0.0872102464643311
Energy: 0.08755138496457746
Energy: 0.016004829096732492
Energy: 0.015381715125032076
Energy: 0.08639447811907615
Energy: 0.08668737532311405
Energy: 0.08766239818619745
Energy: 0.08816710929104571
Energy: 0.08847324008377433
Energy: 0.016033577491928463
Energy: 0.015669088908031956
Energy: 0.08735187052199067
Energy: 0.08847852402410093
Energy: 4.352402717268589
Energy: 0.0165733935778539
Energy: 4.305301325965788
Energy: 0.08918007238833732
Energy: 0.08772526088067403
Energy: 0.08743179498207006
Energy: 0.015867071768855497
Energy: 0.018153881374774448
Energy: 0.08652895795118523
Energy: 0.08677597363125633
Energy: 4.354715546644692
Energy: 0.016135441647360083
Energy: 0.01852807078943158
Energy: 0.01892137862368759
Energy: 0.0886417153637593
Energy: 0.08765226034990019
Energy: 0.08835461125943389
Energy: 4.355852158275327
Energy: 0.01867272564448981
Energy: 0.08899684941458444
Energy: 0.08733008644186052
Energy: 0.08776382894554718
Energy: 4.346488553845756

minimum gb energy = 0.014775068906980745 eV
minimum distance =  0.889829734894597 Angstroms
sigma value = 3


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

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Energy: 1.220960292620338
Energy: 0.6598025946582259
Energy: 0.6629737168011138
Energy: 0.6785588887320756
Energy: 0.6867131695787979
Energy: 1.0531041696681205
Energy: 0.6610796874937598
Energy: 0.6612229998574041
Energy: 0.6778305975029599
Energy: 0.7387177232558991
Energy: 0.7356400283925757
Energy: 0.6636994018111338
Energy: 0.695703641968948
Energy: 0.6463132323830232
Energy: 1.1210722577641088
Energy: 0.7157528449664456
Energy: 0.6607265337826091
Energy: 0.6911401006754294
Energy: 0.6826578882683888
Energy: 0.6513910922842204
Energy: 0.7433370447574023
Energy: 0.6041203753877916
Energy: 0.6185366904304734
Energy: 0.7831962362220686
Energy: 0.6167162050295046
Energy: 0.6023961395827206
Energy: 0.6047308589628471
Energy: 0.6175262019290381
Energy: 1.3959187249006508
Energy: 0.6176214071581465
Energy: 2.522549146396123
Energy: 0.6023847666844595
Energy: 0.6163054222814647
Energy: 1.2135929843520892
Energy: 0.6171605685439321
Energy: 2.638708811605366
Energy: 0.6047809988979818
Energy: 0.6440641126990089
Energy: 1.2543837272344749
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Energy: 0.6823899121319235
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Energy: 0.5778885338990514
Energy: 1.0801368235964979
Energy: 0.6812487779132641
Energy: 0.7103302582108038
Energy: 2.0761220607275073
Energy: 0.7103712509616883
Energy: 0.6875089847894746
Energy: 0.6804400264999927
Energy: 0.7083781914004209
Energy: 2.2125031490200575
Energy: 0.5712723570464548
Energy: 0.6769505098457537
Energy: 0.6773532140006251
Energy: 0.7118418616849504
Energy: 2.069617354098745
Energy: 0.7310716595324562
Energy: 0.7386826569594934
Energy: 0.6820280849757642
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Energy: 0.5767780733849737
Energy: 0.7161697794368058
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Energy: 0.7229154026413465
Energy: 0.7073997579673051
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Energy: 3.2390247713474563
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Energy: 0.7089391021260646
Energy: 0.7105690355379223
Energy: 0.6947747463704743
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Energy: 0.7066189758774006
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Energy: 0.6923961694634327
Energy: 0.6703132911310906
Energy: 0.7302246363865639
Energy: 0.7021043073355181
Energy: 1.2150878816701207
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Energy: 0.6711289304191371
Energy: 0.7012681284957113
Energy: 0.6977255679697792
Energy: 1.3926915133655489
Energy: 0.6709438524127673
Energy: 0.6719967224861841
Energy: 0.7042904464327481
Energy: 0.5771740268066036
Energy: 0.7726124989923546
Energy: 0.6706355537128164
Energy: 0.6994879391452428
Energy: 0.608825843861618
Energy: 0.5777864280152889
Energy: 0.7147586126742137
Energy: 0.6704111641241076
Energy: 0.7005928370609479
Energy: 0.5829112606269428
Energy: 0.6341630245740553
Energy: 0.6023419569939137
Energy: 0.5994942075349857
Energy: 0.6398318380588839
Energy: 1.0802694540802504
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Energy: 0.5999265370446089
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Energy: 0.6069465306920697
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Energy: 0.639245985652533
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Energy: 0.8362890509382037
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Energy: 0.5832885508680205
Energy: 0.6879908236100579
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Energy: 0.7280872602520426
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Energy: 0.6564661190677932
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Energy: 0.8781428690747464
Energy: 0.5756182598816839
Energy: 0.719555163615482
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Energy: 1.8898793148107509
Energy: 0.5783573865289652
Energy: 0.7051180720004077
Energy: 0.7098603188930391
Energy: 0.7066381430535201
Energy: 3.2875011642040506
Energy: 0.5341277634903225
Energy: 0.7028354098908141
Energy: 0.745106037820717
Energy: 0.7088364389680749
Energy: 0.5363264888519395
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Energy: 0.7072331099178218
Energy: 0.7434485604598214
Energy: 0.6353103563145397
Energy: 0.5375213780572565
Energy: 1.0688856365192734
Energy: 0.7054327376480759
Energy: 2.002961761179811
Energy: 0.5800269396037103
Energy: 0.5705667127183708
Energy: 0.6424251177703286
Energy: 0.6082310800078581
Energy: 0.6101151248007342
Energy: 0.5780568912970427
Energy: 0.5734210994582097
Energy: 0.6459245346492823
Energy: 0.6105843129918469
Energy: 2.4916548715735027
Energy: 0.5766268709776317
Energy: 0.7152713345429171
Energy: 0.6095359508077205
Energy: 0.6105054213772396
Energy: 0.6477678787962905
Energy: 0.5764191994665663
Energy: 0.7936803651594531
Energy: 0.6265362374641359
Energy: 0.6104189271689132
Energy: 0.7210230435028525
Energy: 0.5767371301621619
Energy: 0.5762317162622963
Energy: 0.8990927404939643
Energy: 0.6551970135007913
Energy: 0.660419091651075
Energy: 0.626210788685722
Energy: 0.6945636735048861
Energy: 1.2386516184128207
Energy: 0.6600794540536087
Energy: 0.6927064593324221
Energy: 0.6672103015816906
Energy: 0.6907726184775849
Energy: 0.6840632207990672
Energy: 0.6773405160945933
Energy: 0.6137191786127152
Energy: 2.561262174178256
Energy: 0.6929999403244101
Energy: 0.680335063311383
Energy: 0.6881233198041548
Energy: 0.6508220047727414
Energy: 0.6337557293439786
Energy: 0.6845515950130522
Energy: 1.1521796558645427
Energy: 1.2580371174406497
Energy: 0.6087385287999595
Energy: 0.632948555061909
Energy: 0.6895693566218621
Energy: 1.4540334570041014
Energy: 0.73726868127068
Energy: 0.6830988011927106
Energy: 0.665365298432462
Energy: 0.6617668541518626
Energy: 0.6586570924389994
Energy: 0.6790350240504038
Energy: 0.6849735199532666
Energy: 1.3800144062006905
Energy: 0.6608297083160405
Energy: 0.6614955082045587
Energy: 0.684683507173212

minimum gb energy = 0.5341277634903225 eV
minimum distance =  2.44846453986602 Angstroms
sigma value = 75


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

Energy: 1.359768964982961
Energy: 1.2324375241819843
Energy: 0.6497686531255323
Energy: 0.7179067570455241
Energy: 0.7268751849772621
Energy: 0.707501374120818
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Energy: 0.6518635546885696
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Energy: 0.6626343344481658
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Energy: 0.752455774591674
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Energy: 0.6611719527085206
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Energy: 0.9984162324992065
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Energy: 0.9060026551300709
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Energy: 0.6661983263804576
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Energy: 0.7510119836181158
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Energy: 1.0834403969878068
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Energy: 0.7403934203856853
Energy: 0.7574172139881422
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Energy: 0.8635410496243503
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Energy: 0.6456984220047921
Energy: 0.7705395195395591
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Energy: 0.7586512340724239
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Energy: 0.6569381560959813
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minimum gb energy = 0.5922445916230339 eV
minimum distance =  0.890782945045795 Angstroms
sigma value = 105


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

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Energy: 0.7233086610801492
Energy: 0.9111579475693902
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Energy: 0.6911333269790152
Energy: 0.7087579060875036
Energy: 1.2890475152023737
Energy: 0.6821121097889266
Energy: 0.6459294320692864
Energy: 0.693167986697999
Energy: 0.7204190517675714
Energy: 0.6852252046643651
Energy: 0.7222672349328924
Energy: 0.6899468819488505
Energy: 0.6907115359650627
Energy: 1.366615323738545
Energy: 0.6789418351566946
Energy: 0.6997260840781163
Energy: 0.6800219029340996
Energy: 0.8630076790809917
Energy: 1.2224634991732761
Energy: 1.5324652272733366
Energy: 0.6967952018635973
Energy: 0.6869018312608401
Energy: 0.698004223431733
Energy: 1.2166026725131929
Energy: 0.6951022768186459
Energy: 0.6630753511341807
Energy: 0.6806236280790111
Energy: 0.7888322719376198
Energy: 1.2552000159202203
Energy: 0.6962168255602702
Energy: 0.6661902636106273
Energy: 0.6946273119774637
Energy: 0.678464779286299
Energy: 0.6827915474335198
Energy: 0.6939219925273987
Energy: 0.6658241177754792
Energy: 0.6949402959816073
Energy: 0.7289293075968103
Energy: 0.6885520018399875
Energy: 1.283340996391434
Energy: 1.9303419326181313
Energy: 0.6795872287716067
Energy: 0.7084359942640662
Energy: 0.7245511601963064
Energy: 0.7019066997767195
Energy: 1.5704029759440143
Energy: 0.7182934303785803
Energy: 0.7092578075738745
Energy: 0.71689832085896
Energy: 0.6885574059019418
Energy: 0.7216641922433091
Energy: 0.6477735143712103
Energy: 0.6876684358640947
Energy: 0.682008085705476
Energy: 0.6595589810427611
Energy: 0.6942909834994281
Energy: 0.6560522562328203
Energy: 0.6444903372708431
Energy: 0.7238428199596618
Energy: 0.6789482370297942
Energy: 0.6539981852162565
Energy: 0.658928891449778
Energy: 0.6523935013225785
Energy: 1.6476124953266855
Energy: 0.6533707259649674
Energy: 0.6548916943762723
Energy: 0.6528969968076278
Energy: 0.6533785930435361
Energy: 0.678728706454182

minimum gb energy = 0.6291863371134353 eV
minimum distance =  2.42956894384348 Angstroms
sigma value = 165


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

Energy: 0.7404518159223495
Energy: 2.0041149381000376
Energy: 0.6152816766892506
Energy: 0.645036861300616
Energy: 0.6144809926296763
Energy: 0.6585001620722983
Energy: 1.9519807854132483
Energy: 0.6151008851597599
Energy: 0.6460293229457685
Energy: 0.6139976375034795
Energy: 2.0150770251175563
Energy: 0.6408967440644591
Energy: 0.6416241572398154
Energy: 0.6291898412629119
Energy: 0.664897633291802
Energy: 0.6356190478163436
Energy: 0.6390025435088502
Energy: 0.6428380422691344
Energy: 0.6304051232382997
Energy: 0.6682972503860392
Energy: 1.9112941489955948
Energy: 1.8514441291951977
Energy: 0.6333097727388393
Energy: 0.6561081552510386
Energy: 0.6733099250346921
Energy: 0.6340373894342789
Energy: 3.047681030044312
Energy: 3.03288621384587
Energy: 0.6566220870839115
Energy: 0.6713092006190429
Energy: 0.6699004542498217
Energy: 0.6404496715908163
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Energy: 0.6403377424953293
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Energy: 0.6486275983130707
Energy: 0.6740540055796409
Energy: 0.640615377109512
Energy: 0.6184983449701059
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Energy: 0.6075589134091404
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Energy: 1.9703208915147488
Energy: 0.6349591654784903
Energy: 0.6374961087999583
Energy: 0.6219419720399214
Energy: 3.197767544963079
Energy: 1.8840711363251266
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Energy: 0.6362593164666864
Energy: 1.962101163216127
Energy: 3.194094456203486
Energy: 1.8686777895193991
Energy: 0.6156091589552125
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Energy: 0.6399738723099744
Energy: 0.6591965331853813
Energy: 0.6406820353904922
Energy: 1.8463586187801537
Energy: 0.6385643249371972
Energy: 1.9425853388082306
Energy: 0.6576496545873369
Energy: 1.8507979025070938
Energy: 0.6483589342929194
Energy: 0.6406308620979935
Energy: 1.9091027480254965
Energy: 0.670955120027985
Energy: 0.6662067666045008
Energy: 3.033599483032079
Energy: 0.6406853960869817
Energy: 0.6541493239297593
Energy: 1.9168628485553452
Energy: 1.9067448309844603
Energy: 3.0555601174921265
Energy: 1.9022289409033146
Energy: 0.6688055633141663
Energy: 0.6492915292758786
Energy: 0.6414538230850642
Energy: 0.6408540583858491
Energy: 0.632559218181317
Energy: 0.6140486737244407
Energy: 0.6454187107336983
Energy: 0.6408705925907692
Energy: 0.6390170968471022
Energy: 0.6320107494026709
Energy: 0.6487482273911075
Energy: 0.6651842689225647
Energy: 0.6541688684848298
Energy: 0.6501687188035081
Energy: 0.6400163052381256
Energy: 0.6169548650364586
Energy: 0.673495013874
Energy: 0.6441751643945282
Energy: 0.6500167822733094
Energy: 0.6401086105051824
Energy: 0.6178943550277377
Energy: 1.937714996235918
Energy: 0.6411091742137502
Energy: 0.6178557620531576
Energy: 0.6118985009830842
Energy: 0.6369047408135144
Energy: 3.1942346160165944
Energy: 0.6420341611642106
Energy: 0.6220487650395906
Energy: 0.6115390491399026
Energy: 0.6351492700341471
Energy: 0.6395161741321852
Energy: 0.643027824716556
Energy: 0.6470778745073053
Energy: 0.6178894065737388
Energy: 0.6408841086259358
Energy: 0.6435696406933382
Energy: 0.6326282777151225
Energy: 0.6471455773020166
Energy: 0.6190350748676228
Energy: 1.881007611974524

minimum gb energy = 0.6075589134091404 eV
minimum distance =  0.944967154644458 Angstroms
sigma value = 41


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

Energy: 2.3921010598296575
Energy: 1.8599788275827072
Energy: 0.5759457600137292
Energy: 0.5875498882910206
Energy: 1.9498043880233968
Energy: 2.001139617797965
Energy: 0.5850258598269454
Energy: 0.5769379014654513
Energy: 0.5885964602334611
Energy: 0.5892498108525793
Energy: 1.7763273846045227
Energy: 0.5940632617540991
Energy: 0.5789966795421327
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Energy: 0.6075977226599809
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Energy: 1.7644114666639166
Energy: 0.5981448043337921
Energy: 1.8596528597958975
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Energy: 0.5748620808963716
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Energy: 0.5765077766627331
Energy: 0.5947117308932803
Energy: 0.9873855828286321
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Energy: 0.5804094907821685
Energy: 0.5826425591643785
Energy: 1.1319553620934502
Energy: 0.6701933549477905
Energy: 0.6042271866623294
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Energy: 0.5857243897751809
Energy: 0.5876914302994799
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Energy: 0.5956341848336486
Energy: 1.3176978904892374
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Energy: 1.0111042409059923
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Energy: 0.5799263324311494
Energy: 1.8997477812494468
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Energy: 0.6997575315347556
Energy: 1.4334128994107156
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Energy: 0.5717590776760647
Energy: 0.5882041313909478
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Energy: 0.6218823991552113
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Energy: 0.5879447204022825
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Energy: 0.6015681420511056
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Energy: 0.5938341639806386
Energy: 0.6082812743527491
Energy: 0.5734085753228494
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Energy: 0.5913285070273941
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Energy: 0.5892890306749021
Energy: 1.4336866503459142
Energy: 1.4307257238574946
Energy: 1.0866776644956742
Energy: 2.0447388431950646
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Energy: 0.5790397138883385
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Energy: 0.5771696136709035
Energy: 0.5903023101127591
Energy: 0.5969225218189961
Energy: 0.6039000920860195
Energy: 0.5893993469031182
Energy: 0.5872564958124886
Energy: 0.9481019943321621
Energy: 0.5950225645973463
Energy: 0.6215889002067171
Energy: 0.5859462750120242
Energy: 0.5882746559303026
Energy: 0.5843100712443423
Energy: 0.5809130138982631
Energy: 0.5942886349704765
Energy: 0.5887253195778472
Energy: 0.5962619082888048
Energy: 0.5816579030664607
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Energy: 0.5925726796172768
Energy: 0.5941311391682299
Energy: 0.8436742902489343
Energy: 0.594225019984213
Energy: 1.5933277781432944
Energy: 1.5696972920206202
Energy: 0.5952140425302772
Energy: 0.5903280014315795
Energy: 0.5893172393253107
Energy: 1.8660662191542123
Energy: 1.6856151963489883
Energy: 0.5901641815988855
Energy: 0.5858567220299923
Energy: 0.5928304660776568
Energy: 0.6444723220770959
Energy: 0.5802880577344547
Energy: 0.5761624398127331
Energy: 0.5841881102780162
Energy: 0.7237037521331618
Energy: 0.637284792784185
Energy: 0.5712274728303085
Energy: 0.5784379643292965
Energy: 0.5978929579705976
Energy: 0.5893957203266947
Energy: 0.6233948125890328
Energy: 0.5802824028698814
Energy: 0.5708970106038376
Energy: 0.5789822257987415
Energy: 1.7017404346459688
Energy: 0.5877191836363208
Energy: 0.5787162139241204
Energy: 0.5826340652064176
Energy: 0.5815583101084947
Energy: 0.597816032463466
Energy: 0.599774662101212
Energy: 0.5829031974742537
Energy: 0.5759036597589376
Energy: 0.5842148460917337
Energy: 0.5816512140060576
Energy: 1.5081546154260068
Energy: 0.5826964454408383
Energy: 0.5821816508557859
Energy: 0.5904826478478293
Energy: 0.5814055831251664
Energy: 1.1273754950197323
Energy: 0.5856349002822564
Energy: 0.5873704087084979
Energy: 0.8513163709496526
Energy: 0.6427977446643006
Energy: 0.5749142411671828
Energy: 0.5756463984626915
Energy: 0.579756940435996
Energy: 1.6901633169293926

minimum gb energy = 0.5635277736395873 eV
minimum distance =  0.912819200555 Angstroms
sigma value = 185


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

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Energy: 1.0899368709996782
Energy: 0.3164198670864338
Energy: 0.3164168787158226
Energy: 0.23415626056186936
Energy: 0.23604785941369463
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Energy: 0.30393545038735986
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Energy: 0.8889309564062269
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Energy: 0.479271914461256
Energy: 0.4236939811944868
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Energy: 0.2958814142977098
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Energy: 0.3182122779710142
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Energy: 0.37808744014009693
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Energy: 0.3511262160372522
Energy: 1.2816467759843888
Energy: 0.3019562651484535
Energy: 0.3097676198869086
Energy: 0.3175220445934913
Energy: 0.39436332134872193
Energy: 0.9083944799029495
Energy: 0.32255331470481163
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Energy: 1.3019165428231245
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Energy: 0.3215233470410393
Energy: 0.39918809075623063
Energy: 0.4078738840586639
Energy: 0.30376550533770313
Energy: 0.3522123956383706
Energy: 0.32766394300654134
Energy: 0.3576941522895237
Energy: 0.36852098500984604
Energy: 0.29342661360754785
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Energy: 0.30928340637548446
Energy: 0.41791241389653655
Energy: 0.4291826878543921
Energy: 0.29318020873682304
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Energy: 0.3212927243522489
Energy: 0.9102398983204649
Energy: 1.2597205957694755
Energy: 0.3224238785561084
Energy: 0.3219307535868071
Energy: 0.3200136557009699
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Energy: 0.41866635314468215
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Energy: 0.32640646724367567
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Energy: 0.31621808812527535
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Energy: 0.2951511727295747
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Energy: 0.31571090912706834
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Energy: 1.0803379317615662
Energy: 0.9080449735239433
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Energy: 0.30331613415340897
Energy: 0.4246222691201999
Energy: 0.40424584997967583
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Energy: 0.3098764939687044
Energy: 0.36599269125092765
Energy: 0.3651769635412562
Energy: 0.31541757255475494
Energy: 0.4381498701409968
Energy: 0.31030862182884356
Energy: 0.6345577666134007
Energy: 0.4053085333492348
Energy: 0.3044820999538584
Energy: 0.31474461996216707
Energy: 0.3075931274241105
Energy: 1.0371241722468933
Energy: 0.7246287694537421
Energy: 0.3042224448205615
Energy: 0.31538819468663515
Energy: 0.7361980572779002
Energy: 0.4081907759493307
Energy: 0.3210929142226017
Energy: 0.3053235067741222
Energy: 0.3082676768914987
Energy: 0.5559647144127394
Energy: 0.33916066344477924
Energy: 0.3216784147837624
Energy: 0.31355923784532985
Energy: 0.3077544060372267
Energy: 0.4354219593328291
Energy: 0.42206818273693114
Energy: 1.292088691587637
Energy: 0.3201226495746137
Energy: 0.3319396863907507
Energy: 0.33346880434894416
Energy: 0.34222617851738685
Energy: 0.30720546222971395
Energy: 0.33230908417452965
Energy: 0.32831729472182525
Energy: 0.3175944757254935
Energy: 0.5663982321364156
Energy: 0.3071918079504657
Energy: 0.322638429186817
Energy: 0.3076811141724818
Energy: 0.29223559720722136
Energy: 0.45328761259883127
Energy: 0.3101934740059473
Energy: 0.31068500567800955
Energy: 0.2923329071319339
Energy: 0.5296618062841236
Energy: 1.0674909504098729
Energy: 0.30868037466468407
Energy: 0.29513901759057976
Energy: 0.4777756777781968
Energy: 0.23550314117620097
Energy: 0.5714372443428013
Energy: 0.30870104044612645
Energy: 0.3093131325962229
Energy: 0.5417003656573358

minimum gb energy = 0.23415626056186936 eV
minimum distance =  2.49184086805776 Angstroms
sigma value = 33


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

Energy: 0.6280077025412031
Energy: 0.8374268632132431
Energy: 0.5365833636899664
Energy: 0.5416457594101686
Energy: 0.5116522608897308
Energy: 0.5099418891624906
Energy: 0.8425876381723494
Energy: 0.539041513525484
Energy: 0.5355248465999672
Energy: 0.7647462760719071
Energy: 1.7514029907511337
Energy: 0.5340372378332047
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Energy: 0.5195837996866958
Energy: 1.1372713405373827
Energy: 0.5352216664999055
Energy: 0.5411150922169459
Energy: 0.5266463258191868
Energy: 0.5398700166014975
Energy: 1.1754106467689878
Energy: 0.5305547120045897
Energy: 0.530907221641878
Energy: 0.5411030371210342
Energy: 0.6898906322629591
Energy: 1.0147845654763437
Energy: 0.5306840873371056
Energy: 0.5287901522408407
Energy: 0.5433597607698752
Energy: 1.0076858073401012
Energy: 1.5994987078741314
Energy: 0.5419154749496188
Energy: 0.5241202249422172
Energy: 1.1712663240961256
Energy: 0.6268155357862987
Energy: 0.5723044809090109
Energy: 0.5375014626263325
Energy: 0.5366686890312756
Energy: 1.5182572999532253
Energy: 0.5303790593813246
Energy: 0.5332660866357724
Energy: 0.5290596752615427
Energy: 0.5472113322253018
Energy: 0.5226578949074363
Energy: 0.5096458606427056
Energy: 0.5364713571075568
Energy: 0.5460794360462786
Energy: 0.5378573225837157
Energy: 0.5241052139572216
Energy: 0.5235603559992822
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Energy: 0.5392445752252562
Energy: 0.5670045323293778
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Energy: 0.5384058465509611
Energy: 0.5225020540032892
Energy: 1.1991713910402142
Energy: 0.5188135459566293
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Energy: 0.5305938562824541
Energy: 0.5315440493986602
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Energy: 1.0604288749580812
Energy: 0.5447277192411131
Energy: 0.5304244615139293
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Energy: 0.5217553245276547
Energy: 1.0231750835774096
Energy: 0.530544758789975
Energy: 0.5397396326022259
Energy: 0.5203059721048757
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Energy: 0.5226238349274884
Energy: 0.5287006182651711
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Energy: 0.5318751592942726
Energy: 0.5224977339319754
Energy: 0.5227014051187022
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Energy: 0.51290350703899
Energy: 0.5149356761894931
Energy: 0.5320033851592731
Energy: 0.5314589120557631
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Energy: 0.5122878223757067
Energy: 0.9790782966386843
Energy: 0.5329364656289308
Energy: 0.5547843324338967
Energy: 0.5239075029016097
Energy: 0.5311074842480069
Energy: 0.5226176629458169
Energy: 0.5353983772367197
Energy: 1.235736113532479
Energy: 0.5285221166475446
Energy: 0.5597244379231399
Energy: 0.5240758208485309
Energy: 0.5259202527564768
Energy: 0.5226756976644943
Energy: 0.5366112238766025
Energy: 0.9370893718141327
Energy: 0.5225479897626534
Energy: 0.5202746397543768
Energy: 0.5225512588720903
Energy: 0.5381572179662494
Energy: 0.534954252655712
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Energy: 0.5234822511253918
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Energy: 0.5268502429558553
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Energy: 0.530518315769896
Energy: 0.531099762835638
Energy: 1.158924409122968
Energy: 0.5421630003243625
Energy: 0.6238375957793731
Energy: 0.9446174960696877
Energy: 0.5165577059849994
Energy: 1.1591427723268706
Energy: 0.5336867334459254
Energy: 1.165236146565813
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Energy: 0.5464463152464224
Energy: 0.5252827038517541
Energy: 0.5293474166237608
Energy: 1.3729183608206883
Energy: 0.7769333915906713
Energy: 0.5319843193964866
Energy: 0.5283620086552389
Energy: 0.5305865320436626
Energy: 0.5231148132600719
Energy: 0.5250175360692546
Energy: 0.5491833378573899
Energy: 0.5499905273985944
Energy: 0.5180967234793488
Energy: 0.5120776901720723
Energy: 0.5098893030516828
Energy: 0.5593856346025141
Energy: 0.5364899564201577
Energy: 0.5230281413726627
Energy: 1.4407331500922784
Energy: 1.4761694254328852
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Energy: 0.5191112238677759
Energy: 0.508793272668455
Energy: 0.6974596236623665
Energy: 1.0024099049833688
Energy: 0.5371904798110047
Energy: 0.5352199682806569
Energy: 0.5217578263616391

minimum gb energy = 0.508793272668455 eV
minimum distance =  2.44208373156038 Angstroms
sigma value = 219


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

Energy: 0.6549512246021337
Energy: 1.702007583958849
Energy: 0.6640610245677658
Energy: 0.6580816688976463
Energy: 0.6285049009249007
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Energy: 0.6418058146182916
Energy: 2.7201329762333777
Energy: 0.6566450545837156
Energy: 0.6485517687313422
Energy: 0.6587104743846012
Energy: 0.6433340363670296
Energy: 1.6654140119783092
Energy: 0.65673086241331
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Energy: 0.6503679921035775
Energy: 0.6438896110240404
Energy: 0.6934719242553372
Energy: 0.6785387247206374
Energy: 1.6670657577204229
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Energy: 0.6569490095048884
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Energy: 0.6781696813059781
Energy: 1.6422076107425208
Energy: 1.7114612858662186
Energy: 0.7349744131841315
Energy: 0.6445262230856889
Energy: 1.6291014889111304
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Energy: 0.6446624157580482
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Energy: 0.6445932797704912
Energy: 0.6573374823713222
Energy: 0.6396273111853078
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Energy: 0.6460436230487359
Energy: 0.723902647852379
Energy: 0.6894345438095705
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Energy: 0.6468305801582862
Energy: 0.7220591634180822
Energy: 0.6770562854192035
Energy: 0.6427800641564676
Energy: 0.7587017022109028
Energy: 0.6529386218553352
Energy: 0.6415526160536763
Energy: 2.701028439286151
Energy: 0.6501207194898792
Energy: 0.7540502160827174
Energy: 0.658545207611142
Energy: 0.6417654328759146
Energy: 0.6735753042765339
Energy: 0.6514194377429832
Energy: 1.646388240312529
Energy: 0.655062389139236
Energy: 0.6786101580466506
Energy: 0.6510108011862136
Energy: 0.6468259935607867
Energy: 1.6460918406303586
Energy: 0.6588420344169749
Energy: 0.6780339301794961
Energy: 0.6486778885782626
Energy: 0.6482043210847065
Energy: 0.6285077065165006
Energy: 0.6422953107735981
Energy: 0.6551660171572965
Energy: 0.6579584327772687
Energy: 0.6486798675342265
Energy: 0.6506306145921965
Energy: 0.6422414918969047
Energy: 0.6542212810173956
Energy: 0.662013831344665
Energy: 0.6460954459733361

minimum gb energy = 0.6285049009249007 eV
minimum distance =  2.49553332490898 Angstroms
sigma value = 15


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

Energy: 0.7321645796403401
Energy: 2.057264527863568
Energy: 0.7589434509322436
Energy: 0.7537825012517791
Energy: 0.7702698602517967
Energy: 0.7260908745911211
Energy: 0.7452658985000102
Energy: 0.7573964278041508
Energy: 0.7636324516402561
Energy: 0.7652724074224646
Energy: 1.8256082583133653
Energy: 0.7474554944264362
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Energy: 1.1042486980411923
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Energy: 1.7340590945323304
Energy: 0.7467135096412131
Energy: 0.7559020520522742
Energy: 0.7518454362113998
Energy: 0.7509178048686503
Energy: 0.7794950822147306
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Energy: 0.7474193468266594
Energy: 0.749068389195672
Energy: 0.7496190025293991
Energy: 0.7689556873546746
Energy: 0.7474347264062569
Energy: 0.7519481397096962
Energy: 0.7732542516762223
Energy: 0.7516058370400285
Energy: 1.490067314030035
Energy: 0.7605884018884342
Energy: 1.550593453092886
Energy: 0.7609101530638537
Energy: 1.9543209683303575
Energy: 0.7510688826916065
Energy: 0.7573050115629147
Energy: 0.7382544190777375
Energy: 0.7620480525055392
Energy: 1.9532359679233418
Energy: 0.7649606122504171
Energy: 1.8005204247849143
Energy: 0.7432839634274633
Energy: 0.7601259107069563
Energy: 0.7496043438935184
Energy: 0.76641838839534
Energy: 1.6485208874730832
Energy: 1.5602527270239113
Energy: 0.7604753905981976
Energy: 0.7505009419772442
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minimum gb energy = 0.7255091434360179 eV
minimum distance =  0.942036534198151 Angstroms
sigma value = 293


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

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Energy: 1.5997932211331127
Energy: 1.7248835695607514
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Energy: 0.7599106491773246
Energy: 0.7069367692708873
Energy: 1.6551805593910447
Energy: 0.7671265536738264
Energy: 0.732332283492355
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Energy: 0.7161417018487033
Energy: 1.8325951608042341
Energy: 0.7674113393569653
Energy: 0.7326424461737416
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Energy: 1.6868547290407643
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Energy: 0.7553809542283763
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Energy: 0.716004882029023
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Energy: 2.524565554578101
Energy: 0.7493342731495096
Energy: 1.6478849961485817
Energy: 2.5834850101446936
Energy: 1.6662586670774602
Energy: 2.5271885974519037
Energy: 1.7145169051028808
Energy: 0.7261779532397722
Energy: 0.729994398127622
Energy: 0.7465409866860927
Energy: 0.7139210921873412
Energy: 0.7661220978007568
Energy: 0.7272978992418621
Energy: 0.7315865226299997
Energy: 0.7485134793320759
Energy: 0.7186235707562342
Energy: 0.7328523587712363
Energy: 0.7402600487470367
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Energy: 1.6955200402576474
Energy: 0.729335723500695
Energy: 0.732876234752708
Energy: 0.7410106270535476
Energy: 0.7272886790288392
Energy: 1.6951126347910879
Energy: 0.7455387648077042
Energy: 0.7358898885191199
Energy: 0.74927089920875
Energy: 0.7384521728816955
Energy: 2.6219585049668472
Energy: 0.7288231526559146
Energy: 0.7319986987645696
Energy: 0.7487517484592736
Energy: 0.7388335577303106
Energy: 2.5399282563405565
Energy: 0.7288397932466284
Energy: 1.6553195067025248
Energy: 0.7724413218311182
Energy: 0.7705045389415297
Energy: 2.6362805175780992
Energy: 0.7599538881841803
Energy: 0.7423982086586731
Energy: 0.7730005118516539
Energy: 0.7701374527362365
Energy: 2.626437427707722
Energy: 0.7598948630431794
Energy: 0.7404167579820432
Energy: 0.7658211669217493
Energy: 0.7879014559921764
Energy: 0.7329526819346918
Energy: 0.7602844464474454
Energy: 0.7380926794493877
Energy: 0.7450051934166263
Energy: 0.7870979949989476
Energy: 0.7387266700748568
Energy: 0.7598315946058859
Energy: 0.7116838904638113
Energy: 1.72308534449541
Energy: 1.5956889559090468
Energy: 0.7431997219157523
Energy: 0.7603596079390906
Energy: 0.7564169212461672
Energy: 0.7625092849364319
Energy: 1.5907929197042734
Energy: 0.742794671353787
Energy: 0.7459463707152645

minimum gb energy = 0.7051021618776648 eV
minimum distance =  2.42265113393217 Angstroms
sigma value = 293


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

Energy: 0.7606678937922703
Energy: 3.184988450247816
Energy: 0.7702299338362957
Energy: 0.7282758673206021
Energy: 0.7162430939649881
Energy: 0.718868793117183
Energy: 3.2033897884492033
Energy: 0.7716297870750495
Energy: 0.7278081460380603
Energy: 0.7149239674035931
Energy: 2.6053689331385854
Energy: 0.7240153211519305
Energy: 3.1867050663532597
Energy: 3.1902664893471493
Energy: 0.7233684989718304
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Energy: 0.7246612327052008
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Energy: 3.1928452820742783
Energy: 0.7250933943975637
Energy: 0.7260819758186268
Energy: 0.7258938768208261
Energy: 0.7280701338311673
Energy: 0.7281168842803388
Energy: 5.625256933033407
Energy: 0.7267766538335122
Energy: 0.7252404644198104
Energy: 0.7262544303123302
Energy: 0.7897912908760657
Energy: 5.629128828754177
Energy: 0.7703841238064526
Energy: 0.7192186086507154
Energy: 0.7152707470780564
Energy: 0.7259955835423613
Energy: 5.629324713759884
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Energy: 0.7292961110602071
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Energy: 0.7163562218354615
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Energy: 0.7254678142244965
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Energy: 0.7309989119422156
Energy: 3.265979675298978
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Energy: 0.7243826684913064
Energy: 0.7255884224899943
Energy: 0.7261204306358661
Energy: 0.7256801085830805
Energy: 0.774601571727105
Energy: 0.7311061389867113
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Energy: 0.7758843292302089
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Energy: 0.7684454167788284
Energy: 0.7152626023349525
Energy: 0.7259842261100053
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Energy: 0.7242607537053343
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Energy: 3.230845382499142
Energy: 3.224546983127987
Energy: 3.175669077213482
Energy: 0.7235977461721165
Energy: 0.7178779199087606
Energy: 3.2263766014878703
Energy: 0.7256792582798726
Energy: 0.7270319118902043
Energy: 0.7764519450473876
Energy: 0.7270901956155911
Energy: 0.7275434073217286
Energy: 0.7455657034877232
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Energy: 0.7248447396553455
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Energy: 0.801996781946626
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Energy: 0.7765225178761659
Energy: 0.7274916911600515
Energy: 0.7177688195846129
Energy: 0.7201996916828445
Energy: 3.1884040986613384
Energy: 0.7910405036532956
Energy: 0.7260511516268635
Energy: 0.7150507176372771
Energy: 0.7743942308760987
Energy: 0.7254581989295229
Energy: 3.176035105017591
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Energy: 0.7251216217378234
Energy: 3.1832350815872608
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Energy: 0.7260209969604903
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Energy: 0.7907843266689416
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Energy: 0.7256727722331754
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Energy: 0.7265445964407466
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Energy: 0.7718377348750859
Energy: 0.719538242655037
Energy: 0.71662407470738
Energy: 0.7266428295554043
Energy: 5.632332252500567
Energy: 0.7700545261668456
Energy: 0.7182022727233636
Energy: 0.7147262333773575
Energy: 0.7270744151333901
Energy: 5.729787265343208
Energy: 0.7251877335397736
Energy: 0.7153617877981512
Energy: 0.7189641556195935
Energy: 0.8333821859553638
Energy: 3.255026607315538
Energy: 0.7251537946780859
Energy: 0.718263774361119
Energy: 0.7189618554285275
Energy: 0.7274134813087783
Energy: 3.1752953387307348
Energy: 0.7258580823307679
Energy: 0.7705478044576335
Energy: 0.7270512601830684
Energy: 0.7243181953531769
Energy: 0.7172995056022958
Energy: 0.7272319037531453
Energy: 0.769539130660194
Energy: 0.726248666921183
Energy: 0.7255691584934528
Energy: 0.7167508074868242
Energy: 0.7265370002857319
Energy: 0.7206060612425854
Energy: 0.724882665603312
Energy: 0.7253511688799609
Energy: 0.8327409475074057
Energy: 3.198990777456707
Energy: 0.7198993877170341
Energy: 0.7247486322868334
Energy: 0.7246600218927721
Energy: 0.7289440596420208
Energy: 0.725361963382031
Energy: 0.7748282222982251
Energy: 0.7314480507757408
Energy: 0.7192399940160971
Energy: 0.7149965243946199
Energy: 0.726243359386107
Energy: 0.775200899809301
Energy: 3.201832882517774
Energy: 0.7196589337213769
Energy: 0.7153596503380272
Energy: 0.7263161411254427
Energy: 0.7151311557389534
Energy: 0.7240486313149758
Energy: 0.7171158075997016
Energy: 3.2432498573989488
Energy: 3.177321287276161
Energy: 3.195429137554041
Energy: 0.7235943604745205
Energy: 0.7180976758372933
Energy: 3.2297582353341996
Energy: 0.7257313961946518
Energy: 3.2141645030139676
Energy: 0.7757333336044905
Energy: 0.7744738285583175
Energy: 0.7269429071055714
Energy: 0.7273386229429242
Energy: 3.2834622214165132
Energy: 0.79646964407219
Energy: 0.72840293656219
Energy: 0.7259774711696674
Energy: 0.719701314183648
Energy: 0.7250590573278549
Energy: 5.6611605623550725
Energy: 5.6304372086038175
Energy: 0.7733031019579931
Energy: 0.7185015832205898
Energy: 0.7247107893323609
Energy: 0.7182358795316618
Energy: 3.249889366035554
Energy: 3.215537890061311

minimum gb energy = 0.7144630065302323 eV
minimum distance =  0.933510526684223 Angstroms
sigma value = 15


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

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Energy: 1.4065929411012792
Energy: 0.777360013148417
Energy: 0.7182613969027126
Energy: 2.0442210286210347
Energy: 0.7229591254150104
Energy: 0.7623179110170665
Energy: 0.763899631319882
Energy: 0.7390423425741682
Energy: 0.7615691050036605
Energy: 0.7087913582407834
Energy: 0.7569019590303534
Energy: 0.7451307396534788
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Energy: 0.7892342138209495
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Energy: 0.7364729558354991
Energy: 0.8105533813774326
Energy: 0.7532152832152317
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Energy: 0.7649643712558426
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Energy: 0.7570210799382922
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Energy: 2.21522844355032
Energy: 0.7280997368496923
Energy: 0.7062901870630015
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Energy: 0.7043745972127579
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Energy: 0.728813054848882
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Energy: 1.1227718195297614
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Energy: 0.7733651454243319
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Energy: 0.7584776553683665
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Energy: 0.7688702123693836
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Energy: 0.7636693426610548
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Energy: 0.7850372736829652
Energy: 0.7179859528094358
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Energy: 0.7643438695056238
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Energy: 0.7537122425309092
Energy: 0.7062513664642023
Energy: 0.7300406051386052
Energy: 0.7639892540085254
Energy: 0.7713014998470665
Energy: 0.7216654274515198
Energy: 0.9009828795973032
Energy: 0.7292077064404295
Energy: 0.7170919785725304
Energy: 0.7507905409739226
Energy: 0.7231493926035472
Energy: 1.2362523077671428
Energy: 0.7242095546737409
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Energy: 0.7550734834345565
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Energy: 0.7715078745787862
Energy: 0.7219053974731703
Energy: 0.7041392898652691
Energy: 1.1263699787038335
Energy: 0.7680628436405549
Energy: 0.7031440218460822
Energy: 0.7232163669462726
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Energy: 0.702163863115894
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Energy: 2.405350724490245
Energy: 1.4747834673657174
Energy: 0.717356561573241
Energy: 0.7516304871074686
Energy: 0.7768598185200976
Energy: 0.7575278213474029
Energy: 0.7265200233582448
Energy: 0.940746644347903
Energy: 1.0978806851004745
Energy: 0.7671317163161235
Energy: 0.8184639612754581
Energy: 0.8011377477401358
Energy: 0.762519642389613
Energy: 1.3137701288671895
Energy: 0.7681235611113029
Energy: 0.8146979091006759
Energy: 0.7539755933788163
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Energy: 0.8102012321048904
Energy: 0.8140260856407522
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Energy: 0.8130404772071008
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Energy: 0.8415726902220655
Energy: 0.8141091621999326
Energy: 0.7258877406662572
Energy: 0.8067619528869694
Energy: 0.7293840211535932
Energy: 0.7077035388530883
Energy: 0.8334604607182572
Energy: 0.7505061862898494
Energy: 1.933997397975476
Energy: 0.7938986393278511
Energy: 0.7090656225879084
Energy: 0.831709052232692
Energy: 0.7531467230501935
Energy: 2.1644775931001172
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Energy: 0.8293678469054798
Energy: 0.8357417001164137
Energy: 0.8355334734592509
Energy: 0.8050646694889472
Energy: 1.5260252727969108
Energy: 0.8285724211040723
Energy: 0.8372248901885974
Energy: 0.8345773553047301
Energy: 0.7789470980683301
Energy: 0.9229016859075997
Energy: 0.7196744272920993
Energy: 0.7179884233166571
Energy: 0.7276585108032627
Energy: 0.7189047661757055
Energy: 0.7183351552549226
Energy: 0.7213407863152396
Energy: 0.7234341932701539
Energy: 0.7179323931973453
Energy: 0.720771489427082
Energy: 0.7179216067409553
Energy: 1.8545642141547332
Energy: 0.7653025846320037
Energy: 0.7884096530895881
Energy: 0.7185573523753236
Energy: 0.7153530774389248
Energy: 1.4947065172030995
Energy: 0.7890151108997321
Energy: 0.7470278132907254
Energy: 0.7185751125415799
Energy: 0.7154985190445393
Energy: 2.1382993757316267
Energy: 0.7176661389541039
Energy: 0.7026521221769075
Energy: 0.7661412726254748
Energy: 0.7424407630333436
Energy: 1.4973640210172012
Energy: 0.7125308138604272
Energy: 0.7229458581687229
Energy: 1.9377790716454377
Energy: 1.3575993947135838
Energy: 0.718008269117932
Energy: 0.7193905275773319
Energy: 0.758820090175331
Energy: 0.8627452221903349
Energy: 0.718743120282952
Energy: 0.7007496600592046
Energy: 0.7030865619567124
Energy: 0.7669464181629484
Energy: 0.8655688931741155
Energy: 0.720281443792681
Energy: 0.7197085366153946
Energy: 0.8966648490401908
Energy: 0.7217758787156945
Energy: 0.717181648786451
Energy: 0.7044333885038558
Energy: 0.7215277396983671
Energy: 1.0931825773931594
Energy: 0.7325452769409486
Energy: 0.7612563452170311
Energy: 0.7209579806511729
Energy: 0.719513442941883
Energy: 0.7051245396588489
Energy: 0.822322472675782
Energy: 0.8181339003379369
Energy: 0.7964513650918812
Energy: 0.703112604827771
Energy: 0.7059803085430157
Energy: 0.82177683250974
Energy: 2.1047351838837702
Energy: 0.771639283891682
Energy: 0.724169492463099
Energy: 1.3969791164123508
Energy: 0.8043793522693832
Energy: 0.7273171953832704
Energy: 1.4727889857252956
Energy: 0.7275608228991108
Energy: 0.9917551796412465
Energy: 0.7666612196721125
Energy: 0.7126913372380315
Energy: 1.667688525577414

minimum gb energy = 0.6951078903371266 eV
minimum distance =  0.927400313581152 Angstroms
sigma value = 437


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

Energy: 0.6924226423891238
Energy: 2.8528153414128705
Energy: 0.7577672900455866
Energy: 0.7376005052494671
Energy: 2.1244742402147105
Energy: 0.689181793182464
Energy: 1.3671223085364337
Energy: 0.7582990350076649
Energy: 0.7964503710614708
Energy: 0.7734063780067065
Energy: 0.7154704274812316
Energy: 0.7330066555515109
Energy: 0.793183593480714
Energy: 0.7813158069691912
Energy: 0.7415636055983323
Energy: 0.7208456633606979
Energy: 0.7321217181383908
Energy: 0.7004418714734656
Energy: 1.493610871757032
Energy: 0.685838301699377
Energy: 0.720958687994375
Energy: 0.7329226049643026
Energy: 0.7363941453148414
Energy: 0.685150822247054
Energy: 0.7316877867850564
Energy: 0.7205499081579222
Energy: 0.7344011146197026
Energy: 0.736337980839499
Energy: 0.6839711673393829
Energy: 0.7297490721399216
Energy: 0.684819477631803
Energy: 2.0449253492352386
Energy: 0.7319310661060784
Energy: 0.7155488577940073
Energy: 0.733018370887634
Energy: 0.6844647469687017
Energy: 0.6843234335248778
Energy: 0.7267894389220585
Energy: 0.7194171755313953
Energy: 0.6659370045872586
Energy: 1.426333504217057
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Energy: 0.680527934387765
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Energy: 0.689539968452
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Energy: 0.679827660882387
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Energy: 0.6787018384268421
Energy: 0.7259943411762917
Energy: 0.7150254038507982
Energy: 1.3425102166373268
Energy: 0.6870170782746037
Energy: 0.7402777138752327
Energy: 0.7239965249639522
Energy: 1.3190955546572432
Energy: 1.3359966139277695
Energy: 0.7497176596275473
Energy: 0.7228416253104584
Energy: 0.7351469430261636
Energy: 0.7284035059367496
Energy: 0.6854036616106548
Energy: 2.053351644767367
Energy: 0.7273740297376297
Energy: 0.7340082498176708
Energy: 0.7248577296310954
Energy: 0.6872646722567367
Energy: 2.0523085231649283
Energy: 0.7270425175200537
Energy: 0.6821025326817898
Energy: 0.7412002588502709
Energy: 0.725607296851581
Energy: 0.6723074820207702
Energy: 0.6837061777306925
Energy: 0.6821356115769113
Energy: 0.739150263909782
Energy: 0.7272785675638338
Energy: 0.6723418263272999
Energy: 0.6829157312968792
Energy: 2.225269529263269
Energy: 0.7534299653517342
Energy: 0.6585438703057755
Energy: 0.6568273656495666
Energy: 1.3807981286862252
Energy: 0.7676482170419754
Energy: 0.689856757805273
Energy: 0.6599734694930411
Energy: 0.7560807404805711
Energy: 0.7290301169083083
Energy: 0.6627613287847575
Energy: 0.661872765286039
Energy: 0.7251410164155913
Energy: 2.11403818819859
Energy: 0.6606399175094858
Energy: 0.6625460535088821
Energy: 0.6593931863128687
Energy: 0.7242532431894728
Energy: 2.1382827984915265
Energy: 1.3394419887809894
Energy: 0.6621651815689303
Energy: 0.6591999787577226
Energy: 0.6634158598668645
Energy: 0.718000005029765
Energy: 0.6631144744342412
Energy: 0.6599480027358214
Energy: 0.6577316216721355
Energy: 0.6608182198933646
Energy: 0.7168605755647317
Energy: 0.6612669764261837
Energy: 0.6642781717685666
Energy: 0.6631719707274678
Energy: 0.7317371927785753
Energy: 0.7297926744528557
Energy: 0.7288750728472958
Energy: 0.6630362889998542
Energy: 0.6621193241218775
Energy: 0.7342402006305875
Energy: 0.7260335207352644
Energy: 0.7231056498309704
Energy: 2.078931870731611
Energy: 1.524588404947144
Energy: 0.748659253760103
Energy: 0.6641499703805015
Energy: 1.3817744987747522
Energy: 2.070641449999152
Energy: 0.680687080438501
Energy: 0.7540483800133244
Energy: 0.6638853718676919
Energy: 0.7035672113026877

minimum gb energy = 0.6568273656495666 eV
minimum distance =  2.50219324915519 Angstroms
sigma value = 33