Model name: model_name=EAM_Dynamo_WilsonMendelev_2015_NiZr__MO_306032198193_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518121123313904
cohesive_energy=4.385853675361089
mass=58.6934
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=[2.5086881735172e-19, 3.3309732873850196e-19, 3.959667398566619e-19, 4.4820090247833e-19, 4.8908043929484e-19, 5.20600060215522e-19, 5.45991355511154e-19, 5.67596707420644e-19, 5.8677315955299e-19, 6.040045692516599e-19, 6.19380658408158e-19, 6.330199880933999e-19, 6.451340456230739e-19, 6.5584940295126595e-19, 6.65294234208696e-19, 6.737425115997779e-19, 6.81434561619612e-19, 6.88258231903818e-19, 6.9372485857902595e-19, 6.973217451223559e-19, 6.994686618119159e-19, 7.010580210328439e-19, 7.022163947392259e-19, 7.02636165017334e-19, 7.02184351206546e-19, 7.00753607472384e-19, 6.982285770971999e-19, 6.944923011867119e-19, 6.89439036083076e-19, 6.82958231598546e-19, 6.748816591865519e-19, 6.64938550995948e-19, 6.527315672215019e-19, 6.3768232209834e-19, 6.189624903066839e-19, 5.95452150379368e-19, 5.656821063430139e-19, 5.2724428671672e-19, 4.75924966953066e-19, 4.04539987025196e-19, 3.00110114021076e-19, 1.389683151385848e-19, -1.217865729155688e-19, -5.61101483346408e-19, -1.3278359289601798e-18, -2.68361381841732e-18, -4.94042380330338e-18, -8.80423297385778e-18, -1.579680471882006e-17, -2.9492867478672e-17, -5.933837403448739e-17, -1.346488469333208e-16, -3.67960692294342e-16, -1.3472254705848479e-15]
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: 0.020204830574528206
Energy: 0.16357102491610587
Energy: 0.16359130926547708
Energy: 0.16332052268525402
Energy: 0.02537131624216438
Energy: 0.022094493369407633
Energy: 0.16272812206354456
Energy: 0.16486457380842975
Energy: 0.16362535735645073
Energy: 0.024171655266736647
Energy: 0.1628995591074832
Energy: 0.16321883867216033
Energy: 0.1631329971421322
Energy: 0.16365869622865514
Energy: 0.16343776125561432
Energy: 0.1632807836588511
Energy: 0.1634793593137278
Energy: 0.16270894104540692
Energy: 0.16392541201786354
Energy: 0.16408074483734414
Energy: 0.16316251318907807
Energy: 0.025217173895785396
Energy: 0.020768661014349845
Energy: 0.16437462392530247
Energy: 0.16327949836884728
Energy: 0.1628230055231747
Energy: 0.02394656661247266
Energy: 0.02074424123072264
Energy: 0.16289487366586275
Energy: 0.16421308037324878
Energy: 0.1635275576707632
Energy: 0.021777387802334108
Energy: 0.021641632572642244
Energy: 0.16270585972392648
Energy: 0.16314623669767583
Energy: 0.16395220213150064
Energy: 0.022196834418656074
Energy: 0.021034502603762825
Energy: 0.16220075515947863
Energy: 0.16273556720016716
Energy: 0.16339656540751848
Energy: 0.16350981238674892
Energy: 0.16376913608079333
Energy: 0.02211792903965583
Energy: 0.021086123928390727
Energy: 0.16274541192514633
Energy: 0.1640170384596243
Energy: 0.16367435765608948
Energy: 0.02364765057415821
Energy: 0.16196867533103917
Energy: 0.16296987238969707
Energy: 0.16290254634280732
Energy: 0.16591182630321522
Energy: 0.02177931452680674
Energy: 0.02083960317432339
Energy: 0.1625990726390592
Energy: 0.16283674553501354
Energy: 0.16472612322180308
Energy: 0.02137641040111325
Energy: 0.020853257672039466
Energy: 0.02083335028655614
Energy: 0.16331423182069374
Energy: 0.1629348534849744
Energy: 0.16481836699451927
Energy: 0.16432928093291052
Energy: 0.020731856621154857
Energy: 0.16285220638296072
Energy: 0.16284951192153385
Energy: 0.16593827295690047
Energy: 0.16420171883174203

minimum gb energy = 0.020204830574528206 eV
minimum distance =  2.45465014711727 Angstroms
sigma value = 3


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

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Energy: 1.2677057680958272
Energy: 1.2685568261596074
Energy: 1.2693878039725826
Energy: 1.326801019647284
Energy: 1.3288723658531683
Energy: 1.2683965255659908
Energy: 1.270297668169945
Energy: 1.2704710501568652
Energy: 1.3891126764758335
Energy: 1.2600701482024386
Energy: 1.4194163051400566
Energy: 1.2725312243056521
Energy: 1.119915501223281
Energy: 1.169410023883843
Energy: 1.1608298937191321
Energy: 1.2608440320919752
Energy: 1.2695836423214404
Energy: 1.1164281389093003
Energy: 1.319758936599998
Energy: 1.2695580778702147
Energy: 1.4210690102965025
Energy: 1.151477747161409
Energy: 1.1637581105553847
Energy: 1.1664623335475617
Energy: 1.1640156950759533
Energy: 1.4239425371408625
Energy: 1.1548146652988975
Energy: 1.2865999277272746
Energy: 1.2573898334548026
Energy: 1.2725315892334852
Energy: 1.2754462618595783
Energy: 1.3337599641902047
Energy: 1.162890083166418
Energy: 1.1676618627691455
Energy: 1.1638980819867375
Energy: 1.273737707240466
Energy: 1.3403276316313488
Energy: 1.2896474603825758
Energy: 1.3145957934653745
Energy: 1.4574485764129956
Energy: 1.348168421726578
Energy: 1.351613626148435
Energy: 1.1545128049794435
Energy: 1.1586022411903922
Energy: 1.2454088106747476
Energy: 1.3380060893234436
Energy: 1.3998677975278044
Energy: 1.1472530339181692
Energy: 1.1624760651478112
Energy: 1.3289930656540403
Energy: 1.411814503871141
Energy: 1.3321875140859727
Energy: 1.1483916914486998
Energy: 1.3592821249861289
Energy: 1.3266365809298715
Energy: 1.4069519748349992
Energy: 1.3994246731045865
Energy: 1.1452028535024144
Energy: 1.348935382559697
Energy: 1.3382942838299592
Energy: 1.2642448993082671
Energy: 1.4315668440558142
Energy: 1.1551567639080687
Energy: 1.340837244815023
Energy: 1.3607884452372645
Energy: 1.352294999136077
Energy: 1.0714900219829298
Energy: 1.1554290314453033
Energy: 1.3398008243762562
Energy: 1.4656963018162288
Energy: 1.3485151958833541
Energy: 1.4438530569115133
Energy: 1.1747217244511776
Energy: 1.3386482067603627
Energy: 1.3639259942417847
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Energy: 1.41839617543289
Energy: 1.3342869701599989
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Energy: 1.3475580928156863
Energy: 1.3484770786531388
Energy: 1.2366831162533556
Energy: 1.1866930248790555
Energy: 1.2993513091991598
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Energy: 1.1791633290741061
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Energy: 1.1526069453051548
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Energy: 1.155835386477646
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Energy: 1.1624289812385047
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Energy: 1.0980977058627177
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Energy: 1.2928499521765064
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Energy: 1.3757957025335614
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Energy: 1.386930539606211
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Energy: 1.3481111623004498
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Energy: 1.100394152899576
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Energy: 1.3828518689670635
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Energy: 1.383691746835881
Energy: 1.0657412397357418
Energy: 1.1104025143030334
Energy: 1.3833865309508377
Energy: 1.3579803903795555
Energy: 1.3848543773059754
Energy: 1.5856454770994164
Energy: 1.3752754247126564
Energy: 1.3774510107775289
Energy: 1.3744796674570785
Energy: 1.3620960834463185
Energy: 1.362806433228705
Energy: 1.3753717548267952
Energy: 1.3812130400463458
Energy: 1.37370945672358
Energy: 1.362554077710923
Energy: 1.0034983736529992
Energy: 1.496821469234924
Energy: 1.3788191730781463
Energy: 1.380949271704126
Energy: 1.0978643622135384
Energy: 1.004434613241792
Energy: 1.4470162335295844
Energy: 1.3822963124777659
Energy: 1.2193708435646133
Energy: 1.1108357182081776
Energy: 1.1388614146797618
Energy: 1.3977461024650952
Energy: 1.1533693109695913
Energy: 1.2043260250318966
Energy: 1.096345726581931
Energy: 1.1369509557785293
Energy: 1.2314298115766167
Energy: 1.1591077300904333
Energy: 1.2031828325884624
Energy: 1.096172106408087
Energy: 1.207450444842025
Energy: 1.1637274661914363
Energy: 1.1627017529778172
Energy: 1.2082586668825763
Energy: 1.1183481891354932
Energy: 1.2133795584957159
Energy: 1.1641238033619534
Energy: 1.1569511735683478
Energy: 1.2034660952483909
Energy: 1.1178949718532691
Energy: 1.475299991161014
Energy: 1.3748405344075145
Energy: 1.4072879116102666
Energy: 1.3349017908353127
Energy: 1.1534837737921517
Energy: 1.3416814757457294
Energy: 1.3805829141707782
Energy: 1.4102454648171947
Energy: 1.146923159063037
Energy: 1.1801962320127786
Energy: 1.3821731881708714
Energy: 1.3442432388858256
Energy: 1.406042506270883
Energy: 1.1502569262651632
Energy: 1.4238022108184722
Energy: 1.3294782484625611
Energy: 1.3453992265850134
Energy: 1.4057332338198716
Energy: 1.305229724877772
Energy: 1.4191217277942378
Energy: 1.3738429974358297
Energy: 1.3430565055741568
Energy: 1.3189683444451437
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Energy: 1.423703962731484
Energy: 1.360758755556509
Energy: 1.3427195458107555
Energy: 1.2807536177834091
Energy: 1.153261866319489
Energy: 1.2678096755454766
Energy: 1.4609156897600428
Energy: 1.3515497756013959
Energy: 1.3652061173163168
Energy: 1.175860383618403
Energy: 1.343499364277762
Energy: 1.3607598385689785
Energy: 1.3454065533164299
Energy: 1.2342758439947676
Energy: 1.174737050256155
Energy: 1.3406626298768725
Energy: 1.36010256432006
Energy: 1.1807513207862832
Energy: 1.0572452938287404
Energy: 1.170876112455731
Energy: 1.3387425156055355
Energy: 1.3499311583543647
Energy: 1.1938375912438586
Energy: 1.0536205304182027
Energy: 1.1654241450074823
Energy: 1.3346991282680833
Energy: 1.3670606783737236
Energy: 1.1612048016377972
Energy: 1.1483735532133486
Energy: 1.2192148842843542
Energy: 1.1539202107526805
Energy: 1.2028170146518495
Energy: 1.1577599143951594
Energy: 1.159880319139596
Energy: 1.1584544965333305
Energy: 1.1560855386316324
Energy: 1.176448412772256
Energy: 1.1623593945152786
Energy: 1.211787531233047
Energy: 1.1484450267706903
Energy: 1.1575771952151814
Energy: 1.251890916659885
Energy: 1.157308844521192
Energy: 1.1558326282042748
Energy: 1.151117609049916
Energy: 1.1538460181660082
Energy: 1.509806514251704
Energy: 1.1569429716724087
Energy: 1.2434745698027811
Energy: 1.2645625481184364
Energy: 1.262297573922816
Energy: 1.1670433715050237
Energy: 1.0665778300222013
Energy: 1.1608444931138016
Energy: 1.3733293781065032
Energy: 1.2674405237201192
Energy: 1.502249948569487
Energy: 1.3038619159208804
Energy: 1.4408674350854502
Energy: 1.343436691522977
Energy: 1.328729266774774
Energy: 1.166089415221132
Energy: 1.1637933965516212
Energy: 1.350470827252938
Energy: 1.3494809737863245
Energy: 1.3823276715708508
Energy: 1.2652228652682125
Energy: 1.2667224539509985
Energy: 1.270998541371992
Energy: 1.2701179601950614
Energy: 1.2668459049468541
Energy: 1.1598310860882057
Energy: 1.166558029610019
Energy: 1.2760545884958376
Energy: 1.2747779515476196
Energy: 1.42401182887762
Energy: 1.5000816703656097
Energy: 1.2708342300180442
Energy: 1.270531979607499
Energy: 1.2716938986444135
Energy: 1.3275590230197936
Energy: 1.3289548141528547
Energy: 1.270524750316966
Energy: 1.2691108674874045
Energy: 1.2703553088275055
Energy: 1.3337097705806762

minimum gb energy = 1.0034983736529992 eV
minimum distance =  2.0986461854882 Angstroms
sigma value = 75


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

Energy: 2.350285290448025
Energy: 1.4365181522075638
Energy: 1.2731954657022069
Energy: 1.453035075137716
Energy: 1.4126405222888547
Energy: 1.4252305156095175
Energy: 1.429292322562204
Energy: 1.286078608416109
Energy: 1.461304551712677
Energy: 1.4186981395461953
Energy: 1.3299005064070675
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Energy: 1.284397142657259
Energy: 1.3152952408632554
Energy: 1.2717724009296263
Energy: 1.3052332732857401
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Energy: 1.289813819834029
Energy: 1.3096261023361035
Energy: 1.3014570021641252
Energy: 1.3952699170496645
Energy: 1.5521401006437174
Energy: 1.5101187689243774
Energy: 1.3147774195839756
Energy: 1.3315335732952667
Energy: 1.2994867396808931
Energy: 1.5514634922757848
Energy: 1.5003870763528502
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Energy: 1.2762885298555353
Energy: 1.3153216655453366
Energy: 1.342759004930921
Energy: 1.3479817037595818
Energy: 1.3021424240830564
Energy: 1.3557475363484803
Energy: 1.3345469315703244
Energy: 1.2901610542591024
Energy: 1.2417077692495748
Energy: 1.348233249140776
Energy: 1.3581305595088475
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Energy: 1.243060931826975
Energy: 1.4698291150845706
Energy: 1.4992318696247118
Energy: 1.4558540547742083
Energy: 1.46171241351997
Energy: 1.2547119454867768
Energy: 1.4804622723748104
Energy: 1.4984422608089303
Energy: 1.4806722407389483
Energy: 1.4449883215915926
Energy: 1.4458709537575223
Energy: 1.4758099262725335
Energy: 1.3112564518790915
Energy: 1.4784961265272327
Energy: 1.4324609625711
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Energy: 1.4588266013063806
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Energy: 1.314973481533622
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Energy: 1.5401326279822962
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Energy: 1.315196553619803
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Energy: 1.325462898894655
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Energy: 1.3627868358847943
Energy: 1.2908770120000834
Energy: 1.4230854803620208
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Energy: 1.334415439224173
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Energy: 1.3717854129064342
Energy: 1.3498324708704672
Energy: 1.2511327074726912
Energy: 1.3080554631266648
Energy: 1.2706519386532404
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Energy: 1.439250439535872
Energy: 1.4428811699715816
Energy: 1.2865974771680426
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Energy: 1.606600812866044
Energy: 1.4830175004557709
Energy: 1.4577313077677319
Energy: 1.4633384284938644
Energy: 1.5632892304436647
Energy: 1.5829139677263917
Energy: 1.505598556658747
Energy: 1.2825890639542683
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Energy: 1.301211472228955
Energy: 1.5780273455653153
Energy: 1.4821021146827056
Energy: 1.2673775589780396
Energy: 1.4670478729807597
Energy: 1.3178433508907728
Energy: 1.394326916436284
Energy: 1.2522718256794627
Energy: 1.2805812019954639
Energy: 1.348442401432614
Energy: 1.5141900378572022
Energy: 1.3327328465816042
Energy: 1.281918866385793
Energy: 1.320226847217061
Energy: 1.3612629323704057
Energy: 1.2457482084513045
Energy: 1.347970264946242
Energy: 1.3302560204525409
Energy: 1.3101973280740307
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Energy: 1.4108715417995552
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Energy: 1.3270418551554413
Energy: 1.244689271900086
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Energy: 1.2343552863669909
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Energy: 1.2817226816851552
Energy: 1.5463482110196685
Energy: 1.2609267147351897
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minimum gb energy = 1.1666312846582452 eV
minimum distance =  2.12486696917574 Angstroms
sigma value = 105


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

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Energy: 1.3343630355706826
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Energy: 1.5211469948317746
Energy: 1.4230600329688863
Energy: 1.3886905300595767
Energy: 1.410165345566414
Energy: 1.399669893793931
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Energy: 1.395401235743595
Energy: 1.3808526716775988
Energy: 1.3978302287282367
Energy: 1.4063025901818864
Energy: 1.2969262657293086
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Energy: 1.393542933483043
Energy: 1.3951269074920378
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Energy: 1.399845244717534
Energy: 1.21796703464179
Energy: 1.3888033289328885
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Energy: 1.4166224690193658
Energy: 1.4191708411680315
Energy: 1.3062941188745458
Energy: 1.4261110493818807
Energy: 1.4291349336289216
Energy: 1.2425264035555277
Energy: 1.4188269770070079
Energy: 1.3068033430880417
Energy: 1.4264168769159982
Energy: 1.4779570944368767
Energy: 1.3475174547646245
Energy: 1.4482788641751916
Energy: 1.3475740226323032
Energy: 1.4294811111792223
Energy: 1.451602261589855
Energy: 1.4294133214330391
Energy: 1.4858522561410652
Energy: 1.4518763663264729
Energy: 1.4489205630775948
Energy: 1.4524522082186022
Energy: 1.4479977523169953
Energy: 1.3943731967448623
Energy: 1.295167606864886
Energy: 1.2836017590201803
Energy: 1.2901241793983143
Energy: 1.4288582304333561
Energy: 1.2265893107300816
Energy: 1.3040189693916897
Energy: 1.2945260634312776
Energy: 1.2480023180566076
Energy: 1.477952139575346
Energy: 1.3805085756059823
Energy: 1.295841836643733
Energy: 1.2968736796739375
Energy: 1.2955934763861512
Energy: 1.3090565217333487
Energy: 1.3083398282079148
Energy: 1.2944751674093289
Energy: 1.2857526121868492
Energy: 1.2873655933243664
Energy: 1.4233372829521502

minimum gb energy = 1.1933776898408726 eV
minimum distance =  2.15905463856982 Angstroms
sigma value = 165


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

Energy: 1.722663100833637
Energy: 1.2623234302501734
Energy: 1.2548433610246417
Energy: 1.3443052761716097
Energy: 1.1726589233975024
Energy: 1.619093718795846
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Energy: 1.26278841170281
Energy: 1.362103888053312
Energy: 1.263051227411503
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Energy: 1.2925430465416385
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Energy: 1.3827170568188496
Energy: 1.2918346521783175
Energy: 1.347513727084547
Energy: 1.2538699523733845
Energy: 1.3659816204141688
Energy: 1.3520814451375265
Energy: 1.3460691578180422
Energy: 1.3533515856551934
Energy: 1.2847164109189622
Energy: 1.4092722235516297
Energy: 1.280070489969816
Energy: 1.2397056120252035
Energy: 1.242222189789449
Energy: 1.255280071223209
Energy: 1.30687949293292
Energy: 1.3657341736090076
Energy: 1.343506748655253
Energy: 1.3455001720380442
Energy: 1.2593323864096564
Energy: 1.242536785861591
Energy: 1.2691971079509157
Energy: 1.265780251761403
Energy: 1.2313039872630622
Energy: 1.2399540429086715
Energy: 1.3452471453873411
Energy: 1.2697530844776768
Energy: 1.2800287169635525
Energy: 1.2353007820185922
Energy: 1.253056567968652
Energy: 1.2350440564243188
Energy: 1.3692433769142862
Energy: 1.372253637454338
Energy: 1.2597739369911214
Energy: 1.3168699536469672
Energy: 1.1735995737052065
Energy: 1.3513085282739625
Energy: 1.3574215143250994
Energy: 1.2600368058088638
Energy: 1.3454415356213958

minimum gb energy = 1.1713440873178067 eV
minimum distance =  2.20085036885497 Angstroms
sigma value = 41


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

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Energy: 1.1695023740878316
Energy: 1.1446142929069374
Energy: 1.1404227747206892
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Energy: 1.198187351445257
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Energy: 1.2306659361145882
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Energy: 1.1703673677894886
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Energy: 1.1871928346330285
Energy: 1.2866231329126283
Energy: 1.1193710612190595
Energy: 1.1362502790948834
Energy: 1.1811892727088873
Energy: 1.1455169801937013
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Energy: 1.2030249839022575
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Energy: 1.1902154131005218
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Energy: 1.2406337580714542
Energy: 1.238612877670588
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Energy: 1.1825759516693861
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Energy: 1.2557819956412444
Energy: 1.251117641587842
Energy: 1.272106891779251
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Energy: 1.257409905985671
Energy: 1.1526438640225338
Energy: 1.243613863566502
Energy: 1.3029241985382982
Energy: 1.1089863657578416
Energy: 1.2575816356995404
Energy: 1.264085471200817
Energy: 1.2388820038211004
Energy: 1.2383093247556771
Energy: 1.1761517524035958
Energy: 1.2937326034318977
Energy: 1.2807420631803106
Energy: 1.2347088233804084
Energy: 1.23748525290582
Energy: 1.1752678509318015
Energy: 1.3194350680841498
Energy: 1.277410429729848
Energy: 1.1585851104615104
Energy: 1.1866387764019999
Energy: 1.0998841205563794
Energy: 1.266554199741702
Energy: 1.2763581802425668
Energy: 1.2403274982987378
Energy: 1.2213975584333563
Energy: 1.2824741266299258
Energy: 1.238099924124258
Energy: 1.2571425953522262
Energy: 1.1912980220584974
Energy: 1.206933266590407
Energy: 1.233104932300642
Energy: 1.2380248716497373
Energy: 1.2711764985099736
Energy: 1.1978417640682661
Energy: 1.17224761519147
Energy: 1.2341425973438143
Energy: 1.2879257328315694
Energy: 1.1000175952830262
Energy: 1.171861898754775
Energy: 1.101378720552026
Energy: 1.2095372251865049
Energy: 1.328665644550745
Energy: 1.1760746762431007
Energy: 1.1770918679661864
Energy: 1.0986914458866557
Energy: 1.1390626563364536
Energy: 1.1545045753704288
Energy: 1.1520728633493424
Energy: 1.123180579690632
Energy: 1.1371808053695207
Energy: 1.1390820549248526
Energy: 1.1912175360153396
Energy: 1.161714706813619
Energy: 1.186068632135516
Energy: 1.1702812562712828
Energy: 1.1379318079124459
Energy: 1.2390509129016891
Energy: 1.1649285875893725
Energy: 1.172322564672522
Energy: 1.100440918392191
Energy: 1.2006999151202253
Energy: 1.1746058781291475
Energy: 1.1904660459515775
Energy: 1.1004024439623892
Energy: 1.1691675085160265
Energy: 1.203024391276306
Energy: 1.1934683244008946
Energy: 1.1821601515450277
Energy: 1.1910727514147705
Energy: 1.1334857952691402
Energy: 1.1532356989922192
Energy: 1.141389547700637
Energy: 1.1618112671721987
Energy: 1.18629795442821
Energy: 1.181956641086955

minimum gb energy = 1.0881393463847833 eV
minimum distance =  2.18686305039399 Angstroms
sigma value = 185


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

Energy: 1.1560653701694814
Energy: 0.6460938921258017
Energy: 0.6665966079687968
Energy: 0.6922573375152778
Energy: 0.567787719250261
Energy: 0.5668812358354003
Energy: 0.6460274399869556
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Energy: 1.0859024865279132
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Energy: 0.7811977778054895
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Energy: 0.8297402706630203
Energy: 0.7847108971153075
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Energy: 0.7152704397359886
Energy: 0.6468192080096797
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Energy: 0.691540673278746
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Energy: 0.8013509847396104
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Energy: 0.8988317961939912
Energy: 0.6830764613638066
Energy: 0.7483675931623344
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Energy: 0.7922005569135633
Energy: 0.7869276687891428
Energy: 0.6809972457446842
Energy: 0.9687353326507488
Energy: 0.6916360016468537
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Energy: 0.689904003955762
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Energy: 0.6766634395977704
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Energy: 0.6994601776685234
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Energy: 0.8694951202205148
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Energy: 0.7132720050626484
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Energy: 0.6799222690571748
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Energy: 0.6798501208548468
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Energy: 0.7780089571779947
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Energy: 0.6775706413687594
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Energy: 0.7745075699775551
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Energy: 0.646136918786245
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Energy: 0.8068464672064938
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Energy: 0.8321517704263869
Energy: 0.6802681270169725
Energy: 0.7170447931180282
Energy: 0.669933865074451
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Energy: 0.79046745462575
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Energy: 0.7031107418816961
Energy: 0.6680241711347856
Energy: 0.6470834627010702
Energy: 0.6800713744962821
Energy: 0.7743261393551985
Energy: 0.6706725838512296
Energy: 0.9024244382140783
Energy: 0.8994004896639903
Energy: 0.7747397753808942
Energy: 0.9264476574044581
Energy: 0.7817159300623627
Energy: 0.7858042551350223
Energy: 0.7877211625265286
Energy: 0.6668836771558573
Energy: 0.9800759193092088
Energy: 0.7692548012259157
Energy: 0.694569254964582
Energy: 0.8448491561547481
Energy: 0.7063564983866354
Energy: 0.8670197170449432
Energy: 0.7803270930193656
Energy: 0.6465886727328105
Energy: 0.7060048907842442
Energy: 0.6695083386192793
Energy: 0.6840065701075391
Energy: 0.6825806423148841
Energy: 0.7606739043081283
Energy: 0.7599911169083144
Energy: 0.6462775082732809
Energy: 0.6836294365666526
Energy: 0.7049079445982084
Energy: 0.9283014675218705
Energy: 0.648100056361058
Energy: 0.7906657715230954
Energy: 0.6682806564375747
Energy: 0.6967631705911959
Energy: 0.7208509248995163
Energy: 0.6464028130205836
Energy: 0.7796926541684263
Energy: 0.6460061608334555
Energy: 0.9291010511600777
Energy: 0.9270665817360643
Energy: 0.6465584459244913
Energy: 0.8244634888473084
Energy: 0.8007143226410757
Energy: 0.682629086720161
Energy: 0.6774478442135793
Energy: 0.6903815650030889
Energy: 0.6457910518877311
Energy: 0.6482855151169906
Energy: 0.6461611572792088
Energy: 0.6854226630067335
Energy: 0.7750183230548987
Energy: 0.6456541364278336
Energy: 0.7894035523251298
Energy: 1.0907220636660797
Energy: 0.7612603116604395
Energy: 0.6758971275764523
Energy: 0.6463473039781938
Energy: 0.6461352162573795
Energy: 0.5681016539992689
Energy: 0.6837426381244049
Energy: 0.6877424288777557
Energy: 0.6928747204550517
Energy: 1.087345425530224

minimum gb energy = 0.5668812358354003 eV
minimum distance =  2.31477789643277 Angstroms
sigma value = 33


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

Energy: 1.101993899689326
Energy: 1.0690807003253608
Energy: 1.0584867952521415
Energy: 1.0837772343729368
Energy: 1.0702533767392937
Energy: 1.0738121111412022
Energy: 1.069567838520854
Energy: 1.102075766457544
Energy: 1.087005506127571
Energy: 1.0701291160518618
Energy: 1.074123191862693
Energy: 1.0634911587277114
Energy: 1.0631526385661905
Energy: 1.0816894980903549
Energy: 1.0713003386544935
Energy: 1.0737826221189155
Energy: 1.062550593820496
Energy: 1.060983752869018
Energy: 1.060467991753068
Energy: 1.1144126188438574
Energy: 1.0757853779219169
Energy: 1.0604362022555398
Energy: 1.0589569295951269
Energy: 1.1030725367038887
Energy: 1.0704866734470364
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Energy: 1.0602107894082102
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Energy: 1.1028406512523723
Energy: 1.0706072978721217
Energy: 1.1507058765256029
Energy: 1.070939947455294
Energy: 1.0596104052733952
Energy: 1.0703766746634116
Energy: 1.100048508714739
Energy: 1.1237028619914806
Energy: 1.0706709965181103
Energy: 1.0593946984406803
Energy: 1.0697648145977496
Energy: 1.0728647678197176
Energy: 1.06886146861572
Energy: 1.0716306570570604
Energy: 1.1042301409477988
Energy: 1.073656681322824
Energy: 1.0745986792153317
Energy: 1.069228310593028
Energy: 1.0915438834887041
Energy: 1.1005057761377426
Energy: 1.073501814203609
Energy: 1.073965989233396
Energy: 1.0708463473344403
Energy: 1.0733349098306484
Energy: 1.1268899154804988
Energy: 1.072614988909603
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Energy: 1.0691397090453867
Energy: 1.0762015743579978
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Energy: 1.0735710463667034
Energy: 1.0737968716005502
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Energy: 1.0728550441937879
Energy: 1.0733273578148264
Energy: 1.0735333446970092
Energy: 1.0732972702234553
Energy: 1.1027481905880423
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Energy: 1.0731436567936798
Energy: 1.1040183691484755
Energy: 1.0737957318101503
Energy: 1.1030607720776824
Energy: 1.0708775788064535
Energy: 1.069786065705094
Energy: 1.075094335669125
Energy: 1.0661491546588042
Energy: 1.0744034015253505
Energy: 1.1131822857155882
Energy: 1.0742390056550486
Energy: 1.0754747228483208
Energy: 1.0716482655057327
Energy: 1.07614850971502
Energy: 1.1240682705619616
Energy: 1.0752350165940576
Energy: 1.0732989490090497
Energy: 1.0730218014515511
Energy: 1.0729489096912885
Energy: 1.1064680038391295
Energy: 1.0732301223189962
Energy: 1.07314773441107
Energy: 1.0733047940174905
Energy: 1.0731260163825742
Energy: 1.1061088906287302
Energy: 1.073480739722602
Energy: 1.0737175453799517
Energy: 1.1037111637997694
Energy: 1.0699305620360644
Energy: 1.069704756458881
Energy: 1.0728415884298386
Energy: 1.0718629189827247
Energy: 1.1064123076504384
Energy: 1.0699238330435132
Energy: 1.0697637185971494
Energy: 1.072442941429991
Energy: 1.0708381840563312
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Energy: 1.1257746136488394
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Energy: 1.0723870584373598
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Energy: 1.0716585844451623
Energy: 1.07003776366464
Energy: 1.0701419869750761
Energy: 1.0711464987815003
Energy: 1.0702218062701736

minimum gb energy = 1.0519249138232456 eV
minimum distance =  2.26740124400926 Angstroms
sigma value = 219


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

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Energy: 1.3562413185273432
Energy: 1.3504424060546807
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Energy: 1.3168742316181288
Energy: 1.3771138433373649
Energy: 1.3645794122726551
Energy: 1.3731875756168077
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Energy: 1.3810240464412995
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Energy: 1.3835430069669792
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Energy: 1.3824502249901078
Energy: 1.4099950069288028
Energy: 1.3109545119590882
Energy: 1.3948650347329052
Energy: 1.3629746385450083

minimum gb energy = 1.2894390698497737 eV
minimum distance =  2.22479452226936 Angstroms
sigma value = 15


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

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Energy: 1.5250179321426431
Energy: 1.5166804227856623
Energy: 1.4919196027932502
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Energy: 1.5503333364069491
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Energy: 1.5423386264203667
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Energy: 1.5183003211892292
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minimum gb energy = 1.4453553674453241 eV
minimum distance =  2.22749911855834 Angstroms
sigma value = 293


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

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Energy: 1.465829583598606
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Energy: 1.483430807442559
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Energy: 1.5320465425450394
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Energy: 1.4565456063479474
Energy: 1.469882474163705
Energy: 1.533608328930729
Energy: 1.4788493645005607
Energy: 1.4346640928383505
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Energy: 1.531662398635502
Energy: 1.5769634481706214
Energy: 1.4354874937611084
Energy: 1.5482148678753136
Energy: 1.4798705748949275
Energy: 1.5392255952119966
Energy: 1.5755331720079175
Energy: 1.434612357958866
Energy: 1.5602705948000255
Energy: 1.4783197485915534
Energy: 1.476646475265597
Energy: 1.5624141593779846
Energy: 1.435070542021087
Energy: 1.5851646634604404
Energy: 1.4793382420140593
Energy: 1.4827159887596355
Energy: 1.560729064887089
Energy: 1.493066897860732
Energy: 1.479290915854315
Energy: 1.4637228821289452
Energy: 1.4791123466203453
Energy: 1.5779254396994165
Energy: 1.4769678256954262
Energy: 1.4737020935466398
Energy: 1.4636603367936916
Energy: 1.4791171228137374
Energy: 1.479443262526352
Energy: 1.5442581652469034
Energy: 1.5310277639411247
Energy: 1.532119431399645
Energy: 1.53231495419654
Energy: 1.4766318268218463
Energy: 1.4772039697185837
Energy: 1.4784151094818097
Energy: 1.5334532906836498
Energy: 1.535784831147449
Energy: 1.476948549854748
Energy: 1.4785704394609904
Energy: 1.4815023476155704
Energy: 1.4834888875260062
Energy: 1.4807113812416903
Energy: 1.4825521022337493
Energy: 1.5779674980505096
Energy: 1.50555566297336
Energy: 1.4875581771853204
Energy: 1.5847661445918144
Energy: 1.4845386188102643
Energy: 1.5780546498405263
Energy: 1.4794861053158517
Energy: 1.5330991700394596
Energy: 1.4648574721041439
Energy: 1.4795703595134009
Energy: 1.5269527416507649
Energy: 1.4792713943588467
Energy: 1.5324880939895362
Energy: 1.4646097628202197
Energy: 1.479897838263298
Energy: 1.5275985254104507
Energy: 1.4899221544647139
Energy: 1.4810519164310938
Energy: 1.478739878218273
Energy: 1.4700966197058567
Energy: 1.5810947287851824
Energy: 1.4304429245436387
Energy: 1.4804334524440093
Energy: 1.4784825015050624
Energy: 1.4649624456289327
Energy: 1.5413445443379006

minimum gb energy = 1.4294976937725716 eV
minimum distance =  2.17212149616436 Angstroms
sigma value = 293


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

Energy: 1.4071236214349818
Energy: 1.438874397604155
Energy: 1.5432158871325306
Energy: 1.4376029792182798
Energy: 1.416153413271472
Energy: 1.4082336838553466
Energy: 1.440656981893866
Energy: 1.5454460989558974
Energy: 1.4399753914079152
Energy: 1.4150488902420426
Energy: 1.5366008504577267
Energy: 1.4297679951430187
Energy: 1.4297464801551136
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Energy: 1.4148881245737746
Energy: 1.4302624236072383
Energy: 1.4311580775378152
Energy: 1.4345931075849334
Energy: 1.4331355880351806
Energy: 1.4316381690569149
Energy: 1.433964313420692
Energy: 1.532156261458811
Energy: 1.4329127304291867
Energy: 1.4308558862709482
Energy: 1.4311234554599692
Energy: 1.439157043256612
Energy: 1.5363745649979665
Energy: 1.5371778897711252
Energy: 1.4108430259217968
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Energy: 1.430909326691594
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Energy: 1.4171942586634554
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Energy: 1.431268487328842
Energy: 1.4296734684732872
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Energy: 1.4301016117358825
Energy: 1.4291697359300073
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Energy: 1.433127477327943
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Energy: 1.4368730263658553
Energy: 1.4074508075365715
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Energy: 1.5345985310032464
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Energy: 1.4305264962249615
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Energy: 1.4384083715963047
Energy: 1.4318362735692485
Energy: 1.437147964841174
Energy: 1.41646198823359
Energy: 1.408193057411369
Energy: 1.440545145482878
Energy: 1.4340369486940263
Energy: 1.4398775274087217
Energy: 1.4153663351152312
Energy: 1.5366816353293322
Energy: 1.4294560854598466
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Energy: 1.4303546607550293
Energy: 1.4146623143300088
Energy: 1.4303644355360248
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Energy: 1.5397752272845127
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Energy: 1.5354214815599811
Energy: 1.5365876813056654
Energy: 1.4115621192951815
Energy: 1.4143261498393878
Energy: 1.4304525569720319
Energy: 1.5356834641452684
Energy: 1.5466578799829271
Energy: 1.408829462569186
Energy: 1.4145849021577452
Energy: 1.4323113123437623
Energy: 1.5340934377778817
Energy: 1.431575828246489
Energy: 1.4182220724219796
Energy: 1.4080644569231062
Energy: 1.4312699551916597
Energy: 1.4314356529300405
Energy: 1.430687954769921
Energy: 1.417210600039381
Energy: 1.4101679837234378
Energy: 1.4314225083359757
Energy: 1.430660451100248
Energy: 1.4304824039030792
Energy: 1.5370120993139549
Energy: 1.4415907160557522
Energy: 1.4315536829886857
Energy: 1.4157071325865196
Energy: 1.43164620046956
Energy: 1.5448827414051212
Energy: 1.4394660262580188
Energy: 1.4319564964945202
Energy: 1.4166965656975772
Energy: 1.543980987005406
Energy: 1.4073874226306806
Energy: 1.431335424555979
Energy: 1.4302644025750237
Energy: 1.5339055361789973
Energy: 1.431027808048383
Energy: 1.4079318336211246
Energy: 1.4305092449735566
Energy: 1.429559077343632
Energy: 1.4305186550639761
Energy: 1.4314784800090503
Energy: 1.532298558975354
Energy: 1.4302700043947045
Energy: 1.4077339619339684
Energy: 1.4182726408829773
Energy: 1.4328691385406587
Energy: 1.5314474564963894
Energy: 1.433597358280932
Energy: 1.406726426571238
Energy: 1.4162616510618633
Energy: 1.4308778918108387
Energy: 1.414856883886556
Energy: 1.4291341323448412
Energy: 1.4146661240031013
Energy: 1.536362164446807
Energy: 1.4293203615491687
Energy: 1.4290218549425844
Energy: 1.429205153841719
Energy: 1.4150190808826877
Energy: 1.4296691705618163
Energy: 1.4332422802370233
Energy: 1.4314275606598814
Energy: 1.5325190108371736
Energy: 1.5449834258591157
Energy: 1.4376951816493675
Energy: 1.4365920392364897
Energy: 1.4325432567221528
Energy: 1.5323295985541
Energy: 1.4330037413915588
Energy: 1.4331225730194954
Energy: 1.4135443017679705
Energy: 1.430505261957562
Energy: 1.4311195226260576
Energy: 1.4349331811277173
Energy: 1.536831296745471
Energy: 1.415443108091883
Energy: 1.4305975008189167
Energy: 1.4080627112785307
Energy: 1.4354061710547361
Energy: 1.5362845556197577

minimum gb energy = 1.406726426571238 eV
minimum distance =  2.18461614320985 Angstroms
sigma value = 15


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

Energy: 2.543716526684858
Energy: 1.4202803368358132
Energy: 1.5758370618738333
Energy: 1.4672800842982203
Energy: 1.4160936346966744
Energy: 1.3882649727467804
Energy: 1.4170715045755227
Energy: 1.5493283450082431
Energy: 1.4717353331875316
Energy: 1.411897590048944
Energy: 1.415962487717493
Energy: 1.4502172385594043
Energy: 1.4861865160093353
Energy: 1.4985153598355068
Energy: 1.5578052402763312
Energy: 1.3853322690082417
Energy: 1.4786567741164596
Energy: 1.4834604231339847
Energy: 1.5028055302736008
Energy: 1.4988491320456183
Energy: 1.5902106657556798
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Energy: 1.3997167751664665
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Energy: 1.6454174574052964
Energy: 1.6120433760082267
Energy: 1.4579320651380638
Energy: 1.4205916363941284
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Energy: 1.400951111839235
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Energy: 1.432441015456337
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Energy: 1.4034345623862483
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Energy: 1.5182673975100098
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Energy: 1.3931441070159278
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Energy: 1.4028339612245218
Energy: 1.4774257477935244
Energy: 1.6667231061540653
Energy: 1.461363505890296
Energy: 1.4233648537191412
Energy: 1.4272657205378447
Energy: 1.4742271721195646
Energy: 1.4894446757568183
Energy: 1.540380216173327
Energy: 1.387682771305435
Energy: 1.4895996717286062
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Energy: 1.4544565864458487
Energy: 1.6431713046513465
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Energy: 1.6457633348478165
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Energy: 1.4764901846250187
Energy: 1.6798068284161778
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Energy: 1.3830519271199406
Energy: 1.5154068750883418
Energy: 1.4184299629934707
Energy: 1.6765930502117072
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Energy: 1.7091516960908002
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Energy: 1.5356228892241532
Energy: 1.4187170452417721
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Energy: 1.5014982266469639
Energy: 1.4210183607026659
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Energy: 1.4750789776850792
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Energy: 1.5573693184618367
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Energy: 1.4929682832305045
Energy: 1.5052766735209595
Energy: 1.3868662792678832
Energy: 1.460598351174486
Energy: 1.7006131895585088
Energy: 1.4923921255974444
Energy: 1.4429136477752893
Energy: 1.4510550325743383
Energy: 1.3906205601950028
Energy: 1.3955127092481714
Energy: 1.4132534152755902
Energy: 1.4426718856201508
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Energy: 1.4774899313106835
Energy: 1.494465170136074
Energy: 1.4360228365566523
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Energy: 1.6197066119820576
Energy: 1.3924562169442574
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Energy: 1.6166507156032746
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Energy: 1.553467295087635
Energy: 1.3883223062856531
Energy: 1.5217660676715643
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Energy: 1.507293955430946
Energy: 1.6039351001632425
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Energy: 1.5813235756086517
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Energy: 1.4491559378119365
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Energy: 1.525235784881432
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Energy: 1.5154574749578797
Energy: 1.43318609659175
Energy: 1.523158523310271
Energy: 1.3852835593720343
Energy: 1.43789410733643
Energy: 1.6244919068376438
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Energy: 1.6313583585595235
Energy: 1.4505240850854393
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Energy: 1.6311042026805205
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Energy: 1.3976177550198885
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Energy: 1.4955380037257937
Energy: 1.5166396049121578
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Energy: 1.676281213711581
Energy: 1.3973025489482613
Energy: 1.397317718991784
Energy: 1.6603589583029283
Energy: 1.6745731734433915
Energy: 1.625274112665444
Energy: 1.3974984217478679
Energy: 1.3969759373841846
Energy: 1.6589830864585693
Energy: 1.6700527012036634
Energy: 1.405973381623231
Energy: 1.395859262116753
Energy: 1.4044416622873925
Energy: 1.4424975017512607
Energy: 1.5163539743635226
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Energy: 1.40158431595958
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Energy: 1.3969662870686843
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Energy: 1.4566818637796621
Energy: 1.5968482260952233
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Energy: 1.3966815857321444
Energy: 1.4125114451603746
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Energy: 1.503771677904737
Energy: 1.3895679607181795
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Energy: 1.449921363509768
Energy: 1.4635555244875427
Energy: 1.4393735862225088
Energy: 1.4632775711244188
Energy: 1.6218722533449177
Energy: 1.4763092248351843
Energy: 1.646247728278747
Energy: 1.4701200152511587
Energy: 1.3816555384756868
Energy: 1.3799612471329188
Energy: 1.4750986768383987
Energy: 1.6865478058542678
Energy: 1.3951157261790135
Energy: 1.390786689119173
Energy: 1.3937850573170298
Energy: 1.4929417424392932
Energy: 1.4762411917716702
Energy: 1.4507645219696261
Energy: 1.4583737242905797
Energy: 1.4614785029266608
Energy: 1.530815667619983
Energy: 1.3943709311252133
Energy: 1.4389652388053897
Energy: 1.441493558411493
Energy: 1.4472565725847404
Energy: 1.6614284650954805
Energy: 1.4807948517840497
Energy: 1.4246160304849194
Energy: 1.3802333558392708
Energy: 1.469630562892737
Energy: 1.6654630822972218
Energy: 1.6113262652600713
Energy: 1.3940390035525594
Energy: 1.3906383012642247
Energy: 1.4794994689817327
Energy: 1.4938426618479013
Energy: 1.378478540691198
Energy: 1.3905294813618858
Energy: 1.4173156095658166
Energy: 1.441005080518635
Energy: 1.498032589574052
Energy: 1.4247750530249408
Energy: 1.3883619309995292
Energy: 1.4292134322383325
Energy: 1.435322120147822
Energy: 1.4919388504321098
Energy: 1.4946172842798071
Energy: 1.5987065068768775
Energy: 1.4152302204170015
Energy: 1.4376284753468482
Energy: 1.499656340041427
Energy: 1.4479039883843934
Energy: 1.3871475197551368
Energy: 1.4398684630190068
Energy: 1.4295685317370268
Energy: 1.3905446620034558
Energy: 1.4799454690190232
Energy: 1.3803900970643483
Energy: 1.441316886299845
Energy: 1.4459635509088005
Energy: 1.442013499254965
Energy: 1.3898389915833624
Energy: 1.4000211202614956
Energy: 1.4504046984316104
Energy: 1.4819550236158903
Energy: 1.6599876654290842
Energy: 1.6333788694815272
Energy: 1.6636967274189798
Energy: 1.6085932929524833
Energy: 1.47610853747858
Energy: 1.6329133945258243
Energy: 1.6226640058582364
Energy: 1.647640118976732
Energy: 1.6034855469962093
Energy: 1.3768055517471756
Energy: 1.3892609342124882
Energy: 1.5717819772733483
Energy: 1.6218979555675657
Energy: 1.4591170205929433
Energy: 1.503405593459937
Energy: 1.3839265181614195
Energy: 1.5897595026322333
Energy: 1.5147139331398671
Energy: 1.5727539149901009
Energy: 1.4882811130900382
Energy: 1.6374895986141018
Energy: 1.6788496642851234
Energy: 1.6770825745540199
Energy: 1.4635493529846635
Energy: 1.4142744443135955
Energy: 1.6275529483315307
Energy: 1.6741998876313011
Energy: 1.6734651968756236
Energy: 1.4200856831733004
Energy: 1.401617183539832
Energy: 1.3945677417813294
Energy: 1.405794273868083
Energy: 1.5345314998227142
Energy: 1.3949188557950214
Energy: 1.4094574633757577
Energy: 1.395871010161548
Energy: 1.400421481960931
Energy: 1.4102262505538228
Energy: 1.3944231008344081
Energy: 1.4211717086250855
Energy: 1.3962023181720271
Energy: 1.4333307925226786
Energy: 1.4333940807652972
Energy: 1.3951748674303366
Energy: 1.402479234425367
Energy: 1.4496797828441612
Energy: 1.4178567159221647
Energy: 1.5189003682754538
Energy: 1.3938266927696388
Energy: 1.4030753097389752
Energy: 1.5402301710353725
Energy: 1.457665185512377
Energy: 1.4359605552760926
Energy: 1.529686182524659
Energy: 1.4922592360486833
Energy: 1.5259424498068912
Energy: 1.3860158531743867
Energy: 1.4127398398017466
Energy: 1.539795140458277
Energy: 1.5533110337827567
Energy: 1.4162062004395306
Energy: 1.4384622935577966
Energy: 1.554513209716716
Energy: 1.6699000035037426
Energy: 1.4010125931286768
Energy: 1.3849409625498577
Energy: 1.3879090401237144
Energy: 1.5168659720158701
Energy: 1.619389400106777
Energy: 1.403086434535849
Energy: 1.414514610645557
Energy: 1.399401865457791
Energy: 1.413220805881206
Energy: 1.3944114733540844
Energy: 1.3816663525477708
Energy: 1.432826968042824
Energy: 1.4341115603423595
Energy: 1.4412279050176202
Energy: 1.3963618727981364
Energy: 1.3968372219509821
Energy: 1.4181248511388276
Energy: 1.3810548408458039
Energy: 1.684114133900199
Energy: 1.66177951701517
Energy: 1.5647252692061173
Energy: 1.3928257663645462
Energy: 1.4704577166878323
Energy: 1.6729392572042618
Energy: 1.5047829976407394
Energy: 1.564201141001688
Energy: 1.5116067046521484
Energy: 1.555831957871286
Energy: 1.3979444786986543
Energy: 1.478456910874417
Energy: 1.3749987781737274
Energy: 1.6962621414082282
Energy: 1.471214038229344
Energy: 1.3942184633486254
Energy: 1.4777596732115403
Energy: 1.3776366140365832

minimum gb energy = 1.3744679323356794 eV
minimum distance =  2.14838473248296 Angstroms
sigma value = 437


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

Energy: 1.898845473320278
Energy: 1.3932314628361626
Energy: 1.5335889468919657
Energy: 1.2849782834585595
Energy: 1.2909628856213273
Energy: 1.899283022774692
Energy: 1.3950033798347274
Energy: 1.5377737784901402
Energy: 1.2850709662263025
Energy: 1.5618087452114637
Energy: 1.2832257356960612
Energy: 1.5115026689419535
Energy: 1.5795207629034795
Energy: 1.5645348772567118
Energy: 1.4617177938191208
Energy: 1.282507468087067
Energy: 1.5108662077790178
Energy: 1.5748856623171954
Energy: 1.5127847537626011
Energy: 1.3387988941280182
Energy: 1.42908961372388
Energy: 1.4492520684128674
Energy: 1.3658811172654786
Energy: 1.347655872673808
Energy: 1.4401952246731229
Energy: 1.4285388568160642
Energy: 1.4465984732660875
Energy: 1.3664460888886143
Energy: 1.3445618023556896
Energy: 1.4322319986568504
Energy: 1.3441610726656805
Energy: 1.3436783355916075
Energy: 1.3648071700736761
Energy: 1.3186227780897402
Energy: 1.2841475455181683
Energy: 1.3461059238644446
Energy: 1.3466018975672283
Energy: 1.364406865511824
Energy: 1.3139760353631769
Energy: 1.4413563099445166
Energy: 1.3139259745210512
Energy: 1.3933576806663233
Energy: 1.3435994523063626
Energy: 1.3423175395465639
Energy: 1.2812721939996554
Energy: 1.3087610788962283
Energy: 1.5187426238339032
Energy: 1.3440484926651466
Energy: 1.3606657704855558
Energy: 1.455992315636403
Energy: 1.3858246793676205
Energy: 1.3410961936157946
Energy: 1.279880551557914
Energy: 1.4555363938645067
Energy: 1.8945954005379726
Energy: 1.3860743519225844
Energy: 1.340754833785476
Energy: 1.2802069886347855
Energy: 1.4575186805807074
Energy: 1.8972269563360509
Energy: 1.4410898845304183
Energy: 1.4356011096921277
Energy: 1.4245015665800131
Energy: 1.3416929624578573
Energy: 1.3674215811623707
Energy: 1.4395277982094736
Energy: 1.4278675924406905
Energy: 1.428745087171602
Energy: 1.3401453642481418
Energy: 1.3664647561334142
Energy: 1.4404459889976584
Energy: 1.2824620674938676
Energy: 1.3404028085747042
Energy: 1.4997169920973996
Energy: 1.510873908374571
Energy: 1.442029459857456
Energy: 1.2802483889236627
Energy: 1.3415807746260993
Energy: 1.614829634438445
Energy: 1.5109425554942386
Energy: 1.3432480778574862
Energy: 1.3738880524758328
Energy: 1.3944303555982
Energy: 1.370002699625531
Energy: 1.3442486994398337
Energy: 1.3418372230966773
Energy: 1.3712645983000344
Energy: 1.406509842651515
Energy: 1.283717925939436
Energy: 1.342957789618495
Energy: 1.284420601915696
Energy: 1.468033038227456
Energy: 1.291132192338101
Energy: 1.6705725570135324
Energy: 1.4136088381353051
Energy: 1.3066811764291375
Energy: 1.3399213227487468
Energy: 1.3421662409595605
Energy: 1.6478527400882115
Energy: 1.3951839289874173
Energy: 1.283772346085149
Energy: 1.2833232401645311
Energy: 1.2869815495600263
Energy: 1.452917354510834
Energy: 1.2886676079787391
Energy: 1.2835691807098024
Energy: 1.2825228502963537
Energy: 1.3989401116935956
Energy: 1.4525264250477619
Energy: 1.3442766577065361
Energy: 1.2873979292194278
Energy: 1.284856428367015
Energy: 1.2905877004061417
Energy: 1.5532220578035154
Energy: 1.2872137676263007
Energy: 1.2865750087620922
Energy: 1.284529396210252
Energy: 1.2844046553452724
Energy: 1.5840490668777378
Energy: 1.286391218174927
Energy: 1.2829517330326974
Energy: 1.2889667636758497
Energy: 1.7430553119628291
Energy: 1.5113387472017628
Energy: 1.286921233961923
Energy: 1.2841212021504496
Energy: 1.3387879663570517
Energy: 1.5161971452814667
Energy: 1.5099287326112223
Energy: 1.2855569572237577
Energy: 1.5667719761693182
Energy: 1.2890305369380257
Energy: 1.3663743633326757
Energy: 1.2861597743571147
Energy: 1.2902188722785868
Energy: 1.2924803376237923
Energy: 1.2854025690166224
Energy: 1.5416516869434078
Energy: 1.2848829462163414
Energy: 1.3829263253740378

minimum gb energy = 1.279880551557914 eV
minimum distance =  2.22918549807413 Angstroms
sigma value = 33