Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Al__MO_519613893196_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.031999975442886
cohesive_energy=3.360958551709536
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.7874042746567398e-19, 2.49740885001384e-19, 2.9975923733822996e-19, 3.3831882238870793e-19, 3.6927607931085596e-19, 3.9479394656057395e-19, 4.1624709168983396e-19, 4.345711858528919e-19, 4.50408701879982e-19, 4.64205044875356e-19, 4.762822523424479e-19, 4.86879048599724e-19, 4.96173275253558e-19, 5.0430432167110795e-19, 5.11377931510218e-19, 5.174886331922939e-19, 5.22706922489232e-19, 5.270936821131239e-19, 5.30698579539624e-19, 5.33571282244386e-19, 5.357470381133579e-19, 5.37264299385756e-19, 5.38151905240992e-19, 5.38441899211746e-19, 5.38129474768116e-19, 5.37115296958794e-19, 5.35269589476426e-19, 5.324401455407819e-19, 5.284459191922199e-19, 5.23065810055248e-19, 5.16038663338524e-19, 5.07050452421784e-19, 4.957134505596e-19, 4.815630265281119e-19, 4.640207945624459e-19, 4.423641730006679e-19, 4.1569434075110396e-19, 3.82876956756882e-19, 3.4246044898759796e-19, 2.9257507731137394e-19, 2.30766307124922e-19, 1.537918135740162e-19, 5.7299444050059e-20, -6.4648628270217e-20, -2.20321717647876e-19, -4.2144615486716393e-19, -6.852685703047741e-19, -1.0380550476985019e-18, -1.52164322549199e-18, -2.20606905088728e-18, -3.2163535709886596e-18, -4.79353624949826e-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: 0.011788125867584334
Energy: 0.07075820957540069
Energy: 0.07196609640156625
Energy: 0.07176545910646613
Energy: 0.013886744402820058
Energy: 0.012758830497003914
Energy: 0.0706253624583581
Energy: 0.07204903497019159
Energy: 0.07144804148210353
Energy: 0.013432066580429707
Energy: 0.07043710011194165
Energy: 0.07048587747680005
Energy: 0.07078220141039271
Energy: 0.07137198692604907
Energy: 0.07198165286389557
Energy: 0.07065961603181525
Energy: 0.0705773096582943
Energy: 0.07069160901280777
Energy: 0.0711517104636045
Energy: 0.07164910266574574
Energy: 0.07215462054787104
Energy: 0.013927478824240105
Energy: 0.01207892871354962
Energy: 0.07092741382562412
Energy: 0.070949205167835
Energy: 0.07194124631782196
Energy: 0.01338940953145454
Energy: 0.01207053369346137
Energy: 0.07069355522727193
Energy: 0.07146499503715271
Energy: 0.07122699951802759
Energy: 0.012809050064520964
Energy: 0.012576755631359807
Energy: 0.07055957029931824
Energy: 0.07080504021241311
Energy: 0.07192501066424677
Energy: 0.012972481492390232
Energy: 0.012246977228073427
Energy: 0.07024170952479891
Energy: 0.07057622325129295
Energy: 0.0710697855226383
Energy: 0.07138242715526714
Energy: 0.07213549708011287
Energy: 0.01282137630629228
Energy: 0.012772066840910357
Energy: 0.07070752905486652
Energy: 0.07169056705857837
Energy: 0.07231276572938343
Energy: 0.013346402446522073
Energy: 0.0706922154920268
Energy: 0.07216284673940024
Energy: 0.07050203614766684
Energy: 0.07131467720434358
Energy: 0.012607292362997487
Energy: 0.014533177125182171
Energy: 0.0724708599495402
Energy: 0.07047045458695797
Energy: 0.07187395387851457
Energy: 0.012470026648043328
Energy: 0.012186910234399231
Energy: 0.015133331194062703
Energy: 0.07220224347323961
Energy: 0.07096636860210076
Energy: 0.07148309429754639
Energy: 0.07279298679447221
Energy: 0.015186395571613564
Energy: 0.07246407821973438
Energy: 0.07101215134028828
Energy: 0.07182697836220352
Energy: 0.07265122596701565

minimum gb energy = 0.011788125867584334 eV
minimum distance =  2.81226466359724 Angstroms
sigma value = 3


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

Energy: 0.673856428388013
Energy: 0.5726980240791806
Energy: 0.5446186810213564
Energy: 0.5599994922489537
Energy: 0.5941983846024097
Energy: 0.6118342522190195
Energy: 0.5457831456833258
Energy: 0.5708723459241977
Energy: 0.5616803330485802
Energy: 0.5913314833207175
Energy: 0.5449217980725922
Energy: 0.6098799516069424
Energy: 0.5487392323477749
Energy: 0.4852914477141946
Energy: 0.4317891000634313
Energy: 0.44851147080018317
Energy: 0.5812655557268621
Energy: 0.555963826426409
Energy: 0.4920591800976747
Energy: 0.5351822972389156
Energy: 0.502843550255748
Energy: 0.5827948004578064
Energy: 0.4873832289233838
Energy: 0.5367498466183733
Energy: 0.533792649174503
Energy: 0.4300354726301145
Energy: 0.4978116179190327
Energy: 0.48783892833354464
Energy: 0.47475053475835144
Energy: 0.5286501547129808
Energy: 0.4722888835605295
Energy: 0.5515208404450374
Energy: 0.5900362146788907
Energy: 0.43017545931916706
Energy: 0.5342150764564618
Energy: 0.4304445858427691
Energy: 0.5552021224972667
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Energy: 0.5099335478139974
Energy: 0.5287289796442323
Energy: 0.6290735987697634
Energy: 0.561143189078121
Energy: 0.5972937494985476
Energy: 0.5291644329908048
Energy: 0.49365374393739114
Energy: 0.6055956709265797
Energy: 0.5624266608771868
Energy: 0.5430989929649767
Energy: 0.5312540838806865
Energy: 0.4590773138931479
Energy: 0.5788574398900876
Energy: 0.618135952134765
Energy: 0.5948010329815735
Energy: 0.5077815019063889
Energy: 0.6192108189828031
Energy: 0.5786756586595108
Energy: 0.6092482070609632
Energy: 0.5430833271853809
Energy: 0.45068069315361736
Energy: 0.6104161657147712
Energy: 0.5705357852483466
Energy: 0.5932251280936937
Energy: 0.606791587518116
Energy: 0.5098027394786843
Energy: 0.5806550940295319
Energy: 0.5827212863584578
Energy: 0.5830452128239569
Energy: 0.5759493162215035
Energy: 0.4569568229176858
Energy: 0.5713631984638763
Energy: 0.5778041952760113
Energy: 0.5546339118980455
Energy: 0.5793820653972569
Energy: 0.5147763253315452
Energy: 0.5551989006009468
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Energy: 0.5583918379268219
Energy: 0.6131910014351721
Energy: 0.4157131525719201
Energy: 0.5557098256693704
Energy: 0.5724341747986168
Energy: 0.49926890535208085
Energy: 0.4586704822058925
Energy: 0.6143830179124006
Energy: 0.6013995441180856
Energy: 0.5716865927349561
Energy: 0.49101270094488314
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Energy: 0.4891396192491817
Energy: 0.5318052390488734
Energy: 0.5090459946589218
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Energy: 0.4864005534375729
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Energy: 0.6121671434292739
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Energy: 0.5789726993867896
Energy: 0.5610964734648424
Energy: 0.5926230411078669
Energy: 0.6123660821016771
Energy: 0.5968690242938345
Energy: 0.5545670403593966
Energy: 0.5806109646501615
Energy: 0.563093005716561
Energy: 0.6539114947874205
Energy: 0.57790337674268
Energy: 0.5816110024059574
Energy: 0.5550127021895205
Energy: 0.5564297914639005
Energy: 0.41572953869431317
Energy: 0.5812101864322292
Energy: 0.5612010578456703
Energy: 0.5794707219308657
Energy: 0.5142198868960324
Energy: 0.4455893259908718
Energy: 0.5902546020813257
Energy: 0.5568083834486922
Energy: 0.4949325262964554
Energy: 0.4543011195550969
Energy: 0.4567911685547724
Energy: 0.4981465420347236
Energy: 0.4893482080360912
Energy: 0.5294153292835632
Energy: 0.528548034054791
Energy: 0.4810942176808383
Energy: 0.4907934088123287
Energy: 0.4901358400622859
Energy: 0.5152802474435344
Energy: 0.479343535212964
Energy: 0.4646419643032315
Energy: 0.5060231624366683
Energy: 0.5097818671881462
Energy: 0.49302597325046393
Energy: 0.4573082869317373
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Energy: 0.4898364777943068
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Energy: 0.4543474638209832
Energy: 0.4570464854000697
Energy: 0.5871453160045061
Energy: 0.5695366216553548
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Energy: 0.6081350017438109
Energy: 0.46197617222859044
Energy: 0.6082307151869653
Energy: 0.5972700197083153
Energy: 0.5880012482443273
Energy: 0.6279593756552486
Energy: 0.456257599769963
Energy: 0.5772579517831877
Energy: 0.6097644664553206
Energy: 0.5474509987986006
Energy: 0.45206026700799146
Energy: 0.580924644288564
Energy: 0.5766673077926431
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Energy: 0.5916679558907773
Energy: 0.5573396144805817
Energy: 0.5888161629699977
Energy: 0.570853124816851
Energy: 0.5813446139011523
Energy: 0.5764819218572959
Energy: 0.45581624604662585
Energy: 0.6105233855362955
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Energy: 0.6066524705903803
Energy: 0.5494301069635101
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Energy: 0.5783392590577394
Energy: 0.5579000250003308
Energy: 0.4190900408883493
Energy: 0.4197852422361127
Energy: 0.5573509289524414
Energy: 0.5769823674080667
Energy: 0.5538173654524119
Energy: 0.48055476991131596
Energy: 0.5180464147425178
Energy: 0.5561508488714604
Energy: 0.5696331421051894
Energy: 0.49385040313369255
Energy: 0.41771754403188827
Energy: 0.5950544493686402
Energy: 0.5893894494039934
Energy: 0.5722191310308606
Energy: 0.4981041187285104
Energy: 0.46313689948340436
Energy: 0.6144422527161595
Energy: 0.5569390169914059
Energy: 0.49987758763557283
Energy: 0.5358113555590632
Energy: 0.4536848092460222
Energy: 0.5120677056192872
Energy: 0.48543976599349586
Energy: 0.5444360257312943
Energy: 0.5317602748667942
Energy: 0.5096680592754198
Energy: 0.5030932618956905
Energy: 0.5068620650468603
Energy: 0.5783205426415069
Energy: 0.4502755356949121
Energy: 0.5351850537956522
Energy: 0.45121499593658293
Energy: 0.5091469349888308
Energy: 0.508610159022071
Energy: 0.5201194309947079
Energy: 0.4838633859492252
Energy: 0.5039471996714021
Energy: 0.5068873951879785
Energy: 0.6187328870482011
Energy: 0.4767054444374619
Energy: 0.45695304145847576
Energy: 0.5780039616777353
Energy: 0.5484730613629551
Energy: 0.6055440038635067
Energy: 0.4338785904288694
Energy: 0.5328489876486241
Energy: 0.6156251835988719
Energy: 0.5939200084178753
Energy: 0.4710026080644951
Energy: 0.5572053016909124
Energy: 0.6098904205890849
Energy: 0.5917304330765079
Energy: 0.5651768095346986
Energy: 0.43230608204500665
Energy: 0.5362171674192717
Energy: 0.5131201868134544
Energy: 0.5910928828369719
Energy: 0.5765155567225807
Energy: 0.5428357695829056
Energy: 0.5326772941084783
Energy: 0.5739890998079725
Energy: 0.5561275850185492
Energy: 0.6128529341760057
Energy: 0.4335638025487591
Energy: 0.5275775945956913
Energy: 0.5661756897980887
Energy: 0.5493346172495053
Energy: 0.6095141711946936
Energy: 0.6749380767578246
Energy: 0.5730668723939923
Energy: 0.5732992426311798
Energy: 0.5468993019428828
Energy: 0.5564309584741284
Energy: 0.6142817133235466
Energy: 0.5799121726115102
Energy: 0.5714558327440701
Energy: 0.5444642583224371
Energy: 0.5778860258454163

minimum gb energy = 0.4157131525719201 eV
minimum distance =  2.53770548951406 Angstroms
sigma value = 75


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

Energy: 0.9233398377721951
Energy: 0.5205360917449869
Energy: 0.5205495845494722
Energy: 0.5795516423814857
Energy: 0.5063181452457891
Energy: 0.5681903295922784
Energy: 0.5220262900720168
Energy: 0.5260531427531023
Energy: 0.5908412467443391
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Energy: 0.5583819099201994
Energy: 0.541699504164791
Energy: 0.5260234231072993
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Energy: 0.5116795662825008
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Energy: 0.526803094418032
Energy: 0.5416011962857328
Energy: 0.531277135137643
Energy: 0.5654677864362947
Energy: 0.5977927316598711
Energy: 0.5532985128883445
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Energy: 0.5535230397455033
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Energy: 0.5134735070859913
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Energy: 0.5286509458412962
Energy: 0.5485709603008673
Energy: 0.5488330805114572
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Energy: 0.5190585431933871
Energy: 0.5035811155425282
Energy: 0.5661860398168613
Energy: 0.5483461467162012
Energy: 0.5346571879509732
Energy: 0.513825131725556
Energy: 0.6157966898366382
Energy: 0.6041903795712362
Energy: 0.5330065456398382
Energy: 0.5184632588412438
Energy: 0.5133040781879169
Energy: 0.5244785967963103
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Energy: 0.531095380186664
Energy: 0.5173547833323797
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Energy: 0.5428958873121473
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Energy: 0.580963824023202
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Energy: 0.5576909539751266
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Energy: 0.5402557170974396
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Energy: 0.5281834199249008
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Energy: 0.5257207641046973
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Energy: 0.5137813660127235
Energy: 0.6005092917840492
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Energy: 0.5857627613723838
Energy: 0.5243842457806279
Energy: 0.6059693425762158
Energy: 0.5314105574360005
Energy: 0.514189885719964
Energy: 0.598593893680002
Energy: 0.5320315325794089
Energy: 0.5503576493730841
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Energy: 0.6110384653469716
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minimum gb energy = 0.49325237565379854 eV
minimum distance =  2.49718107583249 Angstroms
sigma value = 105


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

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Energy: 0.5214805284989706
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Energy: 0.5740920939244428
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Energy: 0.5193231714218615
Energy: 0.5459688447572932
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Energy: 0.5289228431117439
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Energy: 0.5384432729806706
Energy: 0.547295977828045
Energy: 0.5544403515992482
Energy: 0.5285979943912495
Energy: 0.54936393933776
Energy: 0.539070408559754
Energy: 0.5622738138863435
Energy: 0.5308727762371248
Energy: 0.5490564794895433
Energy: 0.5292462730299836
Energy: 0.5454107621288714
Energy: 0.5427097983531552
Energy: 0.5308551048192472
Energy: 0.5291208405094402
Energy: 0.5295126334719265
Energy: 0.5501372335732295
Energy: 0.53183630535969
Energy: 0.5420157749856778
Energy: 0.5565497605228634
Energy: 0.5380486805904403
Energy: 0.5396901368496138
Energy: 0.5295293758738983
Energy: 0.5353255772619991
Energy: 0.5539839579181693
Energy: 0.5749744250357703
Energy: 0.5305807192375576
Energy: 0.5886264140713736
Energy: 0.5429466960711483
Energy: 0.53102248467825
Energy: 0.5306770644715277
Energy: 0.557808929889299
Energy: 0.5429591883237855
Energy: 0.5419308278443785
Energy: 0.5300034137528858
Energy: 0.5304402945807795
Energy: 0.5392589444596321
Energy: 0.5758134750628147
Energy: 0.5360652813533239
Energy: 0.5374000989728906
Energy: 0.5427792786035337
Energy: 0.5570470953845489
Energy: 0.5754493128042846
Energy: 0.5104136702788702
Energy: 0.5306082732984383
Energy: 0.5596414726562454
Energy: 0.5610402594350601
Energy: 0.5462752042665692
Energy: 0.5557758845415471
Energy: 0.5412143561267801
Energy: 0.5490672069766693
Energy: 0.5695967104042047
Energy: 0.509996678912428
Energy: 0.528065153029897
Energy: 0.5495184734082906
Energy: 0.5493441507691427
Energy: 0.5720076554505319
Energy: 0.5309942804861758
Energy: 0.5174237688462486
Energy: 0.5089831234778457
Energy: 0.5092093131739265
Energy: 0.5286952132522728
Energy: 0.5223973792760572
Energy: 0.5567106924066664
Energy: 0.5135018069819295
Energy: 0.5435359432164902
Energy: 0.5299391109949962
Energy: 0.5402514985403294
Energy: 0.5125293495541487
Energy: 0.5335108653909034
Energy: 0.5289659124391134
Energy: 0.5190148325907609
Energy: 0.5584191225737006
Energy: 0.5092979593576266
Energy: 0.5297299933098397
Energy: 0.524749872379685
Energy: 0.5307065647401069

minimum gb energy = 0.5014684469595747 eV
minimum distance =  2.52973683293551 Angstroms
sigma value = 165


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

Energy: 0.6293065783901598
Energy: 0.49323779091995307
Energy: 0.48648451832593215
Energy: 0.5060993495199123
Energy: 0.4802944530847415
Energy: 0.6297396813254992
Energy: 0.49354813380233026
Energy: 0.48611502194793654
Energy: 0.5065583040441797
Energy: 0.4801071494210036
Energy: 0.5171182916087923
Energy: 0.5074638580222363
Energy: 0.5046918501925836
Energy: 0.5017419289753953
Energy: 0.5201361861977111
Energy: 0.5092508630913836
Energy: 0.5076211202059087
Energy: 0.498659876711935
Energy: 0.5023210901330157
Energy: 0.5186349333646474
Energy: 0.50168864032219
Energy: 0.5337484077968235
Energy: 0.5562807532939836
Energy: 0.5096822096648399
Energy: 0.5108927211066049
Energy: 0.502235476742903
Energy: 0.5067936023817281
Energy: 0.5360493152237839
Energy: 0.5094509208821211
Energy: 0.5109851027108675
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Energy: 0.5059629161580125
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Energy: 0.5110089569083687
Energy: 0.5050780147042901
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Energy: 0.4984750295856968
Energy: 0.5060596837192382
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Energy: 0.4988566910465022
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Energy: 0.4981753457844216
Energy: 0.49194955027486925
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Energy: 0.5016007482895737
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Energy: 0.4916479103106301
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Energy: 0.49936694588873337
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Energy: 0.558835279561389
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Energy: 0.48141904167983157
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Energy: 0.5007128409164361
Energy: 0.5157848199946513
Energy: 0.5163194340193952
Energy: 0.49733586761912935
Energy: 0.49943893818763574
Energy: 0.509269003622833
Energy: 0.517617625252791
Energy: 0.5080066344688035
Energy: 0.504301055632431
Energy: 0.5050753496925264
Energy: 0.5054013222476826
Energy: 0.517959186753112
Energy: 0.5066938554075247
Energy: 0.5045327815073165
Energy: 0.5063770261461251
Energy: 0.5323112998841222
Energy: 0.518947601988645
Energy: 0.5373581323811518
Energy: 0.5085873913951054
Energy: 0.5060174301543595
Energy: 0.6318574552489286
Energy: 0.5073976200009623
Energy: 0.5065367818297547
Energy: 0.5084594415079621
Energy: 0.5051064763258495
Energy: 0.6307186896818275
Energy: 0.5096776223553745
Energy: 0.4979896891396727
Energy: 0.5100958898766036
Energy: 0.5016357547041311
Energy: 0.5019416525579501
Energy: 0.5088133849532139
Energy: 0.4978775511600257
Energy: 0.5087395874903762
Energy: 0.5010089409892843
Energy: 0.5127681392748243
Energy: 0.5354293446433669
Energy: 0.50492647272751
Energy: 0.4989681672033133
Energy: 0.4987070792728422
Energy: 0.49513685492756965
Energy: 0.5019831510891051
Energy: 0.5037221381493063
Energy: 0.49850524073451313
Energy: 0.4982724012200082
Energy: 0.4914561399654
Energy: 0.5013785030999827
Energy: 0.5040648800811042
Energy: 0.5077296850018512
Energy: 0.47978237161285126
Energy: 0.49980336718741813
Energy: 0.5196356408938083
Energy: 0.5045734988974979
Energy: 0.4981985819683216
Energy: 0.48157833030152986
Energy: 0.49969123442567115
Energy: 0.5269739445165963
Energy: 0.5047922250283229
Energy: 0.5056575320225095
Energy: 0.48753383627128827
Energy: 0.5092783543423101
Energy: 0.5181331820221089
Energy: 0.502451872236086
Energy: 0.5049727114672309
Energy: 0.48771833067360476
Energy: 0.507775490978809

minimum gb energy = 0.47978237161285126 eV
minimum distance =  2.57165731326984 Angstroms
sigma value = 41


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

Energy: 0.9685811736197951
Energy: 0.4908950700756004
Energy: 0.45399448372425105
Energy: 0.4448085611854075
Energy: 0.462885846548655
Energy: 0.44491574942674855
Energy: 0.46173283757654837
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Energy: 0.46693057767133933
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Energy: 0.48493044009921393
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Energy: 0.45091490054861155
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Energy: 0.4985986488133025
Energy: 0.45739949330763957
Energy: 0.4755386630442972
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Energy: 0.4667333618645004
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Energy: 0.46717223538759334
Energy: 0.4666401615052741
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Energy: 0.45949165775297574
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Energy: 0.48593627471124473
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Energy: 0.48530043831734393
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Energy: 0.46731237442157736
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Energy: 0.46937885913312716
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Energy: 0.48720038093909496
Energy: 0.46530499036640216
Energy: 0.463834668587669
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Energy: 0.4499081834440718
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Energy: 0.45913938233548646
Energy: 0.45404569548096657
Energy: 0.4788363202209502
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Energy: 0.48535666932717053
Energy: 0.45565883107400335
Energy: 0.48103393797276434
Energy: 0.47909074142043845
Energy: 0.4498423694054719
Energy: 0.4794524076199605
Energy: 0.46398280464695574
Energy: 0.4809208267789335
Energy: 0.45461933922359604
Energy: 0.5058008084428757
Energy: 0.466208323072142
Energy: 0.45422679703419
Energy: 0.4552804855438039
Energy: 0.4459659902712671
Energy: 0.4731381252302178
Energy: 0.4632503068247755
Energy: 0.4906834715979951
Energy: 0.4746270822856999
Energy: 0.4571229210495693
Energy: 0.4584976584287156
Energy: 0.5030541559444855
Energy: 0.500021598197545
Energy: 0.45306366970087075
Energy: 0.5789765571515847
Energy: 0.4366085792740272
Energy: 0.4911224965529729
Energy: 0.495835792425972
Energy: 0.4581924541568436

minimum gb energy = 0.43459391221046534 eV
minimum distance =  2.59859541254013 Angstroms
sigma value = 185


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

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Energy: 0.36660530877497266
Energy: 0.3625600955907457
Energy: 0.36274297034402536
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Energy: 0.373140728683055
Energy: 0.3334304576997795
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Energy: 0.2431315766342403
Energy: 0.34603009402039797
Energy: 0.42168899347473404
Energy: 0.3628135940748123
Energy: 0.2868381927621828
Energy: 0.28185123933275746
Energy: 0.3569218274138499
Energy: 0.37188161454588764
Energy: 0.3689337029762652
Energy: 0.337705804412755
Energy: 0.3286183569010428
Energy: 0.3549339410120785
Energy: 0.35953946778612467
Energy: 0.33886552273747206
Energy: 0.27804440543365694
Energy: 0.3003716539024858
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Energy: 0.3650387430953718
Energy: 0.3663594043345844
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Energy: 0.27712909767901467
Energy: 0.2222228079422831
Energy: 0.3159537222515319
Energy: 0.35203905302994
Energy: 0.33875165888216807
Energy: 0.3385651548261905

minimum gb energy = 0.2134063595844252 eV
minimum distance =  2.64464433703379 Angstroms
sigma value = 33


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

Energy: 0.8076151617877977
Energy: 0.40598488609323186
Energy: 0.41144826352467956
Energy: 0.40558755450485257
Energy: 0.39597064223929884
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Energy: 0.4014787120853245
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Energy: 0.4160150184035786
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Energy: 0.4260003787020504
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Energy: 0.4065654160994021

minimum gb energy = 0.3947175940860155 eV
minimum distance =  2.58797775153685 Angstroms
sigma value = 219


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

Energy: 0.7461910736297034
Energy: 0.5113729639520489
Energy: 0.5102476904568243
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Energy: 0.5155879898638975
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Energy: 0.5105472789273062
Energy: 0.5136560341575113
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Energy: 0.5184069487917361
Energy: 0.5114324272902825
Energy: 0.5015368399300213
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Energy: 0.5101956749317808
Energy: 0.5021895030888105
Energy: 0.5154744445206564
Energy: 0.5284548598848356
Energy: 0.5097349895792327
Energy: 0.5100148183986211

minimum gb energy = 0.4982122671010848 eV
minimum distance =  2.60913049982026 Angstroms
sigma value = 15


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

Energy: 0.872021602641004
Energy: 0.5921870259922593
Energy: 0.5976440742568827
Energy: 0.5857491741251611
Energy: 0.6089656885560082
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Energy: 0.5890060989602965
Energy: 0.5812213718325929
Energy: 0.5939921555023716
Energy: 0.596019760143235
Energy: 0.6086817895146022
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Energy: 0.6095506041107476
Energy: 0.5839655440139264
Energy: 0.607339418153488
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minimum gb energy = 0.5735717527940869 eV
minimum distance =  2.56322471547534 Angstroms
sigma value = 293


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

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Energy: 0.5876576068375704
Energy: 0.5881592711820419
Energy: 0.6133175251899585
Energy: 0.6090997543192469
Energy: 0.5971080550660194
Energy: 0.5783544798525944
Energy: 0.611310754685143
Energy: 0.6252409910365522
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Energy: 0.6419337775607483
Energy: 0.5787935073925636
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Energy: 0.6228266555790782
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Energy: 0.7227478219658501
Energy: 0.5940796716320869
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Energy: 0.5786792805193883
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Energy: 0.5638036331539558
Energy: 0.5973178377402842
Energy: 0.5777060129871489
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Energy: 0.5769850241873831
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Energy: 0.5777017540637891
Energy: 0.5776792040003074
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Energy: 0.5875367217354636
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Energy: 0.5788371025084859
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Energy: 0.6155331743427669
Energy: 0.5891513396193213
Energy: 0.5807073047651338
Energy: 0.602277689226865
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Energy: 0.5782979005573622
Energy: 0.6002594446491899
Energy: 0.5652348586217221
Energy: 0.5877323361378582
Energy: 0.5789738252294525
Energy: 0.5991844684608281
Energy: 0.6002172894968952
Energy: 0.6018653248337702
Energy: 0.6113962731236486
Energy: 0.577272942258709
Energy: 0.5799525200906354
Energy: 0.5906186414076974
Energy: 0.5907361623974764
Energy: 0.5787959946437496
Energy: 0.577674847845639
Energy: 0.5806958725970987
Energy: 0.5893216979368217
Energy: 0.5651952470242658
Energy: 0.5797806378158512
Energy: 0.5761280672845205
Energy: 0.5797248324977697
Energy: 0.6163741399116638
Energy: 0.6081280947916383
Energy: 0.5797394595107481
Energy: 0.577405523096871
Energy: 0.5785227265147449
Energy: 0.6139872012601547
Energy: 0.6189938394177281
Energy: 0.5787443305685664
Energy: 0.6113683017620316
Energy: 0.595797007492842
Energy: 0.5875260932539216
Energy: 0.57663804729352
Energy: 0.5788010617899279
Energy: 0.5959276503651081
Energy: 0.5964279839727661
Energy: 0.5981776143955587
Energy: 0.6022157910486522
Energy: 0.5805881998523897
Energy: 0.5872806954080798
Energy: 0.6173127515288649
Energy: 0.5795866172980252
Energy: 0.5967370137307471
Energy: 0.5884308790311261
Energy: 0.5872966672261285
Energy: 0.6185738178038995
Energy: 0.5792244906100114
Energy: 0.5972006933291469
Energy: 0.5780733853060175
Energy: 0.5968157539931016
Energy: 0.6223912159232949
Energy: 0.5798823515167235
Energy: 0.6422421454903969
Energy: 0.5788419288967954
Energy: 0.5984382315699986
Energy: 0.6218795458548562
Energy: 0.5773016910077977
Energy: 0.6423276597154784
Energy: 0.6112040640518879
Energy: 0.5884436685806117
Energy: 0.5800953371563097
Energy: 0.5772897780701856
Energy: 0.5976351465011799
Energy: 0.5836064749589044
Energy: 0.5894212570324671
Energy: 0.5816218509815003
Energy: 0.5775230346753698
Energy: 0.5915028873260859

minimum gb energy = 0.5637652156230464 eV
minimum distance =  2.55502903326074 Angstroms
sigma value = 293


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

Energy: 0.5433982857491464
Energy: 0.56082714969641
Energy: 0.6097890042784551
Energy: 0.5620825574740406
Energy: 0.5480126874968794
Energy: 0.5439346149197654
Energy: 0.5611326266222895
Energy: 0.6091726189110225
Energy: 0.5638790069857191
Energy: 0.547393184201499
Energy: 0.5941961289494113
Energy: 0.5571769092832873
Energy: 0.5563768017758205
Energy: 0.5568480102756056
Energy: 0.5579332032608457
Energy: 0.5928223147526059
Energy: 0.5574268332062269
Energy: 0.5473171752745398
Energy: 0.5574343091971479
Energy: 0.5628014315117299
Energy: 0.5590138977738313
Energy: 0.5584334917459899
Energy: 0.5587464317475483
Energy: 0.5617538803825732
Energy: 0.5921718527111167
Energy: 0.5581690171823718
Energy: 0.5577908945668579
Energy: 0.5572916263389468
Energy: 0.6103292820707581
Energy: 0.6130971668549188
Energy: 0.6099904690194212
Energy: 0.5456285748811806
Energy: 0.5468712999994201
Energy: 0.5586806876948218
Energy: 0.5578824096333643
Energy: 0.6094658905365391
Energy: 0.5451363093881124
Energy: 0.547311769918818
Energy: 0.5581562157515917
Energy: 0.5465649556106692
Energy: 0.559232734661814
Energy: 0.5463640025260049
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Energy: 0.5576813822338099
Energy: 0.6111250954945916
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Energy: 0.558701680505299
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Energy: 0.5604837715699611
Energy: 0.5619802167161536
Energy: 0.6107071222358517
Energy: 0.5471442908361683
Energy: 0.5676889067771265
Energy: 0.557448721199214
Energy: 0.557379682645194
Energy: 0.5633094695979975
Energy: 0.5472456411584018
Energy: 0.5599260732168689
Energy: 0.5571503243478897
Energy: 0.5567758819978579
Energy: 0.5655157588604572
Energy: 0.5911198045928124
Energy: 0.5610576889700115
Energy: 0.5446300952991726
Energy: 0.5463455389153486
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Energy: 0.5465052800977153
Energy: 0.556920352183229
Energy: 0.5470575603190398
Energy: 0.5578644555890111
Energy: 0.5462733212766331
Energy: 0.5944897006925053
Energy: 0.556511478830918
Energy: 0.5558107905647471
Energy: 0.5566615985993677
Energy: 0.5456721002585643
Energy: 0.594913376056909
Energy: 0.560644237468709
Energy: 0.5585683084243793
Energy: 0.5928773636155269
Energy: 0.6117578169364757
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Energy: 0.5953930764855372
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Energy: 0.5589346390321339
Energy: 0.546011043933603
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Energy: 0.5470940187720105
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Energy: 0.5608709443279906
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Energy: 0.5620589504473561
Energy: 0.5480590302402044
Energy: 0.5440591957222493
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Energy: 0.6092082490559352
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Energy: 0.5473984348091168
Energy: 0.5942522876964492
Energy: 0.5570626412935302
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Energy: 0.5573931505294509
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Energy: 0.5587735992380997
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Energy: 0.6094350374533828
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Energy: 0.5455175928386249
Energy: 0.5468501669328039
Energy: 0.5596913170112958
Energy: 0.5583403093360997
Energy: 0.6094193904748224
Energy: 0.5452315325221652
Energy: 0.5472752910571045
Energy: 0.557961983735753
Energy: 0.5936148684347032
Energy: 0.5595552222587556
Energy: 0.5465429665437482
Energy: 0.5448400635557459
Energy: 0.5574669554146189
Energy: 0.5612142597308565
Energy: 0.5586293440970485
Energy: 0.5466322120590171
Energy: 0.5453761369405374
Energy: 0.5573024283571021
Energy: 0.5572672068057906
Energy: 0.5572890950169419
Energy: 0.6113620340765212
Energy: 0.5625550997079067
Energy: 0.5584578907129848
Energy: 0.5641538595341591
Energy: 0.5584539905296756
Energy: 0.6098845392002268
Energy: 0.5619176978753279
Energy: 0.560114264271106
Energy: 0.5621309170578883
Energy: 0.6101775390684852
Energy: 0.5481527850217212
Energy: 0.5831538152234035
Energy: 0.5575441087292409
Energy: 0.5578918770432946
Energy: 0.6099874519613395
Energy: 0.5473147515619472
Energy: 0.5593583558241724
Energy: 0.5574849664047897
Energy: 0.5565490012842687
Energy: 0.5583498441859355
Energy: 0.590941866708143
Energy: 0.5614972624820255
Energy: 0.54474744698805
Energy: 0.5463593658015603
Energy: 0.5575257337934754
Energy: 0.5930225576868281
Energy: 0.5602649545800511
Energy: 0.5444030103185212
Energy: 0.5467727157553374
Energy: 0.5568539061714971
Energy: 0.5470114871913312
Energy: 0.5580633203288453
Energy: 0.5463175137616528
Energy: 0.5941880202908818
Energy: 0.5566714256146704
Energy: 0.5558501520543047
Energy: 0.5568778926685729
Energy: 0.5457581280558176
Energy: 0.5577268062611807
Energy: 0.5600763373333679
Energy: 0.5583857656780065
Energy: 0.5928334955150403
Energy: 0.5942471236489038
Energy: 0.5620379062348624
Energy: 0.562910499900678
Energy: 0.5593861188332216
Energy: 0.5959544628461415
Energy: 0.5576444966211843
Energy: 0.5608098633774409
Energy: 0.5457693285741886
Energy: 0.5624917899035664
Energy: 0.5600508078268379
Energy: 0.5624391364948528
Energy: 0.5943676281288571
Energy: 0.5463252176136594
Energy: 0.5588984318648783
Energy: 0.5470516482650036
Energy: 0.6101849066946858
Energy: 0.5937265248575091

minimum gb energy = 0.5433982857491464 eV
minimum distance =  2.58424494891712 Angstroms
sigma value = 15


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

Energy: 0.9670976989230864
Energy: 0.6239219792724073
Energy: 0.609605134430533
Energy: 0.5759178625633513
Energy: 0.5620998627528485
Energy: 0.5598334321029015
Energy: 0.5816930538333953
Energy: 0.6170263069028861
Energy: 0.5822634637311637
Energy: 0.5850211147349381
Energy: 0.5693142645619014
Energy: 0.5801206501767171
Energy: 0.5898385086870287
Energy: 0.5906318951492598
Energy: 0.6159216491285032
Energy: 0.5488021576536648
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Energy: 0.6052578134359843
Energy: 0.6472413477219408
Energy: 0.6335940108866315
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Energy: 0.6125931709909284
Energy: 0.6505347363267715
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Energy: 0.6675023843908706
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Energy: 0.6086199316533357
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Energy: 0.577708643304505
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Energy: 0.6477169334825259
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Energy: 0.5698304828492358
Energy: 0.5589363020234766
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Energy: 0.5938190680576866
Energy: 0.5788019111450586
Energy: 0.5492410302200046
Energy: 0.5947289697295545
Energy: 0.627167093220735
Energy: 0.579323827155578
Energy: 0.6315115907860264
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Energy: 0.5860197936983534
Energy: 0.5995971922393064
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Energy: 0.6256930355907812
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Energy: 0.5864423031905847
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Energy: 0.5464375372083986
Energy: 0.6111929039326913
Energy: 0.5848179975866336
Energy: 0.5614075791543827
Energy: 0.6052151502507828
Energy: 0.6386629075449737
Energy: 0.6081683616121297
Energy: 0.5988566683175637
Energy: 0.5790777100927075
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Energy: 0.6432038068616343
Energy: 0.6152042029484054
Energy: 0.6188054119916994
Energy: 0.6635682282746825
Energy: 0.6425395194411226
Energy: 0.6385378425115412
Energy: 0.6404760773650541
Energy: 0.5986355875612689
Energy: 0.6757363842540492
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Energy: 0.6452119986538569
Energy: 0.6488960741873986
Energy: 0.598169645806484
Energy: 0.6138699214432852
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Energy: 0.6656790657384756
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Energy: 0.6677149016833247
Energy: 0.6701765809124605
Energy: 0.5749208084402258
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Energy: 0.6674856869141149
Energy: 0.6703536513258203
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Energy: 0.5853986164395577
Energy: 0.6293206942615316
Energy: 0.5662531900279979
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Energy: 0.5684943383927508
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Energy: 0.6494840727118915
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Energy: 0.6007979104870521
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Energy: 0.6110959776645757
Energy: 0.6110879172282072
Energy: 0.5739947797588286
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Energy: 0.5701742570214813
Energy: 0.6478163932676398
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Energy: 0.5752327371648778
Energy: 0.5491432185130048
Energy: 0.6130299079002175
Energy: 0.6477701798158774
Energy: 0.5992924145475503
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Energy: 0.5584978002736973
Energy: 0.6227307015234766
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Energy: 0.5872617496179976
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Energy: 0.5739994268400135
Energy: 0.5954268254464329
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Energy: 0.6140620181028335
Energy: 0.5993502889106508
Energy: 0.5798976211478731
Energy: 0.6023742925244348
Energy: 0.6388858564421306
Energy: 0.6102775713179469
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Energy: 0.6756570097405425
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Energy: 0.6438640509920058
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Energy: 0.5873716218417824
Energy: 0.6507253207603569
Energy: 0.6396115115011073
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Energy: 0.5774999709814322
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Energy: 0.5723520810937813
Energy: 0.6688028833998068
Energy: 0.6689177725572042
Energy: 0.6677396469440979
Energy: 0.6669001343948471
Energy: 0.5647725112812544
Energy: 0.5838388718751373
Energy: 0.6453098912117364
Energy: 0.5691911353163214
Energy: 0.5654075297655724
Energy: 0.5678536259429916
Energy: 0.5859157070713643
Energy: 0.6615163379441047
Energy: 0.5681514470305553
Energy: 0.5648118925784605
Energy: 0.5701129125884064
Energy: 0.5693415411353048
Energy: 0.6068542858690879
Energy: 0.6166690241313758
Energy: 0.5634321289494162
Energy: 0.5650048318319748
Energy: 0.5929501449433793
Energy: 0.6070873287600662
Energy: 0.5846268934161508
Energy: 0.5631590568553244
Energy: 0.5650693290300176
Energy: 0.6259088049053712
Energy: 0.5883782791511174
Energy: 0.5740783605528649
Energy: 0.5672899030363386
Energy: 0.601049860098377
Energy: 0.6467951068365786
Energy: 0.5764169455188829
Energy: 0.5663742620462335
Energy: 0.6189053510225234
Energy: 0.6170335901688315
Energy: 0.5642526253435486
Energy: 0.5627326287872745
Energy: 0.6020359063789189
Energy: 0.6763279856680227
Energy: 0.6001664620825339
Energy: 0.564845531416639
Energy: 0.5729689035087632
Energy: 0.6140595576549975
Energy: 0.6687066079145819
Energy: 0.5998601237698945
Energy: 0.5684743239493845
Energy: 0.569221443255176
Energy: 0.5650150329937235
Energy: 0.649925988002013
Energy: 0.5753974543764181
Energy: 0.5755232934102886
Energy: 0.5739121258996378
Energy: 0.5751392339050247
Energy: 0.6189380450955158
Energy: 0.5703276166149049
Energy: 0.5704094018107176
Energy: 0.5927692479965443
Energy: 0.6516469180962879
Energy: 0.6493442248294502
Energy: 0.6413417202746312
Energy: 0.5770548755761449
Energy: 0.610390793890973
Energy: 0.6507490523978219
Energy: 0.5847214241292098
Energy: 0.5718458403953997
Energy: 0.599920701981705
Energy: 0.6235124057087243
Energy: 0.5806575047027259
Energy: 0.5621237121527696
Energy: 0.5459498738414735
Energy: 0.5612225405006607
Energy: 0.607788791793393
Energy: 0.5807561274392429
Energy: 0.6294425613462475
Energy: 0.5537917857819457

minimum gb energy = 0.5459498738414735 eV
minimum distance =  2.54156415415436 Angstroms
sigma value = 437


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

Energy: 0.7418126396997459
Energy: 0.5338912838434965
Energy: 0.6045510866861199
Energy: 0.6114889489600622
Energy: 0.5324939030626357
Energy: 0.7412132744916324
Energy: 0.5342961064045222
Energy: 0.6044696942690632
Energy: 0.6552690074107702
Energy: 0.6262664102936936
Energy: 0.5749453367863911
Energy: 0.5930349527633222
Energy: 0.6174605267554664
Energy: 0.6195926828028298
Energy: 0.5977341458742422
Energy: 0.5805421045575402
Energy: 0.5934452592946855
Energy: 0.618094630428866
Energy: 0.6401925422902661
Energy: 0.5873679975158297
Energy: 0.5765989399367413
Energy: 0.5894244844092502
Energy: 0.5871760973153345
Energy: 0.5446632801463531
Energy: 0.5747052717212642
Energy: 0.5754910836345389
Energy: 0.5905339591302664
Energy: 0.5873921238798219
Energy: 0.5435575404456342
Energy: 0.5748527439940996
Energy: 0.5423465768338223
Energy: 0.544221048978296
Energy: 0.586594226321581
Energy: 0.5861053744843829
Energy: 0.5740972213116393
Energy: 0.5431932236985009
Energy: 0.5435765103103312
Energy: 0.5861380087929143
Energy: 0.5754959581216594
Energy: 0.5746036334578395
Energy: 0.5864339201769412
Energy: 0.5976335631897429
Energy: 0.5417046967922218
Energy: 0.5432814478646781
Energy: 0.5623659497311269
Energy: 0.5507574429142935
Energy: 0.5996119070326458
Energy: 0.5421088587091345
Energy: 0.5432812617980602
Energy: 0.5579614998627093
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Energy: 0.5424076583766619
Energy: 0.5748530988575734
Energy: 0.5860640643280841
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Energy: 0.5533158451772733
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Energy: 0.5745358384405472
Energy: 0.585556171318286
Energy: 0.7433025923953056
Energy: 0.5767031711896801
Energy: 0.5752730441890016
Energy: 0.5748540284748886
Energy: 0.5783016505589685
Energy: 0.5881986320379529
Energy: 0.5766269220619323
Energy: 0.5753016335070714
Energy: 0.5750045219377719
Energy: 0.5437174537583476
Energy: 0.5813870195010872
Energy: 0.5916364839184353
Energy: 0.5746091997439928
Energy: 0.5427528093725045
Energy: 0.6814854267970099
Energy: 0.639236977856273
Energy: 0.5902273775001103
Energy: 0.5745978140876711
Energy: 0.5430169208046393
Energy: 0.6828424702515488
Energy: 0.6381793264435248
Energy: 0.5416668466726691
Energy: 0.5888018157384782
Energy: 0.5299662681126096
Energy: 0.5873825233762521
Energy: 0.5432289975335058
Energy: 0.5413311590874131
Energy: 0.5878584575418471
Energy: 0.5338027985201472
Energy: 0.5879056272758014
Energy: 0.5425714121527074
Energy: 0.5573978385977715
Energy: 0.5412656592704801
Energy: 0.5321365547742047
Energy: 0.5312211325550718
Energy: 0.5968216173168438
Energy: 0.5852712041011189
Energy: 0.5423125954207146
Energy: 0.5329508474326654
Energy: 0.5311657146797929
Energy: 0.5983857399618634
Energy: 0.5287170842417498
Energy: 0.5276905838403315
Energy: 0.6419889261049277
Energy: 0.5558065211629044
Energy: 0.5291072507131586
Energy: 0.5285434341319931
Energy: 0.5275400563340844
Energy: 0.6429398763665108
Energy: 0.5561019094386986
Energy: 0.5448696952262514
Energy: 0.5299673096576504
Energy: 0.5307601287580419
Energy: 0.5302135413532463
Energy: 0.5869959146529425
Energy: 0.5299699399544021
Energy: 0.5299645882603724
Energy: 0.5323475142705841
Energy: 0.5345864089079201
Energy: 0.560815665255625
Energy: 0.5293633610098917
Energy: 0.5282000719736899
Energy: 0.5308996571079567
Energy: 0.6475900765943032
Energy: 0.5872268099007408
Energy: 0.5330775551143626
Energy: 0.5286132066876834
Energy: 0.5326035596140795
Energy: 0.6486868177097808
Energy: 0.5869875687521053
Energy: 0.534856318739897
Energy: 0.620797321007682
Energy: 0.5347902330163177
Energy: 0.6045600983886967
Energy: 0.5354807039953182
Energy: 0.5331775973620336
Energy: 0.6220841117050938
Energy: 0.5350039420697604
Energy: 0.6061779847108657
Energy: 0.5356299472154832
Energy: 0.5494527112350892

minimum gb energy = 0.5275400563340844 eV
minimum distance =  2.63057506483331 Angstroms
sigma value = 33