Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Pd__MO_993644691224_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.890355831384662
cohesive_energy=3.9103031467506324
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.24891270796934e-19, 1.9108199407737599e-19, 2.43051797554434e-19, 2.88507150837648e-19, 3.3047776994191197e-19, 3.6932574678650994e-19, 4.04490319549542e-19, 4.3576000091532e-19, 4.63407160911624e-19, 4.878499676399279e-19, 5.094777500222939e-19, 5.28612545562156e-19, 5.45515509050856e-19, 5.60412547393788e-19, 5.73494319610398e-19, 5.84925849893988e-19, 5.948401189051799e-19, 6.03338063771916e-19, 6.104821693829219e-19, 6.162932640344399e-19, 6.207745520797379e-19, 6.239452596384239e-19, 6.25827817183374e-19, 6.26449461717366e-19, 6.25776547531086e-19, 6.235975873088459e-19, 6.19672254555546e-19, 6.137025444172619e-19, 6.05012338354446e-19, 5.9302164842559e-19, 5.7712004533314e-19, 5.56576936531992e-19, 5.305095226968119e-19, 4.97823517186578e-19, 4.57142650272684e-19, 4.06702925481096e-19, 3.4420361716539e-19, 2.6661020278076996e-19, 1.6988679938618996e-19, 4.8665955040086594e-20, -1.041998004394776e-19, -2.98350924076944e-19, -5.4699111373077e-19, -8.686200621231e-19, -1.2896528554186919e-18, -1.8485433350101798e-18, -2.6030563772598e-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: 0.01594759039126348
Energy: 0.33746780074379795
Energy: 0.3372265616753057
Energy: 0.768464941974314
Energy: 0.7651527177500578
Energy: 0.2775103155529119
Energy: 0.01740290188783169
Energy: 0.09337642702525874
Energy: 0.634514533246842
Energy: 0.2176339378388619
Energy: 0.33690277686027886
Energy: 0.5796588060157661
Energy: 0.016919822442152222
Energy: 0.0947470245036965
Energy: 0.016884884025113542
Energy: 0.6351094514126641
Energy: 0.23636664978840582
Energy: 0.3368918501369923
Energy: 0.6360936067623444
Energy: 0.09311115098569177
Energy: 0.0946333875375578
Energy: 0.01866640049739349
Energy: 0.5814611142640311
Energy: 0.33852061857260357
Energy: 0.7703531370444637
Energy: 0.7676557313037683
Energy: 0.09351093496643656
Energy: 0.016937806553302046
Energy: 0.09335794070904932
Energy: 0.7690524066301918
Energy: 0.21731934130188243
Energy: 0.33678155579681973
Energy: 0.580169693534982
Energy: 0.01693713309601556
Energy: 0.09412830498007282
Energy: 0.016438917558552507
Energy: 0.6351889001570917
Energy: 0.3437549542107886
Energy: 0.3374087951412279
Energy: 0.6432416283369037
Energy: 0.09298710848145825
Energy: 0.09421003571969024

minimum gb energy = 0.01594759039126348 eV
minimum distance =  2.72759826557447 Angstroms
sigma value = 5


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

Energy: 1.066913095428113
Energy: 0.9246113695938294
Energy: 1.0864132252883458
Energy: 0.9964228593112182
Energy: 1.0336131001234046
Energy: 1.0086532733385605
Energy: 0.9242651631207921
Energy: 0.9298422414282104
Energy: 1.0155081105280275
Energy: 0.9250401270471436
Energy: 0.982729073677239
Energy: 0.9736314822998773
Energy: 0.9332934060426282
Energy: 1.0057711784871488
Energy: 0.9267956044398299
Energy: 1.0179573874784045
Energy: 1.0086993116306353
Energy: 0.9679970094369993
Energy: 0.9833685216848982
Energy: 1.0135733866863712
Energy: 1.0262226407078658
Energy: 0.9381486475278444
Energy: 1.0054959152253602
Energy: 0.9402551183058073
Energy: 0.9541501241094066
Energy: 0.9857504777016591
Energy: 0.9304595543571296
Energy: 0.9813256141513831
Energy: 1.07385324569674
Energy: 0.9822121246968856
Energy: 1.013940870291357
Energy: 0.9626313448681685
Energy: 1.0090518166327063
Energy: 1.045300730743059
Energy: 0.9827198445384036
Energy: 0.9718674483072348
Energy: 0.9941720198588172
Energy: 0.9343690718584239
Energy: 0.9339975025312477
Energy: 0.9559666823516926
Energy: 0.9702297096214583
Energy: 0.9721905961636174
Energy: 0.9243714955287086
Energy: 1.0243827997519406
Energy: 1.0546738298276548
Energy: 1.0233677281572562
Energy: 0.9761816048020906
Energy: 1.054530794264216
Energy: 1.0173929911839799
Energy: 0.9745498485843671
Energy: 0.974171020676177
Energy: 1.0082751211398489
Energy: 1.0198154424435077
Energy: 0.9315109100685522
Energy: 0.9299331473204948
Energy: 0.9847309798570743
Energy: 0.9487886699775689
Energy: 0.9662377972299236
Energy: 0.9567124236225849
Energy: 0.9675012397640774
Energy: 1.0289526385944676
Energy: 0.9809077689476994
Energy: 0.9357406762841952
Energy: 0.9408233475533312
Energy: 0.976306526533067
Energy: 0.9592213568304044
Energy: 0.9821191457718874
Energy: 0.9861811465840241
Energy: 1.0169526976243761
Energy: 0.9214783623215396
Energy: 0.9548928156919632
Energy: 0.9730725563832713
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Energy: 1.034735308259428
Energy: 1.0111187205117282
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Energy: 0.980641589199267
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Energy: 0.9795890423802429
Energy: 0.9929049512957291
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Energy: 0.945194500162834
Energy: 1.0093726922604105
Energy: 0.9524686163005597
Energy: 1.0347220648238273
Energy: 0.9826757916246744
Energy: 0.9584578990208148
Energy: 0.9634828782704995
Energy: 1.0341921802058092
Energy: 1.0472942031582486
Energy: 1.0107890545885616
Energy: 1.0325466676570552
Energy: 1.0396589306667618
Energy: 1.0495777022138126
Energy: 1.0556100406417919
Energy: 0.9297811016728923
Energy: 0.9478831717621202
Energy: 0.9456539611307979
Energy: 0.9632353295133441
Energy: 1.0239724146814202
Energy: 0.968804651942234
Energy: 0.9647163743220637
Energy: 0.9414101703319332
Energy: 1.0067671606404835
Energy: 0.92795598679113
Energy: 1.0169441368587557
Energy: 0.978465022846721
Energy: 0.9847399524755648
Energy: 0.9847213140053095
Energy: 0.9889364323514493
Energy: 0.9535762082038771
Energy: 0.9521198235284741
Energy: 0.9840528739465707
Energy: 1.0079416854471879
Energy: 0.9718447105430182
Energy: 1.004641791384679
Energy: 0.930710317034116
Energy: 0.962900413539602
Energy: 1.0007111918381113
Energy: 1.0145120679708064
Energy: 0.9781351234733812
Energy: 1.1123962072005489
Energy: 1.0327991295142107
Energy: 0.9616436414928885
Energy: 0.9869125676728373
Energy: 0.9303574136480878
Energy: 0.9590153952607902
Energy: 0.9766003007757755
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Energy: 0.9522041246683082
Energy: 1.0438113206569832
Energy: 0.9686382125248945
Energy: 1.0507738142473297
Energy: 1.0268240341515138
Energy: 1.0187488231345603
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Energy: 0.9710349040322969
Energy: 0.9547156972269043
Energy: 0.9811658367105129
Energy: 0.9441920325112394
Energy: 0.9374760150944972
Energy: 0.9963275388441689
Energy: 0.985804157982501
Energy: 0.9916671165971558
Energy: 1.119354553376593
Energy: 0.9726742323761647
Energy: 1.0205539593598876
Energy: 1.0208939275017728
Energy: 1.0297405271659013
Energy: 1.028280426762515
Energy: 0.9963270537997558
Energy: 0.9547856026011088
Energy: 0.9262550638390779
Energy: 0.926839062187782
Energy: 0.9488585486729185
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Energy: 0.9227590563472214
Energy: 0.9288413585309792
Energy: 1.0281506225703414
Energy: 0.9795075750023187
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Energy: 1.0097475046231785
Energy: 1.0307914088993
Energy: 1.0072244425634667
Energy: 0.9839409273938171
Energy: 0.9280601935569621
Energy: 0.9237223621841707
Energy: 0.9407480848450097
Energy: 0.9262324850028164
Energy: 0.941080162257605
Energy: 0.9594753417748774
Energy: 0.9652674157976128
Energy: 0.9733156137901171
Energy: 1.0085859810374824
Energy: 0.9896923974013438
Energy: 0.9689104117820786
Energy: 0.9755974272296002
Energy: 1.0640502568157213
Energy: 0.9893156275007791
Energy: 0.9276802569458288
Energy: 1.0211065815811602
Energy: 0.9381654071060239
Energy: 0.959355702713325
Energy: 0.9564733538890159
Energy: 0.9313218445156038
Energy: 0.9934181104194988
Energy: 0.9683620274450182
Energy: 0.9768179892170104
Energy: 1.0146601242687148
Energy: 0.9627503168104934
Energy: 0.9504961683645797
Energy: 1.0076061740487943
Energy: 0.9817752720634692
Energy: 0.9675534752177724
Energy: 0.9749475872885189
Energy: 1.0149816203313358
Energy: 0.9340572576718987
Energy: 0.9509522092222412
Energy: 0.971730276653465
Energy: 0.9715056235593224
Energy: 0.9379716775419815
Energy: 1.0267180998478396
Energy: 0.9373138754646245
Energy: 0.9573406512894693
Energy: 0.9786733833898993
Energy: 0.9413065944684564
Energy: 1.0254555847837448
Energy: 0.9915005987532092
Energy: 1.0068574358746407
Energy: 1.000447927783973
Energy: 1.0096019856196938
Energy: 0.9289834490978744
Energy: 0.955808481319067
Energy: 0.963718098625433
Energy: 0.9444582659052599
Energy: 0.9883437946178625
Energy: 0.9734493400193542
Energy: 0.9738892378163505
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Energy: 0.9824856092326544
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Energy: 0.9448429967384376
Energy: 0.9709536555164855
Energy: 1.051949841330893
Energy: 1.021095122647538
Energy: 0.9971723194990849
Energy: 1.0268702645923196
Energy: 0.9394977711188242
Energy: 0.9516889825182959
Energy: 0.975458746495967
Energy: 0.9232349013076914
Energy: 0.9829577035313566
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Energy: 0.941839823832533
Energy: 0.9596059662989241
Energy: 1.0118431447800742
Energy: 0.9372430985890965
Energy: 1.0201360424457337
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Energy: 0.9798807273508259
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Energy: 1.0432180200042633
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Energy: 1.0142818604782746
Energy: 1.0670187712421528
Energy: 0.9362564100809061
Energy: 1.0205581720619241
Energy: 1.0584435743682334
Energy: 1.0330713997084109
Energy: 0.9644025256942247
Energy: 0.9539035200663425
Energy: 0.9421907046570909
Energy: 0.9479436743915325
Energy: 0.9411186135053389
Energy: 0.9939743309584265
Energy: 0.9797785104723927
Energy: 0.9710527740239305
Energy: 0.9731394732227587
Energy: 0.9713274900396088
Energy: 1.0163032257215616
Energy: 1.0643818861504113
Energy: 0.9471928869529955
Energy: 1.0037513026273728
Energy: 1.0462176698800696
Energy: 0.9624382439943082
Energy: 0.9871968011005566
Energy: 0.9347659363157712
Energy: 0.9931520138547492
Energy: 0.987216735736576
Energy: 1.0075387794088633
Energy: 0.9706032556365595
Energy: 0.98729836324631
Energy: 0.9284744315674063
Energy: 1.0019246446108199
Energy: 1.0072281235342342
Energy: 1.0319336815074989
Energy: 0.9517456409907871
Energy: 1.0717969249601251
Energy: 0.9793444758168938
Energy: 0.9329441667952001
Energy: 0.986475393109948
Energy: 0.9223430442280472
Energy: 0.9298991878135672
Energy: 0.9662718921881479
Energy: 0.9441698052031461
Energy: 0.9928331632093825
Energy: 1.0698740253394512
Energy: 0.9355567181209861
Energy: 1.020951677298383
Energy: 1.027350715942405
Energy: 1.0209546293574498
Energy: 0.9924542606389966
Energy: 0.9994141958340851
Energy: 0.9512624420534321
Energy: 1.045925063453132
Energy: 0.9258093870215643
Energy: 0.999562307572944
Energy: 0.9764135784889311
Energy: 0.9637337811136968
Energy: 0.9925442018793934
Energy: 0.9269640842460644
Energy: 1.0415728829963327
Energy: 1.033083726405164
Energy: 1.0257203572710647
Energy: 0.9911103537038886
Energy: 0.9662690224467757
Energy: 0.9995105983251266
Energy: 0.9578366048032274
Energy: 0.9267254677643835
Energy: 0.9285302397581126
Energy: 0.9628839789374597
Energy: 0.9424329272257805
Energy: 0.9259118303992173
Energy: 0.9314453413429195
Energy: 0.9993833789034849
Energy: 1.0161125911521434
Energy: 1.0351405951323396
Energy: 0.98725624847751
Energy: 1.0205389907278397
Energy: 1.008366718814683
Energy: 0.9219720502513508

minimum gb energy = 0.9214783623215396 eV
minimum distance =  2.47425436592601 Angstroms
sigma value = 401


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

Energy: 1.1217738695089905
Energy: 0.9465566174837348
Energy: 0.9721397989782967
Energy: 0.9585753318068679
Energy: 0.9786089241125391
Energy: 0.9939920714902266
Energy: 0.9448468608889914
Energy: 0.9479658860653278
Energy: 0.9464063460718158
Energy: 0.9392713668189551
Energy: 0.9372842461433258
Energy: 0.9807040160856046
Energy: 1.0879225292809134
Energy: 0.9913315040652627
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Energy: 0.961993147054129
Energy: 0.9552773414870834
Energy: 1.003702174094967
Energy: 1.048096050352041
Energy: 1.016135108527578
Energy: 1.0656665256014155
Energy: 0.9925106212029547
Energy: 0.9446054776703371
Energy: 0.9378807527347374
Energy: 0.9711515486735468
Energy: 0.9627673705870049
Energy: 0.9925839523421037
Energy: 1.0519005175496126
Energy: 0.9708269234367244
Energy: 0.938467151798301
Energy: 0.9571326398526456
Energy: 0.9361166845406549
Energy: 0.9291332299776445
Energy: 1.028368287612502
Energy: 1.06163202738921
Energy: 1.003656309781408
Energy: 0.9520252150180899
Energy: 0.95675805497619
Energy: 0.9571639516376668
Energy: 0.9582693718233678
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Energy: 1.0024983685353972
Energy: 1.0099312119782529
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Energy: 0.9810900579220148
Energy: 0.9539778769045262
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Energy: 1.0468577513071868
Energy: 0.9566919057683915
Energy: 0.9725068752358681
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Energy: 0.9376910494965625
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Energy: 1.0143452053099709
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Energy: 1.0075679135018387
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Energy: 0.9622555265791254
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Energy: 0.9655615297917169
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Energy: 0.963898033461611
Energy: 0.9550248036586687
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Energy: 0.9508299073808644
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Energy: 0.971706619094038
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Energy: 0.9426947132218542
Energy: 0.956047820272343
Energy: 0.9824122990802573
Energy: 0.9504244718524414
Energy: 0.9853838465116059
Energy: 0.9687341847947285
Energy: 0.9514836122618696
Energy: 0.9479930217728582
Energy: 0.9861931672441695
Energy: 0.963797310949188
Energy: 0.9875180297524575
Energy: 0.9292051390665385
Energy: 1.0188250686695206
Energy: 0.9516572122150347
Energy: 0.9532170785821178
Energy: 1.0026361362233909
Energy: 0.9638380666776977
Energy: 0.9503386896804249
Energy: 1.0265797896308682
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Energy: 1.0500733674746094
Energy: 1.0738541847413883
Energy: 1.0122242094443061
Energy: 0.9553134182531371
Energy: 0.9419397521624191
Energy: 0.9394267044089964
Energy: 0.9866066245715832
Energy: 1.0130408450710295
Energy: 1.0607204299590176
Energy: 0.977237816679143
Energy: 0.9456549272195172
Energy: 0.9480835427832277
Energy: 0.9309022396401704
Energy: 0.9465535105182519
Energy: 1.0344654612376374
Energy: 1.0111242687030653
Energy: 0.9567180231981223
Energy: 0.9445061773288485
Energy: 0.9430865675484383
Energy: 0.9282649024629169
Energy: 0.9626799093633949
Energy: 1.0413483884184227
Energy: 1.0668441995105442
Energy: 0.9921417957548563
Energy: 0.9462051001338063
Energy: 0.9377700519242268
Energy: 0.9412666845901622
Energy: 1.0022020945245202
Energy: 1.014325673470513
Energy: 0.942817120970651
Energy: 0.9795384196545414
Energy: 0.9623926387119733
Energy: 0.9443635287495463
Energy: 0.9484168703367257
Energy: 1.0561457217002719
Energy: 1.0015990207676482
Energy: 0.9546798356119597
Energy: 0.9904621461247239
Energy: 0.9618859708364677
Energy: 0.9872545148467636
Energy: 0.9486032439283958
Energy: 0.9404814584656891
Energy: 0.9396089044121475
Energy: 0.9418343680632483
Energy: 0.9422594839195018
Energy: 0.9730742841353536
Energy: 0.9528335067607858
Energy: 0.9416021514759207
Energy: 0.9649562141446614
Energy: 0.9504288801253311
Energy: 0.9446899831631922
Energy: 0.9420071594942394
Energy: 0.9806137924823162
Energy: 0.9675737489813773
Energy: 1.0478329867049476
Energy: 0.972252265576731
Energy: 1.0072204525668353
Energy: 0.9493130173827615
Energy: 0.9451745800544328
Energy: 0.9620948596011746
Energy: 0.9481454770681224
Energy: 0.9268800744289647
Energy: 1.0146018751654966
Energy: 0.9500627041982326
Energy: 1.1902139380050356
Energy: 1.0057106777339042
Energy: 0.9373534592432727
Energy: 0.9679282600031957
Energy: 0.9544562564354128
Energy: 0.9584015903856666
Energy: 1.0621860893116752
Energy: 0.9589991933323793
Energy: 0.9732720901774496
Energy: 0.9802207444350473
Energy: 0.9408286670819216
Energy: 0.9513321690216758
Energy: 0.9891733868130229
Energy: 1.0188743821079154
Energy: 1.1011196011511377
Energy: 0.9891592483920898
Energy: 1.0227948724038263
Energy: 0.9626241657744297
Energy: 0.9296012876370597
Energy: 0.9687053746339584
Energy: 1.009167296378541
Energy: 0.9620537084009246
Energy: 0.98208329132644
Energy: 0.943879961703722
Energy: 0.9501262374122107
Energy: 0.9352822319532959
Energy: 0.9617249431988049
Energy: 1.0556751839785914
Energy: 0.9575889711034559
Energy: 0.9976897345799473
Energy: 0.93821362731614
Energy: 0.9626004970528859
Energy: 0.9425996296729824
Energy: 0.9486599415244946
Energy: 1.019547697834141
Energy: 0.9983841745618965
Energy: 0.971994913488935
Energy: 1.0279941153140102
Energy: 0.9787492220505485
Energy: 0.9712304026736145
Energy: 1.0123705435647874
Energy: 0.9675604687799654
Energy: 0.9466726778702108
Energy: 0.9706650708780069
Energy: 0.9604089466192451
Energy: 0.9882481321090356
Energy: 0.994704330085476
Energy: 1.0071858034403895
Energy: 0.9882354591428245
Energy: 0.953765687799495
Energy: 0.9655541257942974
Energy: 0.9575539693274345
Energy: 0.9370257277495636
Energy: 0.9608509965326607
Energy: 0.9810137543874522
Energy: 0.9749937926197194

minimum gb energy = 0.9268800744289647 eV
minimum distance =  2.45457254338889 Angstroms
sigma value = 311


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

Energy: 0.9747072618812045
Energy: 0.9670172010992244
Energy: 1.0205384640094946
Energy: 0.9791703577347235
Energy: 0.9956235630105801
Energy: 0.9714318067451432
Energy: 0.9549274213303626
Energy: 0.9959093174918495
Energy: 0.9841602981403214
Energy: 0.9580684448516489
Energy: 0.9725810485607989
Energy: 0.9866613747339799
Energy: 0.983178375882274
Energy: 1.0172463561088607
Energy: 0.9448417995237314
Energy: 0.9598030066259265
Energy: 0.9726790418786928
Energy: 1.0017755275461062
Energy: 0.9596078496423507
Energy: 0.9493305606939173
Energy: 0.9630253481762602
Energy: 0.9582445367981824
Energy: 0.9670497656381648
Energy: 0.9847032466778843
Energy: 0.9706445743839272
Energy: 0.9950760203097201
Energy: 0.998050859763999
Energy: 0.9810932538289366
Energy: 0.9804312711431831
Energy: 0.9808066515273032
Energy: 0.9815487197681714
Energy: 0.9554782219409285
Energy: 0.9930045430260492
Energy: 0.9862253101714639
Energy: 1.003030900829293
Energy: 0.9550984529388511
Energy: 0.930937239321064
Energy: 0.9789002410763065
Energy: 0.9495982273990422
Energy: 0.9654565913126766
Energy: 0.9516331134779038
Energy: 0.9777913873033679
Energy: 0.9540077232523668
Energy: 0.9465647907498989
Energy: 1.046137812589836
Energy: 0.9160693233511026
Energy: 0.9521511858888195
Energy: 0.9767412762515557
Energy: 0.9431236918085362
Energy: 0.979740726190302
Energy: 0.9703789379424305
Energy: 0.9811353397454518
Energy: 1.0107341697041567
Energy: 0.982666051187984
Energy: 0.9676545953012204
Energy: 1.0069946389808753
Energy: 0.972634541949991
Energy: 0.9784299169953354
Energy: 0.9514927626055498
Energy: 0.9303575304189374
Energy: 0.9794917664036958
Energy: 0.9845351289918701
Energy: 0.9736881797093299
Energy: 0.9535437155259178
Energy: 1.0105802904929329
Energy: 0.9621489056059078
Energy: 1.0390609362440058
Energy: 0.9834363886195971
Energy: 0.965119618150236
Energy: 0.9574275414874894
Energy: 0.9788413822006258
Energy: 0.9822907488344998
Energy: 0.9693891298198871
Energy: 0.9854601560934787
Energy: 0.9638557118074358
Energy: 0.9962371859181451
Energy: 0.9768746796580787
Energy: 0.9702006772635962
Energy: 0.9826623088572388
Energy: 0.9576662970907003
Energy: 0.9660549720165386
Energy: 0.9694135098895117
Energy: 0.958694958079139
Energy: 0.9772574218791916
Energy: 0.9842006645187416
Energy: 0.9547736844426495
Energy: 1.0025838031695788
Energy: 0.9549057679103784
Energy: 1.0252467311077984
Energy: 0.9897112763526829
Energy: 1.022448873005926
Energy: 1.0030218583756016
Energy: 1.0213641507862703
Energy: 1.0143629667091372
Energy: 1.0330060151468403
Energy: 1.0895689334758367
Energy: 1.0231907428568836
Energy: 1.0754969262485967
Energy: 0.9400206620626983
Energy: 0.9756291926532182
Energy: 0.9635774315087893
Energy: 0.963628292001039
Energy: 0.9743223174307297
Energy: 0.9478369147722282
Energy: 0.9834505683642839
Energy: 0.9634233852789581
Energy: 0.9827972376403318
Energy: 0.9626481485581366
Energy: 0.9382599116447067
Energy: 0.9998276642743932
Energy: 0.934702538071482
Energy: 0.981343702682086
Energy: 0.97931146922828
Energy: 0.9633700898794427
Energy: 0.9691562491912121
Energy: 1.0061032921613096
Energy: 0.9823815887757003
Energy: 0.9635021340799846
Energy: 0.9582713900224156
Energy: 0.9496400849066985
Energy: 0.9746361478501004
Energy: 0.9630800982634407
Energy: 0.9593402583125287
Energy: 0.981838938324617
Energy: 0.946634608666188
Energy: 0.972186902474148
Energy: 0.9965720829402173
Energy: 0.9867798837141992
Energy: 0.9550890522352811
Energy: 0.9786296607152883
Energy: 0.9648327438889411
Energy: 1.010844688049959
Energy: 1.0170790309576405
Energy: 1.0515483444464602
Energy: 1.0234304219312484
Energy: 0.9767482242559933
Energy: 1.0267442448156432
Energy: 1.0932562173715645
Energy: 1.0125015040310854
Energy: 1.0409473506399858
Energy: 0.9961513317774144
Energy: 1.0050443842244592
Energy: 0.9923349713777221
Energy: 0.9547467089064051
Energy: 0.9577191106948328
Energy: 0.9629463676019311
Energy: 0.9392013319383011
Energy: 0.9760861749371084
Energy: 1.001127762405164
Energy: 0.9774081607884164
Energy: 0.9698023068797469
Energy: 0.9675345515878417
Energy: 0.9508167236623629
Energy: 0.9740840635071055
Energy: 0.970190063702237
Energy: 0.9723041035265199
Energy: 0.9987046689026204
Energy: 1.039478902128366
Energy: 0.9912718208403901
Energy: 0.9935187846657608
Energy: 1.0004181982065716
Energy: 0.9958118310946283
Energy: 0.9973189050549944
Energy: 0.9725136897968528
Energy: 0.950935520397127
Energy: 0.9920493949056907
Energy: 0.9451890822059771
Energy: 0.9820138327626945
Energy: 1.012800049033245
Energy: 0.9521425048919749
Energy: 1.0359413343908634
Energy: 0.9424792693602991
Energy: 0.9759162975718625
Energy: 0.9787966490071072
Energy: 1.0155934632354615
Energy: 1.0119966901184327
Energy: 0.9870604927993148
Energy: 1.0037916540506902
Energy: 1.0328659875976276
Energy: 1.0608832851133694
Energy: 1.0628868376316492
Energy: 1.0369880825503754
Energy: 0.9706445651082153
Energy: 1.0163946830762447
Energy: 0.9917544728036778
Energy: 0.9737409100563427
Energy: 0.9793447247997676
Energy: 0.9499095463495251
Energy: 0.9930108698358993
Energy: 0.9931611599554949
Energy: 0.9751659921288501
Energy: 0.9734915660478399
Energy: 0.9716926933538078
Energy: 0.9850390658697687
Energy: 0.9382117564907035
Energy: 1.0003523609197331
Energy: 0.9817919358623607
Energy: 0.9611654302558732
Energy: 0.9903709110726885
Energy: 0.9819434237536264
Energy: 0.9816055156906165
Energy: 0.9734631761700618
Energy: 0.9861344625975302
Energy: 0.9585362063899634
Energy: 0.9784006335598017
Energy: 0.9980970139258815
Energy: 1.0053791544216784
Energy: 0.9589249337773504
Energy: 0.9790040839277406
Energy: 0.9988086442304238
Energy: 1.0013622709294476
Energy: 0.9845254790468928
Energy: 0.9602879556437357
Energy: 1.0020830199164157
Energy: 0.9735501260243002
Energy: 0.9416138805058555
Energy: 0.9815144890581766
Energy: 1.0190358773299955
Energy: 1.0105002147205098
Energy: 0.9813593631481369
Energy: 1.0744689392637936
Energy: 1.0674402061775843
Energy: 0.9689821859677311
Energy: 1.0010943192414863
Energy: 0.9869693751094136
Energy: 0.9461093064150163
Energy: 0.9977981199109102
Energy: 0.9761409771740122
Energy: 0.9952739541218907
Energy: 0.9849760808745657
Energy: 1.009309899885934
Energy: 0.9819388570493301
Energy: 0.9624656379428799
Energy: 0.9626528651920216
Energy: 0.9657065590245759
Energy: 0.9829617450992406
Energy: 0.9862209889667761
Energy: 0.995630734605683
Energy: 0.9887293473099841
Energy: 0.961811554699611
Energy: 0.9760060352910833
Energy: 0.968650017933542
Energy: 0.9890388271533057
Energy: 0.9912920000530836
Energy: 0.9915626823775713
Energy: 0.9806131374494553
Energy: 1.0098762043864633
Energy: 1.0156874653391408
Energy: 0.9803987151422378
Energy: 0.9840022085837183
Energy: 0.9509873957728151
Energy: 0.9782055281968461

minimum gb energy = 0.9160693233511026 eV
minimum distance =  2.47318540349273 Angstroms
sigma value = 39


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

Energy: 0.8986532209189066
Energy: 1.0195812184437523
Energy: 1.250303634312307
Energy: 1.1065820384013505
Energy: 0.9889825888408768
Energy: 1.0407220662271959
Energy: 0.8812091274722764
Energy: 0.9250295617020472
Energy: 0.9715220768160804
Energy: 1.0432304524546578
Energy: 1.025634809058967
Energy: 0.9571188695453338
Energy: 0.9610880403514818
Energy: 0.9664295034749166
Energy: 0.9609485720880903
Energy: 0.9413199287594726
Energy: 0.9452784447459233
Energy: 1.0049363054277807
Energy: 0.958512838561433
Energy: 0.9569052917815263
Energy: 0.9573930394367045
Energy: 0.9655035121363494
Energy: 0.9403249542877142
Energy: 1.0512331520968128
Energy: 0.9568733451287224
Energy: 1.0161436355282094
Energy: 0.9509673073968209
Energy: 1.0847037985024406
Energy: 0.9623148055717959
Energy: 0.9546852452149774
Energy: 1.024686764799599
Energy: 0.9467249033430033
Energy: 1.0360170023885062
Energy: 0.9541672622609834
Energy: 0.9577947457297998
Energy: 0.8806406659767684
Energy: 0.9567588007164101
Energy: 0.945764382825135
Energy: 0.9397890675524937
Energy: 0.974933073593367
Energy: 0.9567103638140809
Energy: 0.9883023951738932
Energy: 0.9659477554643382
Energy: 0.9638236551573235
Energy: 0.9444033636403637
Energy: 1.2197592995504625
Energy: 0.8809168830542263
Energy: 0.8828208905225003
Energy: 0.9660082687013504
Energy: 0.8810626538357661
Energy: 0.9718503920947344
Energy: 1.043918959151601
Energy: 0.9423621970783469
Energy: 1.0435535483722709
Energy: 0.9452471517949277
Energy: 0.9600854668891248
Energy: 0.8812453958453332
Energy: 0.972226859700755
Energy: 1.0444457819276245
Energy: 0.9411476904778826
Energy: 0.9541089613718027
Energy: 0.9455863674451608
Energy: 0.9637869160955423
Energy: 0.965934287991544
Energy: 0.9642667824287078
Energy: 1.046401822333444
Energy: 1.0020871129689934
Energy: 0.9549324741124603
Energy: 0.9576872381792086
Energy: 0.9575091728876997
Energy: 0.966721285195735
Energy: 0.9427343891604072
Energy: 0.9608344844307094
Energy: 0.9409122535114126
Energy: 0.9555992174233867
Energy: 0.9618686274910425
Energy: 1.0201317417785607
Energy: 0.9746763510028712
Energy: 0.9557423709467889
Energy: 0.9391064019646493
Energy: 0.9414482950906617
Energy: 1.0259559356198273
Energy: 0.9477834381419638
Energy: 0.9611976117188762
Energy: 0.881962635284524
Energy: 0.9552044266656482
Energy: 1.0444033392743781
Energy: 0.9515529349537589
Energy: 1.0228634306693036
Energy: 0.9485984900358456
Energy: 0.9575004315945038
Energy: 0.9652855005439835
Energy: 0.9421807005361296
Energy: 0.9443933790335608
Energy: 1.0163540446106876
Energy: 0.8811188583215925
Energy: 0.883089669693667
Energy: 0.9658256081478542
Energy: 0.8803794751770894
Energy: 0.9621883101210796
Energy: 0.944769623334436
Energy: 1.013487530525655
Energy: 0.8808689404930905
Energy: 0.8809874860076211
Energy: 0.9672951502044682
Energy: 0.8809677482260304
Energy: 0.9619288770697518
Energy: 0.9818470743576246
Energy: 0.950245483669632
Energy: 0.9979339147433967
Energy: 1.0409888471669955
Energy: 0.8814401099636885
Energy: 0.9614594605408479
Energy: 0.971573810701356
Energy: 1.0409861399881986
Energy: 1.026406692598187
Energy: 0.9570106156644695
Energy: 0.9588514026084841
Energy: 0.9663022177640618
Energy: 0.9587753229501198
Energy: 0.9413345508588741
Energy: 0.94499063089033
Energy: 1.055979235416218
Energy: 1.0041185494984541
Energy: 0.95720645705966
Energy: 0.9573431073206774
Energy: 0.9654646033643718
Energy: 0.9427062162397927
Energy: 1.0507639846057273
Energy: 0.9569073797922701
Energy: 1.0237976629195593
Energy: 1.046291301104031
Energy: 1.0837272957008752
Energy: 0.9629045233242689
Energy: 0.9544332426989924
Energy: 1.0246952043015958
Energy: 0.9460989922859662
Energy: 1.000340418277878
Energy: 0.9532992890672173
Energy: 0.9577286895777897
Energy: 0.8806222673527658
Energy: 0.9568074419619311
Energy: 0.9450409326534307
Energy: 0.9403841508425118
Energy: 0.9751273781968812
Energy: 0.8807888053522236
Energy: 0.986972879286669
Energy: 0.9656668662028648
Energy: 0.9631721560499972
Energy: 0.9441644968005419
Energy: 1.0337609566542538
Energy: 0.8808968633945591
Energy: 0.882904771835866
Energy: 0.9658715863894229
Energy: 0.8808907614258827
Energy: 0.9717858084762557
Energy: 1.0437319202969164
Energy: 0.9421052664710512
Energy: 1.0427320336359398
Energy: 0.9553453827597933
Energy: 0.9566521118848575
Energy: 0.8812952359433375
Energy: 0.9720481348045804
Energy: 1.0229403030436874
Energy: 0.9428654057713118
Energy: 0.9540209898470057
Energy: 0.9468466088415148
Energy: 0.9639939557589915
Energy: 0.9660454898878731
Energy: 0.9650873303652633
Energy: 0.9513716614655424
Energy: 1.0033539832226956
Energy: 0.9557387775161271
Energy: 0.9573119277467452
Energy: 0.9576159568220567
Energy: 0.9672456923056648
Energy: 0.9428901371352756
Energy: 0.9588881892627077
Energy: 0.9410033082309024
Energy: 0.9551790573823765
Energy: 0.9461941138752104
Energy: 1.0192536758030548
Energy: 0.974577235494946
Energy: 0.9557423824561218
Energy: 0.9387611214109196
Energy: 0.9416964936420219
Energy: 1.01350672113672
Energy: 0.9477533278710126
Energy: 0.9610721677255578
Energy: 0.8823111078212591
Energy: 0.9549223699704327
Energy: 1.0442339272437042
Energy: 0.951654756748588
Energy: 1.0232800899240873
Energy: 0.9490621413314302
Energy: 0.9577877107882073
Energy: 0.9653900620266485
Energy: 0.9426931167357282
Energy: 0.9442293002682017
Energy: 1.0254539328163266
Energy: 0.8808759541319104
Energy: 0.8827240893095069
Energy: 0.9658917147822865
Energy: 0.8802912331283382
Energy: 0.9620216066865974
Energy: 0.944969094435712
Energy: 0.9402323851740382
Energy: 0.8808211103857415
Energy: 0.8807796379747527
Energy: 0.9673807526261159

minimum gb energy = 0.8802912331283382 eV
minimum distance =  2.52993250185807 Angstroms
sigma value = 21


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

Energy: 1.1513236610267217
Energy: 0.9244217323884235
Energy: 0.9447051889170653
Energy: 1.273031373446797
Energy: 0.9225743845093605
Energy: 0.9232947368017781
Energy: 0.885997317888987
Energy: 0.952219978301515
Energy: 0.8790614904208567
Energy: 0.9882380110427749
Energy: 0.9648888301189044
Energy: 0.8743089596294773
Energy: 0.9357895914392194
Energy: 0.9425864432794253
Energy: 0.9237320292477111
Energy: 0.9339688066925055
Energy: 0.9787527981991431
Energy: 0.9724467292254388
Energy: 0.9156189180970545
Energy: 0.9355623125925069
Energy: 0.9519308255262908
Energy: 1.0365593680992449
Energy: 0.8842172270826345
Energy: 0.9528154144942641
Energy: 0.9648027289157695
Energy: 0.8987636913105848
Energy: 0.9858895291401385
Energy: 0.9452102716639045
Energy: 0.9152772306860555
Energy: 0.8750911465035394
Energy: 0.9555444890414536
Energy: 0.9124784121643958
Energy: 0.8846307778058958
Energy: 0.9509678591692323
Energy: 0.9455085950062134
Energy: 0.8870373760984787
Energy: 0.8866906820291794
Energy: 0.9637779562702027
Energy: 0.9102963855571221
Energy: 0.9428541381445835
Energy: 0.9408516169878028
Energy: 0.9405212838195195
Energy: 0.9571235457178522
Energy: 0.9078008301113043
Energy: 0.9238788895477176
Energy: 0.9354352153734321
Energy: 0.886462404885142
Energy: 0.8868964646556423
Energy: 0.9423323690398261
Energy: 0.9220915201206048
Energy: 0.9151514877887533
Energy: 0.9799197044942323
Energy: 0.9832692231931892
Energy: 0.9351237400473346
Energy: 0.9145056752541428
Energy: 0.9458188980422145
Energy: 0.9324549466313193
Energy: 0.9124215834509033
Energy: 0.9814141453464582
Energy: 0.9654916161982834
Energy: 0.8840341176927751
Energy: 0.9464342290823472
Energy: 0.9409881285379726
Energy: 0.9334771997758982
Energy: 1.000795059522466
Energy: 1.0827932815168435
Energy: 0.9585849863487772
Energy: 0.9240523661620141
Energy: 0.9239104715011902
Energy: 0.9149481254026353
Energy: 0.9219324110038801
Energy: 0.9639290858018644
Energy: 0.9474761593109245
Energy: 1.031954944123004
Energy: 0.8926549639890992
Energy: 0.8859828693500061
Energy: 0.9419926909241193
Energy: 0.9233536004138373
Energy: 0.9650020720906364
Energy: 0.9535094404317211
Energy: 0.9823256287766352
Energy: 0.8859022926794955
Energy: 0.8857824815806208
Energy: 1.079697169058179
Energy: 0.8856070616375897
Energy: 0.9321416293882947
Energy: 1.0745868088487014
Energy: 0.9691060994828209
Energy: 0.9039939811249251
Energy: 0.9348293764204335
Energy: 0.8867943211022525
Energy: 0.8856461801177907
Energy: 1.012661502710205
Energy: 0.9868927634909437
Energy: 1.0029404717361936
Energy: 0.9507630362549031
Energy: 0.971785629889471
Energy: 0.923691761602103
Energy: 0.9232748872075104
Energy: 0.8787674150083771
Energy: 0.9553491937188198
Energy: 0.9359979321706855
Energy: 0.9139592337775754
Energy: 0.9355773031094508
Energy: 1.0820094357192562
Energy: 0.9828628375959068
Energy: 0.9811890509483916
Energy: 0.9827550005159738
Energy: 0.960026356096524
Energy: 0.9524922609814845
Energy: 0.9813762152042704
Energy: 0.9518369976405645
Energy: 0.9146338249578766
Energy: 0.9439732886599208
Energy: 0.9540183340720877
Energy: 0.9121584812164915
Energy: 0.9215381676818364
Energy: 0.9310358433165359
Energy: 0.9484646996061429
Energy: 0.8871440742825161
Energy: 0.8756448590403572
Energy: 0.9997663210951163
Energy: 1.020631279214727
Energy: 0.8805278016634398
Energy: 0.9461818920644145
Energy: 0.9195979074266121
Energy: 0.8859897014293109
Energy: 0.8791221901979492
Energy: 0.9547996877834175
Energy: 0.9991516397092407
Energy: 0.8882227794903468
Energy: 0.8867460991494636
Energy: 0.941154681177943
Energy: 0.932839223166988
Energy: 0.9143966264315176
Energy: 0.9767193160995274
Energy: 0.9979988740779129
Energy: 0.9210460862217407
Energy: 0.9146673171839218
Energy: 0.9431197110034585
Energy: 0.9231979269535355
Energy: 0.8787966116599097
Energy: 0.9682136843470579
Energy: 0.9607435464237949
Energy: 0.8801166826667726
Energy: 0.9417826348532389
Energy: 0.9684246784664686
Energy: 0.933620045632661
Energy: 0.8876834748100109
Energy: 0.9544103517017675
Energy: 0.972708119423052
Energy: 0.9022736323758092
Energy: 0.9310901714259308
Energy: 0.9392025902516116
Energy: 1.0241966507866496
Energy: 0.9806460075638681
Energy: 0.9362313071487278
Energy: 0.9694997181288195
Energy: 0.9663155571127466
Energy: 0.9528211334098736
Energy: 0.9209672203377464
Energy: 0.9220219266251847
Energy: 0.911681157585333
Energy: 0.9357876726874683
Energy: 0.9812061225401499
Energy: 0.886266026776159
Energy: 0.8857979073768303
Energy: 1.0796339838291416
Energy: 0.8856430384490321
Energy: 0.9568131003224343
Energy: 0.9424128463048967
Energy: 1.0275728512419136
Energy: 0.9746136748648132
Energy: 0.958499175025078
Energy: 0.9364916927988892

minimum gb energy = 0.8743089596294773 eV
minimum distance =  2.49857793376595 Angstroms
sigma value = 113


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

Energy: 1.1356941604808348
Energy: 1.095904000961594
Energy: 1.2536757370160434
Energy: 1.0070302873474535
Energy: 1.148167331579205
Energy: 1.082126760003501
Energy: 1.1206614373692145
Energy: 1.0651445183983428
Energy: 1.115546965377086
Energy: 1.0179947726870875
Energy: 0.9386081606834084
Energy: 1.008193918235953
Energy: 0.8935903452612501
Energy: 1.1483981516272035
Energy: 1.1480577060435908
Energy: 1.026027050112235
Energy: 1.079979297014881
Energy: 1.1434315531974026
Energy: 1.1769065029182526
Energy: 1.067201073089229
Energy: 1.0493700781044513
Energy: 1.046042173338574
Energy: 0.9598096708030258
Energy: 1.0884912843893908
Energy: 1.1686294646982116
Energy: 1.1515046016365431
Energy: 1.0825224335922583
Energy: 1.098594641094038
Energy: 0.8947784857305173
Energy: 0.9547301630024113
Energy: 0.9714949374451605
Energy: 1.0345525478264896
Energy: 0.9989465119382671
Energy: 1.0210574144735998
Energy: 0.9849303208313769
Energy: 0.9923375006993849
Energy: 1.0445080783705016
Energy: 1.0216660620910696
Energy: 0.9189322697151495
Energy: 1.0220909241742764
Energy: 1.0602290391846723
Energy: 0.9930933781097843
Energy: 1.029841243653283
Energy: 0.9178983158733616
Energy: 1.006788368282989
Energy: 0.9077837754274461
Energy: 1.0866137484115674
Energy: 1.0207582565716302
Energy: 1.0090290831179627
Energy: 1.0071155216782264
Energy: 0.9269339286020798
Energy: 0.9213381405550354
Energy: 1.0267240798183905
Energy: 0.9419363063347139
Energy: 0.9305264799041786
Energy: 0.9369990351273187
Energy: 0.8853665997671881
Energy: 1.0320630052135547
Energy: 1.0108870414763584
Energy: 0.9653887315627384
Energy: 1.0610885156514362
Energy: 1.0609350127889756
Energy: 0.9041932114240689
Energy: 1.0500338613608666
Energy: 0.9585918366867981
Energy: 0.9727061300392157
Energy: 0.9486699782770355
Energy: 0.9298952561257632
Energy: 1.0066457968470854
Energy: 0.9895307281285982
Energy: 0.9936954885207332
Energy: 0.9394179531032603
Energy: 0.9432163579351401
Energy: 0.9889190732960277
Energy: 0.9633632618051304
Energy: 0.9491996912379445
Energy: 1.0082289003751224
Energy: 0.9259082416882846
Energy: 0.9286713671855841
Energy: 1.0601969611429118
Energy: 1.0071378036200256
Energy: 1.0791518730643868
Energy: 1.107482356956377
Energy: 0.9372266287378598
Energy: 1.0078365409113659
Energy: 0.9587376994696084
Energy: 0.9806242449219157
Energy: 1.1328095701593637
Energy: 1.1331884560692551
Energy: 0.9830326395098583
Energy: 0.9736519567299694
Energy: 1.0620994134702864
Energy: 0.9643068560509349
Energy: 1.0432146382231404
Energy: 0.9794620700593833
Energy: 0.9377492178384141
Energy: 0.9571483457083118
Energy: 0.9870504146218884
Energy: 0.9478199775124649
Energy: 1.1351157143520056
Energy: 1.0094552536898682
Energy: 0.9737847413951921
Energy: 0.9714982824050942
Energy: 1.0176117511799818
Energy: 1.1285451909908655
Energy: 0.8909226585015808
Energy: 0.9683263473167025
Energy: 1.022342169555897
Energy: 1.0004833273060019
Energy: 1.021754197578251
Energy: 1.0654184993872684
Energy: 1.0399343515262116
Energy: 1.0387915674587573
Energy: 1.0413178503078857
Energy: 1.0269806142344327
Energy: 0.9841410146734587
Energy: 1.08465025992283
Energy: 1.129870877049457
Energy: 0.9973574941456985
Energy: 1.0123131725364631
Energy: 1.0822921896572153
Energy: 1.085828695081421
Energy: 1.1622397226692
Energy: 1.1246030303234167
Energy: 1.0717085383745404
Energy: 1.0584396332325035
Energy: 0.9719456472763758
Energy: 0.9474674376445169
Energy: 0.8995337911205645
Energy: 0.9659043411582459
Energy: 0.9790533236899579
Energy: 0.9876649024365708
Energy: 1.007708557483825
Energy: 1.1557017818354114
Energy: 1.0382663215458257
Energy: 1.0739753521158435
Energy: 1.0455449714688412
Energy: 1.1507692915608236
Energy: 1.0816074380080274
Energy: 1.0758455269529352
Energy: 1.088282159170033
Energy: 0.95562483972665
Energy: 0.9765497820188687
Energy: 0.9217344592165335
Energy: 1.10292600243064
Energy: 1.1204390880113224
Energy: 1.058020200726681
Energy: 0.9840172964324432
Energy: 0.9953974713170766
Energy: 0.9978364420046417
Energy: 0.9562961114558364
Energy: 1.1440016003768239
Energy: 1.1210623054433042
Energy: 1.057906393970982
Energy: 1.1334519296767138
Energy: 1.0700039276722606
Energy: 1.0740696890510295
Energy: 1.126229311067553
Energy: 1.1121032535145579
Energy: 1.08105898901359
Energy: 1.0359618989351824
Energy: 0.9766292815110865
Energy: 0.9631021810502065
Energy: 0.9523753286499831
Energy: 0.9872992334661821
Energy: 0.9897227435918942
Energy: 0.9644822634550461
Energy: 1.1446267254790865
Energy: 1.0138544952380253
Energy: 1.0665417820051835
Energy: 1.0783365553004745
Energy: 1.078696408179898
Energy: 1.1574385781266356
Energy: 1.0678382638655044
Energy: 1.0537622386539396
Energy: 1.0478772906189313
Energy: 0.9198244722817521
Energy: 1.0903306810440747
Energy: 1.171538035430568
Energy: 1.1523852254212625
Energy: 1.0833781386066461
Energy: 1.0586053439276057
Energy: 0.921426469807929
Energy: 0.9831181054189733
Energy: 0.9701531960365927
Energy: 1.035321209256918
Energy: 0.9714106026239355
Energy: 1.0239788803367518
Energy: 1.0234745020034282
Energy: 0.9919236879096649
Energy: 1.0373412207464485
Energy: 1.0218862326225753
Energy: 0.9363062687458285
Energy: 1.0232927327766401
Energy: 1.0616140525494153
Energy: 1.0235534546961176
Energy: 1.0323654271744234
Energy: 0.9375264358572166
Energy: 1.0225681390276247
Energy: 1.0949948402624665
Energy: 0.9695990810778814
Energy: 1.0227431091077823
Energy: 0.9210299204562417
Energy: 1.0671604144474742
Energy: 0.9589787600879119
Energy: 0.9821752686209152
Energy: 0.9978152619124422
Energy: 1.0729903656654518
Energy: 0.9617660717165952
Energy: 0.9403200176975186
Energy: 0.8864106583593617
Energy: 1.0020767142108216
Energy: 1.011980466177359
Energy: 0.9792344871116605
Energy: 1.0610289655374028
Energy: 1.0608980596747206
Energy: 1.0194056929880286
Energy: 0.9447857574847938
Energy: 0.9593145484101453
Energy: 0.9165080509323815
Energy: 0.9489871858219076
Energy: 0.9644997201580975
Energy: 0.9032127597529318
Energy: 0.966302157094348
Energy: 0.9904888403049381
Energy: 0.9393325323107368
Energy: 0.9521835551595595
Energy: 0.9936288233859536
Energy: 0.9423303243466694
Energy: 0.9948293984688297
Energy: 1.0071504743990896
Energy: 0.8929118047878278
Energy: 0.9280722687705034
Energy: 1.060000642887954
Energy: 1.0308965001883155
Energy: 1.1175407039071128
Energy: 1.1075015255855816
Energy: 0.960112171689634
Energy: 0.9364687395296969
Energy: 0.9555087201312469
Energy: 0.9809871659335792
Energy: 0.967070593091237
Energy: 1.0568410264828358
Energy: 0.9989216544668977
Energy: 0.9260911894741056
Energy: 1.0607660118564535
Energy: 0.9438590799180504
Energy: 1.0214054442190565
Energy: 0.9303999715566769
Energy: 0.9940171899865011
Energy: 1.0210270625817768
Energy: 0.9287387187829559
Energy: 0.9482183526595906
Energy: 1.0123733807407076
Energy: 1.0084630804199555
Energy: 0.9198293992326877
Energy: 0.971633534009697
Energy: 1.0174604501517401
Energy: 0.912842660324384
Energy: 0.8930123550705976
Energy: 0.962900684993132
Energy: 1.0178889018156045
Energy: 1.002201847771128
Energy: 1.0219211364531027
Energy: 1.0226497041521676
Energy: 1.057694202619691
Energy: 1.0317722697336362
Energy: 1.0157415246362111
Energy: 1.0258632995219061
Energy: 1.1343809630639679
Energy: 1.130762837538056
Energy: 1.0640839445628967
Energy: 0.9768507718971128
Energy: 1.014199222674821
Energy: 1.0675788409783726
Energy: 1.0870649150415843
Energy: 1.0632532209653316
Energy: 1.1461819501247497
Energy: 0.9520871767951231
Energy: 1.019800242521802
Energy: 1.1056848700701356
Energy: 0.9860661390279994
Energy: 1.0744780931270592
Energy: 1.0653661408264679
Energy: 0.9150947346275927
Energy: 0.938545075938201
Energy: 1.0534483914491757
Energy: 1.0653245459194312
Energy: 0.9925128934760471
Energy: 1.1662216279351643
Energy: 1.0456148590542036
Energy: 1.1488578032179637
Energy: 1.0812410054615964
Energy: 1.1091551234833597
Energy: 1.0898424267522753
Energy: 1.0488753072070227
Energy: 0.9847182897300504
Energy: 1.001614767536925
Energy: 1.1116124363203805
Energy: 1.1131299250637006
Energy: 1.0582441066577823
Energy: 1.0882723320442529
Energy: 0.9445130297766087
Energy: 1.0407012402154088
Energy: 1.0556479052777932
Energy: 1.110967560710361
Energy: 1.1209360008300355
Energy: 1.0445006968417574
Energy: 1.1201781798238493
Energy: 1.09294033175256
Energy: 1.073002852586128
Energy: 1.1264495099688232
Energy: 1.176293281690602
Energy: 1.0817580515998189
Energy: 1.0114318536958387

minimum gb energy = 0.8853665997671881 eV
minimum distance =  2.47026429397724 Angstroms
sigma value = 365


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

Energy: 1.0113462838225882
Energy: 1.1797741716099897
Energy: 0.9136347467648711
Energy: 0.9104834980201099
Energy: 0.9102134369073447
Energy: 0.9118935410788546
Energy: 0.9114133322516582
Energy: 1.0197405677307612
Energy: 1.1014929375559337
Energy: 0.9690226307525304
Energy: 0.9103818456038306
Energy: 0.9102583633470871
Energy: 0.9699591494982004
Energy: 1.101333370541737
Energy: 0.9702190903765527
Energy: 1.0988123327628285
Energy: 0.9693137074458832
Energy: 0.9104132364903789
Energy: 0.9109900903924384
Energy: 0.9680171333296793
Energy: 0.910310839068925
Energy: 0.9714548111519309
Energy: 1.0980191820743066
Energy: 0.9693876322098276
Energy: 0.910577671010395
Energy: 0.9104636071857765
Energy: 0.9107396014055547
Energy: 0.9111520715707654
Energy: 0.9980310164355736
Energy: 1.1004452223816477
Energy: 0.9710667255709379
Energy: 1.100797380159858
Energy: 0.9097541128550362
Energy: 0.9707620919484615
Energy: 1.1006910535350642
Energy: 0.9734611405352644
Energy: 1.0992840010340865
Energy: 0.9107636082961623
Energy: 0.909557538922639
Energy: 0.909453975189532
Energy: 0.9096804612668271
Energy: 0.9113446457445142
Energy: 0.9699371225485056
Energy: 1.1008740149513794
Energy: 0.9702943132365246
Energy: 0.910268173774558
Energy: 0.9101878113951813
Energy: 0.9701908994736753
Energy: 1.1006726442699875
Energy: 0.969918740881647
Energy: 1.0995200355257821
Energy: 0.9698498873623569
Energy: 0.9107824789303979
Energy: 0.9105003287987029
Energy: 0.9690335929966852
Energy: 1.1009751249760178
Energy: 0.9746647955307172
Energy: 1.097864631695317
Energy: 0.9102612381075013
Energy: 0.910801498579279
Energy: 0.9098419320500222
Energy: 0.9102977575909409
Energy: 0.9116338527669426
Energy: 0.9974950805502426
Energy: 1.1004121852434983
Energy: 0.9710033538829741
Energy: 1.1821085111345642
Energy: 1.1836694896528803
Energy: 0.9703884296653467
Energy: 1.101936135278679
Energy: 0.973051480556049
Energy: 1.0979563683826243
Energy: 0.9105609375500754
Energy: 0.910314539789625
Energy: 0.9110835264549535
Energy: 0.910373952494047
Energy: 0.9112081391343541
Energy: 0.9703136582933001
Energy: 1.0997883090992089
Energy: 0.9695837863927296
Energy: 0.9111585575970704
Energy: 0.9110057864654498
Energy: 0.9685659259194231
Energy: 1.1007055223418032
Energy: 0.9707856234797522
Energy: 1.1006881291136918
Energy: 0.9707382946567367
Energy: 0.9103436862526546
Energy: 0.9097839838299933
Energy: 0.970972297236077
Energy: 1.1013313901067923
Energy: 0.975389895498404
Energy: 1.0988874239482045
Energy: 0.9086588699076846
Energy: 0.9100012506890506
Energy: 0.9098165401735954
Energy: 0.9082079480628339
Energy: 0.9113841684498559
Energy: 0.998497568651191
Energy: 1.1012678896978434
Energy: 0.9712103551514647
Energy: 0.9102328684284987
Energy: 0.912633544047791
Energy: 0.9683077528625339
Energy: 1.100289476850218
Energy: 0.9709064316708448
Energy: 1.0981166550687904
Energy: 0.969298379706086
Energy: 0.910217713786523
Energy: 0.9108078828634046
Energy: 0.9106104343883163
Energy: 0.9109952589971778
Energy: 0.9705498817525712
Energy: 1.0981979327821623
Energy: 0.9691347851497891
Energy: 0.9107363069605482
Energy: 0.9105882628004536
Energy: 0.9678557383846379
Energy: 0.9102855168707411
Energy: 0.9988194777625645
Energy: 1.1018187281209708
Energy: 0.9692014346232802
Energy: 0.9108375680795258
Energy: 0.9098495876634664
Energy: 0.9680691336745563
Energy: 1.1005699361370391
Energy: 0.9725911350966173
Energy: 1.0998424883849167
Energy: 0.9089615300841397
Energy: 0.9102598301419929
Energy: 0.9095482563532332
Energy: 0.9093589189216995
Energy: 0.9114426511369599
Energy: 0.9711613146354904
Energy: 1.1009428102232972
Energy: 0.9697424222923621
Energy: 0.9100640844385819
Energy: 0.910648704713113
Energy: 0.9704958788264416
Energy: 1.1015909890580722

minimum gb energy = 0.9082079480628339 eV
minimum distance =  2.54989937213526 Angstroms
sigma value = 23