Model name: model_name=EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.560000121593475
cohesive_energy=4.400346012135227
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.021495031891507123
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.4581374109285116
Energy: 0.021495031888925466
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193
Energy: 0.023702501379264503
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193
Energy: 0.021495031891507123
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.4581374109285116
Energy: 0.021495031888925466
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193
Energy: 0.023702501379264503
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193
Energy: 0.021495031891507123
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.4581374109285116
Energy: 0.021495031888925466
Energy: 0.45846677793584684
Energy: 0.58119014544991
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193
Energy: 0.023702501379264503
Energy: 0.5806312961160365
Energy: 0.023793233102223747
Energy: 0.23336402801366193

minimum gb energy = 0.021495031888925466 eV
minimum distance =  2.49263754630329 Angstroms
sigma value = 5


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

Energy: 1.5315544299260067
Energy: 1.528653163156621
Energy: 1.529136717297875
Energy: 1.5368925812414351
Energy: 1.5315544299070827
Energy: 1.528653163125081
Energy: 1.5291367173073367
Energy: 1.4277372955942098
Energy: 1.439894007971639
Energy: 1.4451032133979163
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Energy: 1.439894007990563
Energy: 1.4451032134199944
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Energy: 1.4602550281163478
Energy: 1.4513304161013232
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Energy: 1.4328577294238003
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Energy: 1.4649585265893428
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Energy: 1.5449006593942463
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Energy: 1.5462899569978776
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Energy: 1.4825182122842273
Energy: 1.4417372756490696
Energy: 1.4366030017543678
Energy: 1.4585485498556539
Energy: 1.482518212293689
Energy: 1.4417372756837634
Energy: 1.4366030017543678
Energy: 1.5852051956179778
Energy: 1.4608043291138584
Energy: 1.4702054258683521
Energy: 1.4692477487204194
Energy: 1.5852051956305362
Energy: 1.4608043291201664
Energy: 1.470205425880968
Energy: 1.5309760476857388
Energy: 1.441454134388431
Energy: 1.4826310370787754
Energy: 1.489279782462648
Energy: 1.530976047698355
Energy: 1.441454134382123
Energy: 1.4826310370913913
Energy: 1.4216782616993913
Energy: 1.4633079882953084
Energy: 1.459955852985836
Energy: 1.4551667638991357
Energy: 1.4216782617183152
Energy: 1.4633079883331561
Energy: 1.459955852976374
Energy: 1.4517883256072843
Energy: 1.4790079522946298
Energy: 1.4512129169095702
Energy: 1.511552199530271
Energy: 1.4517883256230544
Energy: 1.4790079522820136
Energy: 1.451212916903262
Energy: 1.4211931274271496
Energy: 1.4374852348188165
Energy: 1.4771087033011383
Energy: 1.4461999473797753
Energy: 1.421193127408226
Energy: 1.4374852348345868
Energy: 1.4771087033074466

minimum gb energy = 1.4120016150927712 eV
minimum distance =  2.29640275053208 Angstroms
sigma value = 401


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

Energy: 1.6043189029160658
Energy: 1.5095544169954964
Energy: 1.4808669253879432
Energy: 1.4960570522645031
Energy: 1.6043189029124858
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Energy: 1.4560401102526084
Energy: 1.5053371286475348
Energy: 1.535078987516607
Energy: 1.4902010876354022
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Energy: 1.5053371286475348
Energy: 1.570284782293151
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Energy: 1.5139643281456103
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Energy: 1.4960388732297916
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Energy: 1.4536662815690982
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Energy: 1.4777910479559535
Energy: 1.4959383548968943
Energy: 1.4541596990221588
Energy: 1.4873481112320517
Energy: 1.4561232775603237
Energy: 1.4846408320822102
Energy: 1.4541596990221588
Energy: 1.4873481112249567
Energy: 1.463135436166742
Energy: 1.4554682888968065
Energy: 1.4871266705256976
Energy: 1.5471900589416319
Energy: 1.5037532827786535
Energy: 1.4554682889075468
Energy: 1.4871266705328576
Energy: 1.547190058948792
Energy: 1.4731859219403458
Energy: 1.5753142519233436
Energy: 1.5858211353883083
Energy: 1.5036680233888622
Energy: 1.4731859219439258
Energy: 1.5753142519233436
Energy: 1.5529383859211245
Energy: 1.4726795303501667
Energy: 1.5274680127327855
Energy: 1.5504087315987627
Energy: 1.5031562180136804
Energy: 1.472679530360907
Energy: 1.527468012743526
Energy: 1.5504087315987627
Energy: 1.4565879973318807
Energy: 1.483441199772725
Energy: 1.6446095480811083
Energy: 1.512267035003373
Energy: 1.4565879973211406
Energy: 1.483441199772725
Energy: 1.644609548088268
Energy: 1.4828644962773414
Energy: 1.492163085729152
Energy: 1.524002116127249
Energy: 1.5096162744900552
Energy: 1.4828644962809214
Energy: 1.4921630857219916
Energy: 1.48783527805857
Energy: 1.4817722830830793
Energy: 1.5095544169954964
Energy: 1.4708715722708146
Energy: 1.4960570522716634
Energy: 1.4817722830723388
Energy: 1.5095544169919164
Energy: 1.4708715722708146
Energy: 1.4684298310885107
Energy: 1.5080473369973115
Energy: 1.4656186422598654
Energy: 1.4778375575582383
Energy: 1.468429831099251
Energy: 1.5080473369865712
Energy: 1.4656186422741861

minimum gb energy = 1.4442251585662533 eV
minimum distance =  2.31868873846168 Angstroms
sigma value = 311


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

Energy: 1.5775100274889706
Energy: 1.503333551461947
Energy: 1.5707351164963073
Energy: 1.4694640597330688
Energy: 1.5775100274869036
Energy: 1.5033335514595045
Energy: 1.57073511649424
Energy: 1.5650623916894253
Energy: 1.5754865359222119
Energy: 1.5142694369067
Energy: 1.559746386358607
Energy: 1.5650623916881852
Energy: 1.57548653593172
Energy: 1.5142694369062863
Energy: 1.491711074888534
Energy: 1.4937063324596693
Energy: 1.6067277701862117
Energy: 1.5024605919269411
Energy: 1.4917110748943214
Energy: 1.493706332455949
Energy: 1.6142422054815344
Energy: 1.4833777431711423
Energy: 1.5220251533235614
Energy: 1.5052642760403199
Energy: 1.499737816105698
Energy: 1.4833777431752762
Energy: 1.5220251533194276
Energy: 1.5052642760419732
Energy: 1.5083214808259584
Energy: 1.4891393376230897
Energy: 1.57713466175364
Energy: 1.486695675899058
Energy: 1.5083214808300924
Energy: 1.489139337615235
Energy: 1.5372490868179292
Energy: 1.4871352754089107
Energy: 1.5455109611794187
Energy: 1.4964062433881213
Energy: 1.5247908657424614
Energy: 1.4871352754138711
Energy: 1.5455109611839661
Energy: 1.496406243385641
Energy: 1.5363837924798989
Energy: 1.5037591658601854
Energy: 1.5210160405194204
Energy: 1.5212953044367725
Energy: 1.5363837924840327
Energy: 1.5037591658593588
Energy: 1.5210160405194204
Energy: 1.4831647081533685
Energy: 1.5459647838683956
Energy: 1.5490472005583837
Energy: 1.5455485411082541
Energy: 1.4831647081554356
Energy: 1.545964783868809
Energy: 1.549047200560864
Energy: 1.4987766918553862
Energy: 1.5487986876976967
Energy: 1.5855563360116107
Energy: 1.5092366311027383
Energy: 1.4987766918553862
Energy: 1.5487986877001771
Energy: 1.5803518420969054
Energy: 1.5078454480806212
Energy: 1.5244144489876206
Energy: 1.5666148996790015
Energy: 1.5082747804570822
Energy: 1.5078454480785541
Energy: 1.5244144489896876
Energy: 1.5666148996790015
Energy: 1.5763695272696263
Energy: 1.5691950466678606
Energy: 1.5533668313267386
Energy: 1.5014376578415407
Energy: 1.5763695272675593
Energy: 1.569195046667034
Energy: 1.5533668313325257
Energy: 1.5306587969297951
Energy: 1.521937638982077
Energy: 1.533595701748504
Energy: 1.564369336948229
Energy: 1.5306587969256613
Energy: 1.5219376389800099
Energy: 1.533595701747264
Energy: 1.524377910151982
Energy: 1.5371502273031947
Energy: 1.5875368207087006
Energy: 1.5428293975314993
Energy: 1.5243779101557027
Energy: 1.537150227301128
Energy: 1.5875368207053935
Energy: 1.5268254655726938
Energy: 1.4931681521610616
Energy: 1.5136331932157825
Energy: 1.535123531032726
Energy: 1.526825465571867
Energy: 1.493168152161475
Energy: 1.5136331932128886
Energy: 1.5246162586653322
Energy: 1.5423766619549188
Energy: 1.588510160562233
Energy: 1.4995447909244792
Energy: 1.524616258662025
Energy: 1.5423766619540922
Energy: 1.5885101605667802
Energy: 1.5022332903027613
Energy: 1.564631865706352
Energy: 1.5461672208222945
Energy: 1.4910817497582551
Energy: 1.502233290307722
Energy: 1.5646318657108993
Energy: 1.5461672208206412
Energy: 1.598381075101366
Energy: 1.5405878457455546
Energy: 1.5425489187943853
Energy: 1.5730330853678838
Energy: 1.5983810751030196
Energy: 1.5405878457393538
Energy: 1.5425489187943853
Energy: 1.5280012992391674
Energy: 1.502946966331188
Energy: 1.5924420580244538
Energy: 1.504710374340699
Energy: 1.5280012992379273
Energy: 1.5029469663303612
Energy: 1.5924420580244538
Energy: 1.4992221456239552
Energy: 1.556204281994015
Energy: 1.5246226966646816
Energy: 1.537911579446619
Energy: 1.4992221456223018
Energy: 1.556204281998562
Energy: 1.5246226966609613
Energy: 1.4834415552533105
Energy: 1.550347367916799
Energy: 1.5214078323389517
Energy: 1.546172484066451
Energy: 1.4834415552541376
Energy: 1.550347367914356
Energy: 1.5214078323410185
Energy: 1.4998706910503037
Energy: 1.5057894428134688
Energy: 1.5176019590877732
Energy: 1.5096291069850791
Energy: 1.4998706910469966
Energy: 1.5057894428142957
Energy: 1.5176019590902534
Energy: 1.4832956220343003
Energy: 1.5551842706195402
Energy: 1.4974579264954422
Energy: 1.5087164010552112
Energy: 1.4832956220301665
Energy: 1.555184270620367
Energy: 1.4974579264954422
Energy: 1.5761220436192949
Energy: 1.4676103618639307
Energy: 1.5549322236748946
Energy: 1.4894939097008641
Energy: 1.5761220436271495
Energy: 1.4676103618626908
Energy: 1.5757384167966861
Energy: 1.517820613900927
Energy: 1.536767355860285
Energy: 1.6228176609825924
Energy: 1.5450370023287672
Energy: 1.5178206139001
Energy: 1.5367673558578048
Energy: 1.6228176609825924
Energy: 1.4957915657818563
Energy: 1.5479560148618727
Energy: 1.578756387312096
Energy: 1.5360887613600442
Energy: 1.495791565780616
Energy: 1.5479560148651799
Energy: 1.570326101534147
Energy: 1.533124763183939
Energy: 1.584799875477579
Energy: 1.5100261417238168
Energy: 1.5402046640699945
Energy: 1.5331247631893135
Energy: 1.5847998754779922
Energy: 1.510026141726297
Energy: 1.5401940324440815
Energy: 1.4697201613527309
Energy: 1.5706754864888413
Energy: 1.4669519035269807
Energy: 1.5401940324449082
Energy: 1.4697201613547979
Energy: 1.5616659904044408
Energy: 1.5851923627872364
Energy: 1.5752562166194213
Energy: 1.5595973626417408
Energy: 1.5569272691311036
Energy: 1.5851923627810356
Energy: 1.5752562166235176
Energy: 1.5595973626384334
Energy: 1.5053457467889089
Energy: 1.507431956298536
Energy: 1.6062921412199636
Energy: 1.4975386683370815
Energy: 1.505345746786842
Energy: 1.5074319562989495
Energy: 1.6062921412158295
Energy: 1.4902831711096534
Energy: 1.531320119769718
Energy: 1.620923738909055
Energy: 1.491420937305925
Energy: 1.4902831711096534
Energy: 1.531320119769718
Energy: 1.6209237389119486
Energy: 1.5342457954140802
Energy: 1.489091242673696
Energy: 1.5602023199085109
Energy: 1.4880205066079117
Energy: 1.5342457954169737
Energy: 1.4890912426753493
Energy: 1.5602023199039639
Energy: 1.4895262326728818
Energy: 1.560559825294053
Energy: 1.462482583015528
Energy: 1.541016410699379
Energy: 1.4895262326757757
Energy: 1.5605598252977735
Energy: 1.4624825830167683
Energy: 1.5277816601614935
Energy: 1.528490430356588
Energy: 1.5262595195626434
Energy: 1.5127403225540417
Energy: 1.527781660159013
Energy: 1.5284904303611353
Energy: 1.5262595195663637
Energy: 1.4835870577950703
Energy: 1.5466529690897866
Energy: 1.559479369713048
Energy: 1.513990664216966
Energy: 1.483587057789696
Energy: 1.5466529690901998
Energy: 1.5594793697093272
Energy: 1.5100291721827508
Energy: 1.5489066307970587
Energy: 1.5942389899639777
Energy: 1.4929459735757729
Energy: 1.5100291721839911
Energy: 1.548906630799539
Energy: 1.5942389899602571
Energy: 1.5122364903744498
Energy: 1.538399750708295
Energy: 1.5667078214684231
Energy: 1.5082030037962175
Energy: 1.5122364903727963
Energy: 1.538399750708295
Energy: 1.5667078214721442

minimum gb energy = 1.462482583015528 eV
minimum distance =  2.29980138683271 Angstroms
sigma value = 39


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

Energy: 1.4664792116334016
Energy: 1.5099626634944272
Energy: 1.6101036392949784
Energy: 1.5098674559502225
Energy: 1.4664792116573084
Energy: 1.5099626634885723
Energy: 1.61010363928766
Energy: 1.459313945751963
Energy: 1.5447686465794828
Energy: 1.3873478870839702
Energy: 1.5451983559805602
Energy: 1.4593139457558661
Energy: 1.5447686465931436
Energy: 1.3873478870825064
Energy: 1.4663549685398283
Energy: 1.4068273189680955
Energy: 1.5084258250988025
Energy: 1.5062500732363313
Energy: 1.4663549685437314
Energy: 1.4068273189617533
Energy: 1.5084258251046572
Energy: 1.4583383780771022
Energy: 1.5446735723551808
Energy: 1.3871618238184846
Energy: 1.4929159523876083
Energy: 1.4583383780663688
Energy: 1.5446735723390805
Energy: 1.3871618238248271
Energy: 1.5621464487018102
Energy: 1.5045712445342978
Energy: 1.561510146403293
Energy: 1.5064161279888393
Energy: 1.5621464486915646
Energy: 1.5045712445523496
Energy: 1.561510146407684
Energy: 1.4580386432942614
Energy: 1.4897695086177976
Energy: 1.5969126151198536
Energy: 1.4936559782635115
Energy: 1.4580386433040189
Energy: 1.4897695086109672
Energy: 1.596912615116926
Energy: 1.649375657071716
Energy: 1.5041561195793216
Energy: 1.570874673278882
Energy: 1.504785631680606
Energy: 1.6493756570770828
Energy: 1.5041561195739548
Energy: 1.570874673276443
Energy: 1.4580260125452136
Energy: 1.3874598931435134
Energy: 1.628163251560506
Energy: 1.3873970026285902
Energy: 1.4580260125457014
Energy: 1.387459893140098
Energy: 1.6281632515629454
Energy: 1.6495480611004167
Energy: 1.5049157876723616
Energy: 1.5356607749582536
Energy: 1.5043247962971051
Energy: 1.6495480611033442
Energy: 1.504915787674313
Energy: 1.5066152665769588
Energy: 1.457780070471611
Energy: 1.4937017416354803
Energy: 1.5968467305385765
Energy: 1.4894275949434377
Energy: 1.4577800704691717
Energy: 1.4937017416257226
Energy: 1.5968467305371128
Energy: 1.562698391201783
Energy: 1.5052647483177473
Energy: 1.5533863293137364
Energy: 1.504046269441101
Energy: 1.562698391202271
Energy: 1.505264748323602
Energy: 1.542068159737232
Energy: 1.458377565455248
Energy: 1.4930418450657585
Energy: 1.3868105507709325
Energy: 1.54634172925196
Energy: 1.4583775654503692
Energy: 1.493041845057021
Energy: 1.3868105507738597
Energy: 1.4663580106315004
Energy: 1.5061069203767017
Energy: 1.4882309994509137
Energy: 1.406979215390913
Energy: 1.4663580106227185
Energy: 1.5061069203698714
Energy: 1.4879064880226063
Energy: 1.459109421110661
Energy: 1.5451933766473858
Energy: 1.38730801982655
Energy: 1.5446361202629169
Energy: 1.4591094211116369
Energy: 1.545193376637628
Energy: 1.3873080198187437
Energy: 1.4664792116294985
Energy: 1.5099626634914998
Energy: 1.6101036392944905
Energy: 1.5098674559497347
Energy: 1.466479211653893
Energy: 1.5099626634856451
Energy: 1.610103639292539
Energy: 1.4593139457548903
Energy: 1.5447686465794828
Energy: 1.3873478870825064
Energy: 1.5451983559829994
Energy: 1.4593139457573299
Energy: 1.54476864659168
Energy: 1.3873478870771396
Energy: 1.466354968540804
Energy: 1.406827318970047
Energy: 1.5084258251027056
Energy: 1.5062500732348676
Energy: 1.4663549685471466
Energy: 1.4068273189632168
Energy: 1.5084258251066087
Energy: 1.458338378078566
Energy: 1.5446735723507898
Energy: 1.3871618238184846
Energy: 1.4929159523895599
Energy: 1.458338378064905
Energy: 1.5446735723361533
Energy: 1.3871618238223877
Energy: 1.5621464487042496
Energy: 1.5045712445347856
Energy: 1.5615101464023171
Energy: 1.5064161279878634
Energy: 1.5621464486876615
Energy: 1.504571244550398
Energy: 1.561510146407196
Energy: 1.458038643295237
Energy: 1.4897695086187734
Energy: 1.5969126151174138
Energy: 1.493655978264975
Energy: 1.4580386433040189
Energy: 1.4897695086109672
Energy: 1.5969126151135107
Energy: 1.6493756570697644
Energy: 1.504156119581761
Energy: 1.570874673276443
Energy: 1.5047856316801183
Energy: 1.6493756570780587
Energy: 1.504156119573467
Energy: 1.5708746732759993
Energy: 1.4580260125457014
Energy: 1.3874598931440012
Energy: 1.6281632515614817
Energy: 1.387397002630054
Energy: 1.4580260125457014
Energy: 1.3874598931420496
Energy: 1.628163251564897
Energy: 1.649548061099441
Energy: 1.5049157876728494
Energy: 1.4538991757422004
Energy: 1.5043247962946655
Energy: 1.6495480611018805
Energy: 1.504915787674801
Energy: 1.4538991757353699
Energy: 1.4577800704730748
Energy: 1.493701741631089
Energy: 1.596846730537601
Energy: 1.4894275949463653
Energy: 1.4577800704711232
Energy: 1.4937017416252343
Energy: 1.5968467305371128
Energy: 1.5626983911988557
Energy: 1.5052647483201866
Energy: 1.5246807824917887
Energy: 1.5040462694464676
Energy: 1.5626983912003194
Energy: 1.505264748327505
Energy: 1.5246807824717854
Energy: 1.4583775654537843
Energy: 1.4930418450672223
Energy: 1.3868105507699566
Energy: 1.5463417292529356
Energy: 1.4583775654484177
Energy: 1.4930418450579968
Energy: 1.3868105507738597
Energy: 1.466358010633452
Energy: 1.5061069203752384
Energy: 1.48790648802407
Energy: 1.406979215390913
Energy: 1.4663580106222307
Energy: 1.506106920366944
Energy: 1.4879064880191908
Energy: 1.4591094211101732
Energy: 1.5451933766483614
Energy: 1.38730801982655
Energy: 1.544636120262429
Energy: 1.4591094211126125
Energy: 1.5451933766405552
Energy: 1.3873080198202072
Energy: 1.4664792116338896
Energy: 1.5099626634939392
Energy: 1.6101036392940025
Energy: 1.5098674559497347
Energy: 1.4664792116577963
Energy: 1.5099626634885723
Energy: 1.6101036392871722
Energy: 1.459313945751963
Energy: 1.5447686465789945
Energy: 1.387347887084458
Energy: 1.5451983559800724
Energy: 1.4593139457558661
Energy: 1.5447686465926556
Energy: 1.3873478870815306

minimum gb energy = 1.3868105507699566 eV
minimum distance =  2.35724737288389 Angstroms
sigma value = 21


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

Energy: 1.4847041757423178
Energy: 1.5874093417601274
Energy: 1.5847309422296976
Energy: 1.5873361734565061
Energy: 1.4847041757435027
Energy: 1.5874093417601274
Energy: 1.5847309422261437
Energy: 1.4883613213182503
Energy: 1.4817451057327289
Energy: 1.3946839925344776
Energy: 1.4819109799872403
Energy: 1.4883613213170657
Energy: 1.481745105733321
Energy: 1.3946839925386232
Energy: 1.4943032535174081
Energy: 1.4900759600560936
Energy: 1.4617617839115042
Energy: 1.5510579796727888
Energy: 1.4943032535103011
Energy: 1.4900759600578701
Energy: 1.4617617839120962
Energy: 1.4966320150668422
Energy: 1.481963539219068
Energy: 1.4729414465801323
Energy: 1.4816899283034708
Energy: 1.4966320150638812
Energy: 1.4819635392184753
Energy: 1.4729414465801323
Energy: 1.4488231739758932
Energy: 1.4207559324844632
Energy: 1.5630931244000636
Energy: 1.422125131522679
Energy: 1.4488231739764854
Energy: 1.4207559324832784
Energy: 1.5630931243994717
Energy: 1.4966402912506636
Energy: 1.4966402912506636
Energy: 1.5896958910448284
Energy: 1.4852387022980211
Energy: 1.4966402912500711
Energy: 1.417136789380026
Energy: 1.5896958910519357
Energy: 1.488749410250939
Energy: 1.421922073855656
Energy: 1.5637761901400162
Energy: 1.5117170292967932
Energy: 1.4887494102515317
Energy: 1.4219220738532872
Energy: 1.5637761901400162
Energy: 1.4860398087849631
Energy: 1.4860497886840496
Energy: 1.5894114325197009
Energy: 1.4853250925468324
Energy: 1.4860398087820017
Energy: 1.4860497886840496
Energy: 1.5894114325179238
Energy: 1.4964945278941562
Energy: 1.4871800997787525
Energy: 1.502785909597871
Energy: 1.4163327813365885
Energy: 1.4964945278953405
Energy: 1.4871800997787525
Energy: 1.5027859096032015
Energy: 1.489999604786922
Energy: 1.411161550892409
Energy: 1.5446263735641237
Energy: 1.484750362008746
Energy: 1.4899996047881063
Energy: 1.4111615508864863
Energy: 1.5446263735635315
Energy: 1.545774770965687
Energy: 1.4952622675535734
Energy: 1.501055234988481
Energy: 1.4976078155738402
Energy: 1.5457747709645027
Energy: 1.4952622675529812
Energy: 1.5010552349914423
Energy: 1.3962317610009065
Energy: 1.4116645534457337
Energy: 1.4854351238406058
Energy: 1.4145433117004107
Energy: 1.3962317610056445
Energy: 1.411664553443957
Energy: 1.4854351238447516
Energy: 1.5437890459462587
Energy: 1.498222094378404
Energy: 1.5123569973592097
Energy: 1.4829170295703935
Energy: 1.5437890459415202
Energy: 1.4982220943742584
Energy: 1.5123569973627635
Energy: 1.396407479378275
Energy: 1.412176798935965
Energy: 1.509902579223643
Energy: 1.4147313726901156
Energy: 1.3964074793788674
Energy: 1.4121767989395189
Energy: 1.5099025792212741
Energy: 1.4923727996547698
Energy: 1.4186335161600863
Energy: 1.541720193651997
Energy: 1.4819071887952808
Energy: 1.492372799648255
Energy: 1.4186335161618633
Energy: 1.541720193649628
Energy: 1.396376092623897
Energy: 1.488675713512862
Energy: 1.4476891670661347
Energy: 1.4638592369725825
Energy: 1.3963760926280426
Energy: 1.4886757135158233
Energy: 1.447689167069688
Energy: 1.4922933034855923
Energy: 1.4187823617780753
Energy: 1.490017225577021
Energy: 1.4822547419056629
Energy: 1.4922933034832502
Energy: 1.4187823617822215
Energy: 1.4900172255728747
Energy: 1.3965784111454345
Energy: 1.4447724651217095
Energy: 1.4439223627142883
Energy: 1.4638930689214003
Energy: 1.3965784111466195
Energy: 1.4447724651264477
Energy: 1.4439223627154727
Energy: 1.508501559517555
Energy: 1.4176851292217088
Energy: 1.5462662554015378
Energy: 1.4814124526108763
Energy: 1.508501559519332
Energy: 1.417685129219932
Energy: 1.5462662553979842
Energy: 1.3964393038575296
Energy: 1.5297127097156415
Energy: 1.4481687522446156
Energy: 1.529792718048413
Energy: 1.3964393038527914
Energy: 1.5297127097179837
Energy: 1.4481687522487612
Energy: 1.5087590173595065
Energy: 1.4813018390624229
Energy: 1.5464153124185078
Energy: 1.4177549313016622
Energy: 1.5087590173595065
Energy: 1.48130183906953
Energy: 1.5464153124173232
Energy: 1.396539041275776
Energy: 1.463928774552646
Energy: 1.4438333969850956
Energy: 1.4445532889899306
Energy: 1.3965390412739993
Energy: 1.4639287745573837
Energy: 1.4438333969886494
Energy: 1.492375024710383
Energy: 1.4821833715468709
Energy: 1.5335498834573582
Energy: 1.419090930182676
Energy: 1.4923750247133443
Energy: 1.4821833715445016
Energy: 1.5335498834532122
Energy: 1.3963617412739147
Energy: 1.4636564121056954
Energy: 1.447556495784409
Energy: 1.4872294751678417
Energy: 1.3963617412673996
Energy: 1.4636564120974038
Energy: 1.4475564957850011
Energy: 1.4923799784525997
Energy: 1.4820824696578956
Energy: 1.54366550056943
Energy: 1.4183833834341368
Energy: 1.492379978453192
Energy: 1.4820824696525652
Energy: 1.54366550056943

minimum gb energy = 1.3946839925344776 eV
minimum distance =  2.32743276983298 Angstroms
sigma value = 113


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

Energy: 1.3801086879137705
Energy: 1.5877261203985027
Energy: 1.5558141109834436
Energy: 1.5681337340730894
Energy: 1.380108687923687
Energy: 1.5877261203885864
Energy: 1.5558141109834436
Energy: 1.5327432560649714
Energy: 1.535875040950963
Energy: 1.3969003892952911
Energy: 1.6095938582237816
Energy: 1.5327432560518095
Energy: 1.5358750409410467
Energy: 1.3969003893052077
Energy: 1.3869063971064692
Energy: 1.5200532674277603
Energy: 1.5374316400400463
Energy: 1.4449971963030328
Energy: 1.3869063971097746
Energy: 1.5200532674343712
Energy: 1.5374316400334356
Energy: 1.3781010049044276
Energy: 1.5511267361264534
Energy: 1.4049438488640404
Energy: 1.529213884491208
Energy: 1.3781010048978166
Energy: 1.5511267361066208
Energy: 1.4049438488574297
Energy: 1.3821564607840657
Energy: 1.3625483106740846
Energy: 1.5580985997147183
Energy: 1.427387265478128
Energy: 1.3821564607675385
Energy: 1.362548310684001
Energy: 1.558098599704802
Energy: 1.316056409757928
Energy: 1.502580247977806
Energy: 1.412237977401254
Energy: 1.419188832423663
Energy: 1.3160564097513168
Energy: 1.5025802479811112
Energy: 1.41223797741117
Energy: 1.361749021856591
Energy: 1.3626650987753048
Energy: 1.4555712650336796
Energy: 1.3742062737062275
Energy: 1.3617490218466746
Energy: 1.3626650987786104
Energy: 1.455571265030374
Energy: 1.3562090406416167
Energy: 1.4785403469853733
Energy: 1.4302342863457311
Energy: 1.416350507495719
Energy: 1.3562090406350058
Energy: 1.4785403470019005
Energy: 1.4302342863424256
Energy: 1.3519685398104893
Energy: 1.381702429118921
Energy: 1.6169097111483415
Energy: 1.3689577437933527
Energy: 1.3519685398171002
Energy: 1.381702429092477
Energy: 1.6169097111351196
Energy: 1.3155942006671522
Energy: 1.432760743367055
Energy: 1.4346962286845453
Energy: 1.4145311636105544
Energy: 1.315594200673763
Energy: 1.4327607433868879
Energy: 1.434696228691156
Energy: 1.3522000614271357
Energy: 1.3873450266874563
Energy: 1.539783191761466
Energy: 1.3879978589257065
Energy: 1.35220006142383
Energy: 1.3873450266940672
Energy: 1.5397831917713822
Energy: 1.3470864129930153
Energy: 1.428212987268773
Energy: 1.473793324534271
Energy: 1.4167691462638532
Energy: 1.3470864129797937
Energy: 1.4282129872555513
Energy: 1.473793324534271
Energy: 1.3524523458461644
Energy: 1.4254739558347043
Energy: 1.4529778458194214
Energy: 1.4266431792556458
Energy: 1.3524523458593865
Energy: 1.4254739558347043
Energy: 1.45297784584256
Energy: 1.3469906424130782
Energy: 1.4653406383021268
Energy: 1.4668897888817918
Energy: 1.481473514351563
Energy: 1.3469906424130782
Energy: 1.4653406382955159
Energy: 1.4668897888718753
Energy: 1.352455279545194
Energy: 1.4089950092711896
Energy: 1.7115515647496555
Energy: 1.4615259530708926
Energy: 1.3524552795418887
Energy: 1.408995009274495
Energy: 1.7115515647595718
Energy: 1.3473326128316145
Energy: 1.428367132552508
Energy: 1.4692870098364164
Energy: 1.424800621155654
Energy: 1.3473326128118421
Energy: 1.4283671325425917
Energy: 1.469287009839722
Energy: 1.461883786001501
Energy: 1.425969873263653
Energy: 1.4842790932218295
Energy: 1.416552827955189
Energy: 1.4618837860081122
Energy: 1.4259698732570418
Energy: 1.4842790932019965
Energy: 1.347186099364281
Energy: 1.371601475758807
Energy: 1.4766745830560595
Energy: 1.3947989247056343
Energy: 1.3471860993543645
Energy: 1.371601475758807
Energy: 1.476674583052754
Energy: 1.4612650847192359
Energy: 1.3687530998106063
Energy: 1.5348310455108203
Energy: 1.4249282119324735
Energy: 1.4612650847258466
Energy: 1.3687530998205228
Energy: 1.5348310455009038
Energy: 1.3155984150647448
Energy: 1.401251032482544
Energy: 1.4016936390866415
Energy: 1.3700251923269755
Energy: 1.315598415038301
Energy: 1.4012510324924006
Energy: 1.4016936390899466
Energy: 1.4107453010108084
Energy: 1.4011342593571592
Energy: 1.4850435253642995
Energy: 1.4352853741906286
Energy: 1.4107453010141142
Energy: 1.4011342593505485
Energy: 1.4850435253576884
Energy: 1.32378256106692
Energy: 1.3865404304924542
Energy: 1.459360318378288
Energy: 1.3647311260359045
Energy: 1.3237825610636145
Energy: 1.3865404304726814
Energy: 1.459360318378288
Energy: 1.4100490413945517
Energy: 1.460530112898463
Energy: 1.3974073157117712
Energy: 1.3987319887977023
Energy: 1.4100490413912459
Energy: 1.4605301128918522
Energy: 1.39740731570516
Energy: 1.3587031470053308
Energy: 1.3991118025326692
Energy: 1.6195377256607795
Energy: 1.3887876862276507
Energy: 1.3587031470053308
Energy: 1.3991118025359748
Energy: 1.6195377256607795
Energy: 1.512087237373916
Energy: 1.5131597316370344
Energy: 1.4581852462130926
Energy: 1.669090820207886
Energy: 1.5120872373639995
Energy: 1.5131597316436454
Energy: 1.4581852462263147
Energy: 1.3533546360608193
Energy: 1.4691497258798596
Energy: 1.5092726057206418
Energy: 1.4034722335581866
Energy: 1.3533546360575135
Energy: 1.4691497258732487
Energy: 1.5092726057206418
Energy: 1.6301481303792806
Energy: 1.4753261188846523
Energy: 1.4247301656536195
Energy: 1.5288877567341768
Energy: 1.6301481303792806
Energy: 1.475326118878041
Energy: 1.421784745833882
Energy: 1.374135590237206
Energy: 1.5116915252445264
Energy: 1.5026009679680044
Energy: 1.508670460975351
Energy: 1.3741355902405115
Energy: 1.5116915252412209
Energy: 1.5026009679580878
Energy: 1.6404430829325753
Energy: 1.4759575584919271
Energy: 1.4106280467927146
Energy: 1.7122164010138299
Energy: 1.6404430829557135
Energy: 1.475957558478705
Energy: 1.4106280467827983
Energy: 1.3540301553120635
Energy: 1.5121417711179046
Energy: 1.4165997516658428
Energy: 1.5019078968490682
Energy: 1.3540301553219798
Energy: 1.5121417711343719
Energy: 1.4165997516559268
Energy: 1.4061703441399236
Energy: 1.4782839785478412
Energy: 1.4595332966146577
Energy: 1.6310516692791135
Energy: 1.4061703441366178
Energy: 1.4782839785478412
Energy: 1.4595332966047412
Energy: 1.3690856518973735
Energy: 1.3876952829019134
Energy: 1.5256743804857344
Energy: 1.3681665923071258
Energy: 1.3690856519139005
Energy: 1.3876952828953024
Energy: 1.5256743804923456
Energy: 1.3847795167557069
Energy: 1.4637212096431271
Energy: 1.3693109552715044
Energy: 1.5008303373354728
Energy: 1.3847795167557069
Energy: 1.4637212096398218
Energy: 1.3693109552814209
Energy: 1.3931198972534422
Energy: 1.3829541805569194
Energy: 1.5141774566950694
Energy: 1.3753532189257471
Energy: 1.393119897250137
Energy: 1.3829541805536139
Energy: 1.5141774566950694
Energy: 1.3527008953349788
Energy: 1.3940225909406097
Energy: 1.4438617332620505
Energy: 1.4954996101294635
Energy: 1.3527008953349788
Energy: 1.3940225909538317
Energy: 1.443861733271967
Energy: 1.368929365940949
Energy: 1.384582709583252
Energy: 1.501684144005143
Energy: 1.3924419876097456
Energy: 1.3689293659541109
Energy: 1.384582709583252
Energy: 1.501684143991921
Energy: 1.3526922130895336
Energy: 1.4357658867806988
Energy: 1.4443575633031907
Energy: 1.5028480485632594
Energy: 1.3526922130928394
Energy: 1.4357658867806988
Energy: 1.4443575633098014
Energy: 1.4048665742212985
Energy: 1.3689905854508955
Energy: 1.4366483714932607
Energy: 1.430102403313369
Energy: 1.4048665742246043
Energy: 1.3689905854310627
Energy: 1.4366483715031773
Energy: 1.4054104179892613
Energy: 1.486871406701133
Energy: 1.439378981976452
Energy: 1.5049313973959484
Energy: 1.4054104179892613
Energy: 1.486871406701133
Energy: 1.4393789819797573
Energy: 1.420451989858244
Energy: 1.4492417709754728
Energy: 1.48640435212671
Energy: 1.428708565553618
Energy: 1.4204519898549384
Energy: 1.4492417709655565
Energy: 1.4864043521366266
Energy: 1.395651193684457
Energy: 1.4898598266912666
Energy: 1.4629039794290557
Energy: 1.5201362818838584
Energy: 1.3956511936910678
Energy: 1.4898598267077943
Energy: 1.462903979438972
Energy: 1.420338375852159
Energy: 1.452983242295111
Energy: 1.7938590069898406
Energy: 1.45205801424914
Energy: 1.4203383758422425
Energy: 1.452983242291805
Energy: 1.7938590070063682
Energy: 1.3468787431164317
Energy: 1.4901897864292408
Energy: 1.5060810921635979
Energy: 1.5198621803299397
Energy: 1.3468787431230427
Energy: 1.490189786416019
Energy: 1.5060810921635979
Energy: 1.4075820881370789
Energy: 1.4417616027669047
Energy: 1.6194801633883713
Energy: 1.4204303720645248
Energy: 1.4075820881403842
Energy: 1.4417616027602937
Energy: 1.6194801633685385
Energy: 1.3473979594463625
Energy: 1.4775292495458807
Energy: 1.464955587824542
Energy: 1.5065456475839107
Energy: 1.3473979594463625
Energy: 1.4775292495425754
Energy: 1.464955587824542

minimum gb energy = 1.3155942006671522 eV
minimum distance =  2.28878312659075 Angstroms
sigma value = 365


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

Energy: 1.357195349190678
Energy: 1.1880852580663748
Energy: 1.5577302873982832
Energy: 1.1880852580626484
Energy: 1.3571953491936593
Energy: 1.1880852580633938
Energy: 1.3340859907793248
Energy: 1.3571953491862065
Energy: 1.1880852580633938
Energy: 1.5577302873982832
Energy: 1.1880852580708463
Energy: 1.3571953491839708
Energy: 1.188085258058922
Energy: 1.3340859907875224
Energy: 1.3571953491869522
Energy: 1.1880852580648842
Energy: 1.3417799533305568
Energy: 1.188085258058922
Energy: 1.357195349184716
Energy: 1.1880852580723367
Energy: 1.5532360012909665
Energy: 1.357195349189933
Energy: 1.1880852580626484
Energy: 1.1972965101329012
Energy: 1.1880852580611578
Energy: 1.3571953491936593
Energy: 1.188085258058922
Energy: 1.3340859907830511
Energy: 1.3571953491876971
Energy: 1.1880852580656294
Energy: 1.3417798145837823
Energy: 1.1880852580723367
Energy: 1.3571953491854614
Energy: 1.1880852580626484
Energy: 1.3340859907875224
Energy: 1.3571953491862065
Energy: 1.1880852580633938
Energy: 1.2600504800047025
Energy: 1.188085258058922
Energy: 1.357195349184716
Energy: 1.1880852580738275
Energy: 1.1955362748556406
Energy: 1.357195349190678
Energy: 1.188085258064139
Energy: 1.197297067389181
Energy: 1.1880852580611578
Energy: 1.3571953491943705
Energy: 1.1880852580648842
Energy: 1.33408599078007
Energy: 1.3571953491869522
Energy: 1.1880852580633938
Energy: 1.1972972780097244
Energy: 1.1880852580715917
Energy: 1.357195349184716
Energy: 1.1880852580604127
Energy: 1.3340859907905036
Energy: 1.3571953491869522
Energy: 1.188085258064139
Energy: 1.3286848510389242
Energy: 1.1880852580596675
Energy: 1.3571953491854614
Energy: 1.188085258073082
Energy: 1.3286848510396694
Energy: 1.3571953491891877
Energy: 1.1880852580648842
Energy: 1.334085990786032
Energy: 1.188085258058922
Energy: 1.3571953491929138
Energy: 1.1880852580581769
Energy: 1.3340859907808154
Energy: 1.3571953491876971
Energy: 1.1880852580648842
Energy: 1.197297920044901
Energy: 1.1880852580723367
Energy: 1.3571953491854614
Energy: 1.1880852580596675
Energy: 1.334085990785287
Energy: 1.3571953491862065
Energy: 1.1880852580626484
Energy: 1.3340859907867775
Energy: 1.1880852580581769
Energy: 1.3571953491854614
Energy: 1.1880852580708463
Energy: 1.390156190103671
Energy: 1.3571953491891877
Energy: 1.1880852580633938
Energy: 1.334085990785287
Energy: 1.1880852580604127
Energy: 1.3571953491936593
Energy: 1.1880852580626484
Energy: 1.3340859907808154
Energy: 1.3571953491876971
Energy: 1.188085258064139
Energy: 1.3340859907815605
Energy: 1.1880852580715917
Energy: 1.357195349184716
Energy: 1.1880852580604127
Energy: 1.3340859907882678
Energy: 1.3571953491876971
Energy: 1.1880852580663748
Energy: 1.3340859907875224
Energy: 1.1880852580596675
Energy: 1.3571953491854614
Energy: 1.188085258073082
Energy: 1.334085990786032
Energy: 1.3571953491876971
Energy: 1.188085258064139
Energy: 1.3340859907837963
Energy: 1.1880852580596675
Energy: 1.3571953491936593
Energy: 1.1880852580626484
Energy: 1.3340859907815605
Energy: 1.3571953491884423
Energy: 1.1880852580671197
Energy: 1.3340859907823055
Energy: 1.1880852580738275
Energy: 1.3571953491854614
Energy: 1.188085258061903
Energy: 1.3340859907845417
Energy: 1.3571953491862065
Energy: 1.1880852580648842
Energy: 1.3340859907837963
Energy: 1.1880852580581769
Energy: 1.3571953491854614
Energy: 1.1880852580723367
Energy: 1.3340859907845417
Energy: 1.3571953491884423
Energy: 1.1880852580663748
Energy: 1.3340859907830511
Energy: 1.188085258061903
Energy: 1.3571953491936593
Energy: 1.1880852580626484
Energy: 1.3340859907815605
Energy: 1.3571953491876971
Energy: 1.1880852580648842
Energy: 1.3340859907823055
Energy: 1.1880852580715917
Energy: 1.357195349184716
Energy: 1.1880852580604127
Energy: 1.3340859907882678

minimum gb energy = 1.1880852580581769 eV
minimum distance =  2.41028009470569 Angstroms
sigma value = 23