Model name: model_name=EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.520000764727593
cohesive_energy=4.450350029950939
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[6.53213822388336e-20, 1.42254058979592e-19, 2.41100346414222e-19, 3.3853671841093195e-19, 4.1388868768458594e-19, 4.67882040250386e-19, 5.07933251747118e-19, 5.40064904141988e-19, 5.66620981850538e-19, 5.88830354351046e-19, 6.075726166155779e-19, 6.2375940714888e-19, 6.38198222974488e-19, 6.51454632444204e-19, 6.63626368332702e-19, 6.7456442821302e-19, 6.841294227179999e-19, 6.92273286548622e-19, 6.990280632375659e-19, 7.043985593147339e-19, 7.083815704268579e-19, 7.11044387992566e-19, 7.1251678831921205e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.110331727561279e-19, 7.084152161361718e-19, 7.04440215907218e-19, 6.987060257341319e-19, 6.90715970860374e-19, 6.798436002220499e-19, 6.653086537984019e-19, 6.46321258508868e-19, 6.22179660987756e-19, 5.92335916826238e-19, 5.5644395587137e-19, 5.14446099764328e-19, 4.66276659263118e-19, 4.11680888282934e-19, 3.5014929465416396e-19, 2.81425530115368e-19, 2.11176493421004e-19, 1.515617439171516e-19, 1.228393631817702e-19, 1.7032739796053998e-19, 4.12057399791924e-19, 1.163337249594132e-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: 0.02048220928128935
Energy: 0.8463617051453955
Energy: 0.17734647171756854
Energy: 0.1761541580152905
Energy: 0.02551486573907926
Energy: 0.02238914834284082
Energy: 0.17671828204762652
Energy: 0.17922702084423003
Energy: 0.17521654500251668
Energy: 0.024277954470723798
Energy: 0.6747529800157902
Energy: 0.17366897206294943
Energy: 0.17675534448443575
Energy: 0.17886767971287099
Energy: 0.18041393657715604
Energy: 0.17448446814003848
Energy: 0.17404264296934915
Energy: 0.1760872324954763
Energy: 0.17463108343041145
Energy: 0.17885898287289068
Energy: 0.1793947971734823
Energy: 0.025874764541008656
Energy: 0.0210485195572255
Energy: 0.1752423005150394
Energy: 0.17575339530640485
Energy: 0.1784026967489356
Energy: 0.024424973396303968
Energy: 0.02086466597530134
Energy: 0.1747734492849254
Energy: 0.17734627362744312
Energy: 0.17861296251634434
Energy: 0.021742488852861758
Energy: 0.021891563724612813
Energy: 0.18054762259091142
Energy: 0.17364758410617498
Energy: 0.1800677006853676
Energy: 0.02181814825282535
Energy: 0.021139949848890567
Energy: 0.1736955942936482
Energy: 0.17346953658469472
Energy: 0.17716978798652913
Energy: 0.17494744310767887
Energy: 0.1811813172788163
Energy: 0.02265446373232974
Energy: 0.021132816548990168
Energy: 0.17688424992149288
Energy: 0.17637400539003317
Energy: 0.18033624272431192
Energy: 0.02366918615683075
Energy: 0.17933030503289366
Energy: 0.18047496168201352
Energy: 0.17410152907494475
Energy: 0.17759823147414625
Energy: 0.02185894523416006
Energy: 0.021077604147343654
Energy: 0.1819200265957143
Energy: 1.202936738449664
Energy: 0.1783025544924451
Energy: 0.02175020266221006
Energy: 0.021305269519676446
Energy: 0.02132702289350251
Energy: 0.18285784608772643
Energy: 0.17798348781931322
Energy: 0.17908623090549777
Energy: 0.18424351545243886
Energy: 0.02128353426969806
Energy: 0.18453403441380029
Energy: 0.17737013765581308
Energy: 0.1808921858367167
Energy: 0.18291767580192853

minimum gb energy = 0.02048220928128935 eV
minimum distance =  2.45074093787866 Angstroms
sigma value = 3


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

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Energy: 1.6704694758113094
Energy: 1.579680333163055
Energy: 1.5792910383718641
Energy: 1.701545342784138
Energy: 1.781850755347743
Energy: 1.5933215742035596
Energy: 1.65085099365366
Energy: 1.580489754226847
Energy: 1.6870805689062351
Energy: 1.5287184291455649
Energy: 1.6904032104199975
Energy: 1.5915313374502618
Energy: 1.3848351743696319
Energy: 1.244973585882588
Energy: 1.3900810465113072
Energy: 1.6120961707190715
Energy: 1.6089069427594245
Energy: 1.4057911996197638
Energy: 1.3632806273401195
Energy: 1.5521792611019187
Energy: 1.6870216042301336
Energy: 1.4126312809574095
Energy: 1.5658996107373637
Energy: 1.3770719444522486
Energy: 1.2429717925988781
Energy: 1.4218559427215363
Energy: 1.4156019552683548
Energy: 1.4430981250666688
Energy: 1.5443323066976644
Energy: 1.5526475369269135
Energy: 1.6378216835235477
Energy: 1.693367532317719
Energy: 1.2427585794277873
Energy: 1.2451926985187105
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Energy: 1.6043551768677629
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Energy: 1.544548912487261
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Energy: 1.65621568006419
Energy: 1.7756293730819117
Energy: 1.4317225599409273
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Energy: 1.6430217782163734
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Energy: 1.6720116530800435
Energy: 1.625543179821333
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Energy: 1.6257475346905974
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Energy: 1.583150496832962
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Energy: 1.6610541777883319
Energy: 1.6836810758489618
Energy: 1.6087809761062573
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Energy: 1.7851420032064995
Energy: 1.6739910347326832
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Energy: 1.6101420253138674
Energy: 1.6558902261999022
Energy: 1.3123159285666814
Energy: 1.65262459934
Energy: 1.614790327675495
Energy: 1.4164440674130025
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Energy: 1.1911217840162434
Energy: 1.6675024414395803
Energy: 1.6286476555562233
Energy: 1.4261271776830224
Energy: 1.3095352487749545
Energy: 1.4803771481035997
Energy: 1.4264024337394894
Energy: 1.4117848135214917
Energy: 1.5581359753255273
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Energy: 1.4819914968573724
Energy: 1.471168995623796
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Energy: 1.713782402032882
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Energy: 1.7310148134281915
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Energy: 1.677132326637762
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Energy: 1.7794627058318413
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Energy: 1.6388160558549687
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Energy: 1.6630873874054835
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Energy: 1.3938192763708466
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Energy: 1.672816256311017
Energy: 1.621893208999059
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Energy: 1.6256563130501624
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Energy: 1.6265211964492596
Energy: 1.3080974963481022
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Energy: 1.6099582375815822
Energy: 1.6100066667619912
Energy: 1.4165174250226693
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Energy: 1.693068578244284
Energy: 1.710471783630761
Energy: 1.6171452147723648
Energy: 1.41696187099007
Energy: 1.2630954219691242
Energy: 1.7911505874089442
Energy: 1.6215933574920747
Energy: 1.4325159581570681
Energy: 1.5538903827764357
Energy: 1.3920169115661718
Energy: 1.4681951154316286
Energy: 1.6926749933786995
Energy: 1.4078608786295268
Energy: 1.5501261676972689
Energy: 1.3897646724760355
Energy: 1.5170781075263289
Energy: 1.4888649483377856
Energy: 1.648935374195826
Energy: 1.3989604974607743
Energy: 1.4811922940977322
Energy: 1.3855154204241722
Energy: 1.5705583056480399
Energy: 1.3426218794331046
Energy: 1.3934549517678019
Energy: 1.4790202532826502
Energy: 1.387551210872021
Energy: 1.4874131155230348
Energy: 1.8017592012823116
Energy: 1.4014118595894662
Energy: 1.400275501592451
Energy: 1.6114176987355666
Energy: 1.5918698506292865
Energy: 1.4732402303318703
Energy: 1.251306053808012
Energy: 1.4778087122378856
Energy: 1.734014068399626
Energy: 1.7164144212607524
Energy: 1.5427360759770692
Energy: 1.6082043178530192
Energy: 1.6606818174403712
Energy: 1.7288794308761284
Energy: 1.6453471834884097
Energy: 1.2478287297581065
Energy: 1.5684464175543555
Energy: 1.4930954567969046
Energy: 1.7120172690313014
Energy: 1.6849726839399952
Energy: 1.4725797668759861
Energy: 1.5495145408126059
Energy: 1.6023530828881054
Energy: 1.594698918174969
Energy: 1.7149014978786778
Energy: 1.2508267775258446
Energy: 1.2481228600899892
Energy: 1.5793897221298208
Energy: 1.6437562580733134
Energy: 1.6920254222130664
Energy: 1.7228356146458441
Energy: 1.6298707134542478
Energy: 1.6558292370044774
Energy: 1.5853398285814397
Energy: 1.6343869851295163
Energy: 1.784091536850257
Energy: 1.6572783130727005
Energy: 1.64917465920243
Energy: 1.581114591817867
Energy: 1.6728694037683804

minimum gb energy = 1.1911217840162434 eV
minimum distance =  2.23521606180303 Angstroms
sigma value = 75


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

Energy: 2.7733720195770295
Energy: 1.4079993362004415
Energy: 1.4145029183047524
Energy: 1.4545851991751573
Energy: 1.3969951799536293
Energy: 1.4214253464585782
Energy: 1.42231237140937
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Energy: 1.4323645483668241
Energy: 2.061901707785116
Energy: 1.4740862327982234
Energy: 1.5430188335298465
Energy: 1.4342829786611055
Energy: 1.4312671110614434
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Energy: 1.6435607158892813
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Energy: 1.583708306639577
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Energy: 1.4748032783657106
Energy: 1.71783064182346
Energy: 1.4698841968541383
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minimum gb energy = 1.3854933362015778 eV
minimum distance =  2.24748912528686 Angstroms
sigma value = 105


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

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Energy: 1.5465919456447568
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Energy: 1.6109163282659555
Energy: 1.6513139493177924
Energy: 1.6507145677420185
Energy: 1.5894275139249066
Energy: 1.5904107558990326
Energy: 1.6030893913419515
Energy: 1.6028515234565197
Energy: 1.6250293013295887
Energy: 1.589066515044488
Energy: 1.5961337614423692
Energy: 1.6032126264169013
Energy: 1.7161219987010687
Energy: 1.5836222960370294
Energy: 1.5716316682217568
Energy: 1.5901928681522877
Energy: 1.5963598047888992
Energy: 1.5737233776357447
Energy: 1.5789329498053326
Energy: 1.5244593581123131
Energy: 1.590144943449783
Energy: 1.596087118578362
Energy: 1.5817147749649312
Energy: 1.5851232000213615
Energy: 1.6224798947795416
Energy: 1.5820041702579217
Energy: 1.653991580032885
Energy: 1.5860583748987063
Energy: 1.6226186240143103
Energy: 1.6216575327830733
Energy: 1.642769179703602
Energy: 1.5375975858956044
Energy: 1.5466016626503138
Energy: 1.6021225519288607
Energy: 1.5859335407958997
Energy: 1.5837480491468336
Energy: 1.6247626237272828
Energy: 1.582760643117787
Energy: 1.59764437288134
Energy: 1.579054640087877
Energy: 1.5792621630651842
Energy: 1.6219835186879379
Energy: 1.7006774014052195
Energy: 1.5673942502187188
Energy: 1.6124456723228198
Energy: 1.5643773706468336
Energy: 1.5705824404965152
Energy: 1.591961881411023
Energy: 1.4963322952401725
Energy: 1.5813020008033816
Energy: 1.5798342012138757
Energy: 1.5935980416593056
Energy: 1.6425433495159936
Energy: 1.603044865605192
Energy: 1.5682184779276587
Energy: 1.6645113034025076
Energy: 1.7063896208853513
Energy: 1.4977525179398237
Energy: 1.6022553595609828
Energy: 1.622979586398674
Energy: 1.6645439359093026
Energy: 1.6714967772051625
Energy: 1.5822755724682431
Energy: 1.5313978668405541
Energy: 1.4887727788021106
Energy: 1.4884831442146933
Energy: 1.5639333496583327
Energy: 1.5076056204552246
Energy: 1.5053440734039083
Energy: 1.5086874420192466
Energy: 1.5073850286960648
Energy: 1.579918709432167
Energy: 1.624082888680023
Energy: 1.5054543728054801
Energy: 1.5677267352077084
Energy: 1.5541888786108515
Energy: 1.48995713032598
Energy: 1.4885799026047895
Energy: 1.490440760260839
Energy: 1.5384805953733294
Energy: 1.5251029704271974
Energy: 1.5787357388298944

minimum gb energy = 1.4098815806295648 eV
minimum distance =  2.23609057131414 Angstroms
sigma value = 165


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

Energy: 1.9629377853372985
Energy: 1.5312018054805308
Energy: 1.4441047595026661
Energy: 1.5229104690642585
Energy: 1.3625711659328665
Energy: 1.8437169421636483
Energy: 1.4915647343241165
Energy: 1.4523847683016498
Energy: 1.5448356616848333
Energy: 1.4542755378443748
Energy: 1.4175872292196718
Energy: 1.5494667030945166
Energy: 1.5218370287497893
Energy: 1.5202128291180408
Energy: 1.5139060270355036
Energy: 1.500733387193024
Energy: 1.4329277063921617
Energy: 1.5549795879902832
Energy: 1.5534663396279262
Energy: 1.6115655695618116
Energy: 1.5174835697535767
Energy: 1.6199468578898384
Energy: 1.6697587009582606
Energy: 1.5249865415555766
Energy: 1.6163311441797221
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Energy: 1.5960674108699306
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Energy: 1.4997312095072024
Energy: 1.520434716096451
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Energy: 1.5410843067589186
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Energy: 1.3651625278499135
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Energy: 1.5991325358188364
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Energy: 1.449350023214754
Energy: 1.5740124199968029
Energy: 1.5688593096000196
Energy: 1.5116677319129135
Energy: 1.6059990112385998
Energy: 1.4720824268466073
Energy: 1.5899861753739208
Energy: 1.590686615558468
Energy: 1.5721927470751953
Energy: 1.5423835802396582
Energy: 1.4556566240031839
Energy: 1.5732473367960944
Energy: 1.581142330937367
Energy: 1.6000802529168339
Energy: 1.5722079062564531
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Energy: 1.4209892033546618
Energy: 1.59290304059099
Energy: 1.5266372258386682
Energy: 1.5877438537202113
Energy: 1.6307549929889933
Energy: 1.5299045177714707
Energy: 1.5964091391325945
Energy: 1.5096537484998755
Energy: 1.57915013740247
Energy: 1.5925377730194294
Energy: 1.417912400174473
Energy: 1.415004811309246
Energy: 1.448607909317564
Energy: 1.586305571955593
Energy: 1.5164144792612924
Energy: 1.5271339415600567
Energy: 1.5246232198676477
Energy: 1.5302082138170923
Energy: 1.6060700266746304
Energy: 1.5702385374125838
Energy: 1.4143853516172737
Energy: 1.508592626884998
Energy: 1.5303049269186628
Energy: 1.4785471248872446
Energy: 1.516972671789937
Energy: 1.521157733651476
Energy: 1.521049085962074
Energy: 1.4547346819998928
Energy: 1.41617553180483
Energy: 1.524043854282093
Energy: 1.5807797379002513
Energy: 1.423003958197108
Energy: 1.4143071414873896
Energy: 1.4545582097506973
Energy: 1.520388105416987
Energy: 1.5009820240392087
Energy: 1.4280470214314471
Energy: 1.4952865353062261
Energy: 1.4284967887790374
Energy: 1.5612206190160758
Energy: 1.574784768970541
Energy: 1.4873673865909331
Energy: 1.4981542006807078
Energy: 1.5114710330400305
Energy: 1.519557189540382
Energy: 1.541522926765414
Energy: 1.5058394831671407
Energy: 1.6060347974620375

minimum gb energy = 1.3625711659328665 eV
minimum distance =  2.2811322812751 Angstroms
sigma value = 41


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

Energy: 2.6930136493006085
Energy: 1.390385179969718
Energy: 1.3090007676569198
Energy: 1.2947825969973146
Energy: 1.2567374082646399
Energy: 1.2796958859132135
Energy: 1.321818310197981
Energy: 1.3336101963784308
Energy: 1.3229589217573137
Energy: 1.3790844025652975
Energy: 1.4195783695361877
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Energy: 1.2963128928014143
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Energy: 1.299488173003006
Energy: 1.3953080841723802
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Energy: 1.3589998635500682
Energy: 1.4014480827739384
Energy: 1.317921639424734
Energy: 1.3881779465788555
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Energy: 1.3750510506372904
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Energy: 1.3596498797385868
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Energy: 1.443518110708019
Energy: 1.3698476291236805
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Energy: 1.4426647143146845
Energy: 1.3171853498845145
Energy: 1.44275488857538
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Energy: 1.3559137874773277
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Energy: 1.3086139102439602
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Energy: 1.3703646326021315
Energy: 1.3995091087227065
Energy: 1.3269281157068569
Energy: 1.3208822307640429
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Energy: 1.337670479481644
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Energy: 1.5941611414240826
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Energy: 1.3398484384159242
Energy: 1.3187041622612194
Energy: 1.301677521720149
Energy: 1.3397228996741886
Energy: 1.3217616296461967
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Energy: 1.3780949166578753
Energy: 1.3398535935194693
Energy: 1.3819641247288774
Energy: 1.3294223858169805
Energy: 1.4019702812537878
Energy: 1.4070454703473596
Energy: 1.3401945880049166
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Energy: 1.3237089798011243
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Energy: 1.356999856696402
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Energy: 1.3943711730387833
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Energy: 1.3510274254223154
Energy: 1.340180610592511
Energy: 1.3841849122978798
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Energy: 1.4005975218642546
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Energy: 1.3835091288895989
Energy: 1.383119708324426
Energy: 1.4552240590686338
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Energy: 1.3543928902529694
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Energy: 1.3845913505980523
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Energy: 1.3823319524010054
Energy: 1.3758045556707608
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Energy: 1.4175909656419923
Energy: 1.4060364504295562
Energy: 1.2980903948165123
Energy: 1.3406113073902968
Energy: 1.3655388239162414
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Energy: 1.4123431728271398
Energy: 1.2982352827043526
Energy: 1.3588754384160509
Energy: 1.4206054727113178
Energy: 1.5994127120497905
Energy: 1.4032766638370981
Energy: 1.353891156943564
Energy: 1.3978732533467082
Energy: 1.401924498187153
Energy: 1.6019302162697924
Energy: 1.4049793554798573
Energy: 1.5094862589779618
Energy: 1.3886710433985257
Energy: 1.323718216566548
Energy: 1.392522018038541
Energy: 1.3668843145489562
Energy: 1.343252530107807
Energy: 1.323379514459636
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Energy: 1.3513183661633525
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Energy: 1.3803519038045882
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Energy: 1.3165887550372783
Energy: 1.3148894205686037
Energy: 1.373414035248466
Energy: 1.3389900716620915
Energy: 1.3831671948272353
Energy: 1.286566082714237
Energy: 1.332524274648097
Energy: 1.3230808825811775
Energy: 1.3441305027017887
Energy: 1.3755571408927803
Energy: 1.36461934991454
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Energy: 1.3450332757353944
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Energy: 1.3738097017393578
Energy: 1.3680684848306066
Energy: 1.3031620860095177
Energy: 1.3209835085610244
Energy: 1.3144401258963805
Energy: 1.3040025149771288
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Energy: 1.3180599505436041
Energy: 1.356609154635627
Energy: 1.3271785322946794
Energy: 1.3341064005640186
Energy: 1.4531154891731566
Energy: 1.3022379384671874
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Energy: 1.3071030657970568
Energy: 1.3056618804515874
Energy: 1.337144109902417
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Energy: 1.4491206575292377
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Energy: 1.3517839500124618
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Energy: 1.3555139653141548
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Energy: 1.6065630958766137
Energy: 1.4317060580596581
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Energy: 1.3101134618965706
Energy: 1.3977464408430071
Energy: 1.3974707804503494
Energy: 1.393750865842379
Energy: 1.3949142338696845
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Energy: 1.357069622467231
Energy: 1.3549428486102069
Energy: 1.3665287315802754
Energy: 1.3935134971405825
Energy: 1.3622513011290125
Energy: 1.3559879751262824
Energy: 1.3556277831587398
Energy: 1.3594294059312941
Energy: 1.3550185721415173
Energy: 1.3870223379310471
Energy: 1.3256927575387654
Energy: 1.3543394711013328
Energy: 1.3889605706304595
Energy: 1.3395466544620085
Energy: 1.378397599015033
Energy: 1.3562055069551298
Energy: 1.3530163989031194
Energy: 1.4139697584418696
Energy: 1.3636190834391033
Energy: 1.3976646114995417
Energy: 1.3154394551766224
Energy: 1.5967726793142498
Energy: 1.4024364259630608
Energy: 1.3636891220694518
Energy: 1.3899037856954624
Energy: 1.3178212890767036
Energy: 1.5975939601428557
Energy: 1.3565558857480622
Energy: 1.4179004711275474
Energy: 1.3152455675641985
Energy: 1.3148386577239157
Energy: 1.3140570376348157
Energy: 1.3579380601134214
Energy: 1.3395273459552728
Energy: 1.3275070283808592
Energy: 1.3233916401380517
Energy: 1.3137942692821352
Energy: 1.3835057901820078
Energy: 1.303295665937296
Energy: 1.3867146857121497
Energy: 1.2792766300233283
Energy: 1.3740864991056363
Energy: 1.3811395272748959
Energy: 1.3116254049571865
Energy: 1.3898742323388016
Energy: 1.3335957605417867
Energy: 1.3674615524605411
Energy: 1.3264737800341584
Energy: 1.4269669718274423
Energy: 1.349520241694234
Energy: 1.3602627955700581
Energy: 1.3004749953314108
Energy: 1.3002563673105507
Energy: 1.3587422594344576
Energy: 1.3401713402466031
Energy: 1.3218723830168093
Energy: 1.265531767920034
Energy: 1.3980926405795344
Energy: 1.3289179921281669
Energy: 1.4540778532201946
Energy: 1.4478066490781465
Energy: 1.3218129741742706
Energy: 1.27773845275957
Energy: 1.2726790054905592
Energy: 1.4241520211042848
Energy: 1.29402976134983
Energy: 1.3408367534818755

minimum gb energy = 1.2567374082646399 eV
minimum distance =  2.2912901840817 Angstroms
sigma value = 185


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

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Energy: 0.8416729020192179
Energy: 0.834688972564737
Energy: 0.6693660294132524
Energy: 0.8792529203602696
Energy: 0.8958856359071324
Energy: 0.6819652724235596
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Energy: 0.8202172847888469
Energy: 1.137988615044504
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Energy: 0.7916689291551626
Energy: 0.8602317400565386
Energy: 0.646753126532697
Energy: 0.6518575918859554
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Energy: 0.6799453828211913
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Energy: 0.8794577934923129
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Energy: 0.6479582814099755
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Energy: 0.6791187125780194
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Energy: 0.8846398489364423
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Energy: 0.9681233523463071
Energy: 0.6703435947518829
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Energy: 0.6467449327768
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Energy: 0.8552977626261785
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Energy: 0.6494760430247579
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Energy: 0.646755540483852
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Energy: 0.6600054141239909
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Energy: 0.6786810515744612
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Energy: 0.8550503474001008
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Energy: 0.9100188779755977
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Energy: 0.9020715593025895
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Energy: 0.9214552420921719
Energy: 0.6789552207433178
Energy: 0.8092414903292253
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Energy: 0.9999492644956843
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Energy: 0.6786840835056916
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Energy: 0.6786066823789105
Energy: 0.6473577743380781
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Energy: 0.8495460687265204
Energy: 0.8456399633756565
Energy: 0.8378156474750317
Energy: 0.8238037760366664
Energy: 0.7978694932530515
Energy: 0.8261956229716768
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Energy: 0.6795584331132708
Energy: 0.816348200253325
Energy: 0.6464292624642256
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Energy: 0.6598668281019593
Energy: 0.6473082213984725
Energy: 0.673994775200506
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Energy: 0.8408727055927101
Energy: 0.681466155949587
Energy: 1.102445080047821
Energy: 0.6647918381088777
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Energy: 0.8801656093215074
Energy: 0.6788913878888109
Energy: 0.6808604756506855
Energy: 0.6469435563985014
Energy: 0.6514154930155942
Energy: 0.7846484384959258
Energy: 0.8398270519470624
Energy: 0.8246781097063147
Energy: 0.6469100201743117
Energy: 0.6651093344242759
Energy: 0.6474397765920467
Energy: 0.8269449826418478
Energy: 0.6475508180874439
Energy: 0.6595451635926611
Energy: 0.9191325329213484
Energy: 0.7880590554123218
Energy: 0.8927340522192422
Energy: 0.826354382530236
Energy: 0.6789949097411573
Energy: 0.8922004160513993
Energy: 0.6468365228871205
Energy: 0.6593193215430109
Energy: 0.8196863032278665
Energy: 0.9342038758118675
Energy: 0.9520609839283605
Energy: 0.8363532670937703
Energy: 0.8644033519143093
Energy: 0.8243840913267125
Energy: 0.8925606070180765
Energy: 0.9260757639849339
Energy: 0.9518301043908026
Energy: 1.3594153309382535
Energy: 0.6663110431759532
Energy: 0.818599878924768
Energy: 0.6794593628300113
Energy: 0.9333471819579853
Energy: 0.9317232871486009
Energy: 0.6506834351865485
Energy: 0.677471333743362
Energy: 0.6514602030444642
Energy: 0.6782570765504736
Energy: 0.658500314323042
Energy: 0.6468175920614769
Energy: 1.1385014585788955
Energy: 0.8245642080940262
Energy: 0.8331273044576746
Energy: 0.663389124890583
Energy: 0.6733837130154938
Energy: 0.8767704357991392
Energy: 0.651409337725874
Energy: 0.6867444181311745
Energy: 0.6684157237334709
Energy: 1.1381092906065784

minimum gb energy = 0.6408840925174709 eV
minimum distance =  2.33629627626972 Angstroms
sigma value = 33


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

Energy: 1.1813161039811293
Energy: 1.1759663927545956
Energy: 1.1745312580397091
Energy: 1.1750017721494281
Energy: 1.1475068080554773
Energy: 1.1453363914689192
Energy: 1.1711064906097537
Energy: 1.1753108986273177
Energy: 1.2104652344010924
Energy: 1.147374839132126
Energy: 1.1538184697866996
Energy: 1.1775361965068991
Energy: 1.17464651766143
Energy: 1.1739644356697652
Energy: 1.1743345485418089
Energy: 1.153247469225884
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Energy: 1.173381969831014
Energy: 1.1741960738100088
Energy: 1.1720911758183092
Energy: 1.1954675716858463
Energy: 1.174419679697157
Energy: 1.1765951150165899
Energy: 1.2198123294444214
Energy: 1.1435281751282786
Energy: 1.1964295262732625
Energy: 1.1746773507774928
Energy: 1.1770114307921966
Energy: 1.2207786453345228
Energy: 1.1440082309789583
Energy: 1.2984340211244934
Energy: 1.2396324765956215
Energy: 1.1746809213877119
Energy: 1.1737312080292268
Energy: 1.1445519681669092
Energy: 1.3046306567287491
Energy: 1.2399072721075202
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Energy: 1.1722739260302213
Energy: 1.1446825112337387
Energy: 1.1709852115127453
Energy: 1.1781468485579134
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Energy: 1.1528154482812802
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Energy: 1.17120150530499
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Energy: 1.1524309135637747
Energy: 1.2367413473529774
Energy: 1.1713935406526963
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Energy: 1.308832382206266
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Energy: 1.3607862938111606
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Energy: 1.266647578485838
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Energy: 1.1522445610113392
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Energy: 1.1450077171791255
Energy: 1.1535363373539025
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Energy: 1.15211688344846
Energy: 1.1873066353410169
Energy: 1.2956375141932237
Energy: 1.1479926093058197
Energy: 1.2005846829017603
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Energy: 1.4405429508013685
Energy: 1.1409577232368058
Energy: 1.1525662031218868
Energy: 1.1755282049509534
Energy: 1.1518730384778768
Energy: 1.1987964241400062
Energy: 1.1460930479236489
Energy: 1.2091045325778462
Energy: 1.30769984093501
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Energy: 1.1466714217480682
Energy: 1.152024693983414
Energy: 1.1520431262880553
Energy: 1.1753968002526498
Energy: 1.1985247295693373
Energy: 1.1451431572786535
Energy: 1.1453887306422554
Energy: 1.1519850281155994
Energy: 1.1483726133928878
Energy: 1.1969509022297042
Energy: 1.1452059229073894
Energy: 1.1456177811780999
Energy: 1.1958645679857154
Energy: 1.1507429660693054
Energy: 1.3095691940651268
Energy: 1.1456387923189157
Energy: 1.1433104945174979
Energy: 1.1954243419195059
Energy: 1.1501390418299589
Energy: 1.4259767950323068
Energy: 1.1461320625517617
Energy: 1.1430289002029481
Energy: 1.3119207635347725
Energy: 1.2531271632897225
Energy: 1.1466598547262725
Energy: 1.198014309823895
Energy: 1.1519820516463923
Energy: 1.3866272510547204
Energy: 1.3522808625774358
Energy: 1.1465179086042983
Energy: 1.197895972959623
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Energy: 1.1525813139944998
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Energy: 1.152076152732386
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Energy: 1.1522695999050736
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Energy: 1.1436334196178342
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Energy: 1.1719961330884126
Energy: 1.2782275174395417
Energy: 1.1501869147636234
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Energy: 1.3278709747394253
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Energy: 1.1712733742062966
Energy: 1.1496170206482321
Energy: 1.1439907174973347
Energy: 1.3271317780770566
Energy: 1.1715611136937116
Energy: 1.171304890354755
Energy: 1.2092056366031476
Energy: 1.1524471774944565
Energy: 1.2379853775458263
Energy: 1.2273039651513977
Energy: 1.171369697314958
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Energy: 1.1525552084207433
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Energy: 1.1771078803618649
Energy: 1.1714661197721083
Energy: 1.2931268622537544
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Energy: 1.143109937130115
Energy: 1.17613726200658
Energy: 1.1744560913141455
Energy: 1.2198575162777168
Energy: 1.3058423405309563

minimum gb energy = 1.1409577232368058 eV
minimum distance =  2.27618040163381 Angstroms
sigma value = 219


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

Energy: 2.1982665633814187
Energy: 1.555494808654246
Energy: 1.5576128954192205
Energy: 1.532795006094727
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Energy: 1.5465536476110262
Energy: 1.5377540502663176
Energy: 1.5024155302958877
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Energy: 1.5385138606325157
Energy: 1.521671728242927
Energy: 1.5136183375927241
Energy: 1.5019732097111622
Energy: 1.550133332344286
Energy: 1.5360324959536156
Energy: 1.546661844862475
Energy: 1.5140772591451184
Energy: 1.5362497236061352
Energy: 1.5023835568835846
Energy: 1.55405173545835
Energy: 1.5292327619026447
Energy: 1.510018800687004
Energy: 1.5361894382696446
Energy: 1.5042656754000057
Energy: 1.553107550599645
Energy: 1.5110306021722513
Energy: 1.511143020308849
Energy: 1.5040038023887952
Energy: 1.5364072300265872
Energy: 1.4870114374193242
Energy: 1.4880784590656206
Energy: 1.5110412361890073
Energy: 1.505919747425826
Energy: 1.538035952314298
Energy: 1.4875920483887908
Energy: 1.488421794309198
Energy: 1.5101147019015912

minimum gb energy = 1.452567061110603 eV
minimum distance =  2.29048932464807 Angstroms
sigma value = 15


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

Energy: 2.530749686135114
Energy: 1.7058460192863274
Energy: 1.740577905600217
Energy: 1.7128182051720628
Energy: 1.7760402882018962
Energy: 1.6907168298484936
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Energy: 1.708276675572498
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Energy: 1.7517842907572998
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Energy: 1.7217084516050938
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Energy: 1.6767720865132298
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Energy: 1.6779974829874187
Energy: 1.6968198411532878
Energy: 1.7207575544852536
Energy: 1.7198094281987883
Energy: 1.7326209500450542
Energy: 1.6739454416235415
Energy: 1.6989361837704806
Energy: 1.7280558426695756
Energy: 1.7044815615561881
Energy: 1.7275036547903904
Energy: 1.671928977819323
Energy: 1.6687073918263444
Energy: 1.6948365535808225
Energy: 1.7053662344421447
Energy: 1.6824940023472401
Energy: 1.6705280117840549
Energy: 1.668615950160691
Energy: 1.7642265938605102
Energy: 1.7175064900399477
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minimum gb energy = 1.6388370943600385 eV
minimum distance =  2.25688286353395 Angstroms
sigma value = 293


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

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Energy: 1.7087912148126863
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Energy: 1.7020112973895902
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Energy: 1.68588861366069
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Energy: 1.6955634408981897
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Energy: 1.7016008221859527
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Energy: 1.6754979253443567
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Energy: 1.6640051484873597
Energy: 1.6636505794898186
Energy: 1.7185755593284302
Energy: 1.685330911160338
Energy: 1.637196553351934
Energy: 1.7180468778395075
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Energy: 1.6852396936782894
Energy: 1.6319913674404902
Energy: 1.7055156308397061
Energy: 1.7072913279242852
Energy: 1.7467330915008643
Energy: 1.7815131865531244
Energy: 1.6392262147368843
Energy: 1.6830438160018097
Energy: 1.7003742759751572
Energy: 1.6839139036674853
Energy: 1.7210901836865418
Energy: 1.6363722990300884
Energy: 1.6740593472233158
Energy: 1.7001731051619793
Energy: 1.6865382502108042
Energy: 1.7189495990920682
Energy: 1.6394324832216167
Energy: 1.6821726490225373
Energy: 1.667097833823715
Energy: 1.701202616575994
Energy: 1.7541651224719979
Energy: 1.6836224901326131
Energy: 1.6811493984137673
Energy: 1.6695496245188015
Energy: 1.6844746805823652
Energy: 1.7884357726319051
Energy: 1.7850757540386923
Energy: 1.682829544350986
Energy: 1.7593179302639486
Energy: 1.7265288480203183
Energy: 1.6752235284459502
Energy: 1.673879880690981
Energy: 1.6801779815136733
Energy: 1.7642649117298
Energy: 1.7261077698464404
Energy: 1.6995734720037576
Energy: 1.75639263560722
Energy: 1.6765631857913839
Energy: 1.6961526638418252
Energy: 1.7898635315063918
Energy: 1.709126761636562
Energy: 1.746720205008815
Energy: 1.7042297906391661
Energy: 1.6961881741273457
Energy: 1.7913181499547608
Energy: 1.7111137253208948
Energy: 1.7449650556734804
Energy: 1.6858414168142575
Energy: 1.7701894390770094
Energy: 1.81788968583479
Energy: 1.683497812988789
Energy: 1.7563185719055774
Energy: 1.6854546506265289
Energy: 1.7017929437418446
Energy: 1.8024922680425586
Energy: 1.6828848451998968
Energy: 1.7516115973146804
Energy: 1.6313450911173335
Energy: 1.7140858628818507
Energy: 1.6809795116109714
Energy: 1.6713693668221827
Energy: 1.7497426866444434
Energy: 1.71094327848758
Energy: 1.6807511918435671
Energy: 1.6786404671494182
Energy: 1.6723935730581065
Energy: 1.7196179797564517

minimum gb energy = 1.6266658456516678 eV
minimum distance =  2.26288281393389 Angstroms
sigma value = 293


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

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Energy: 1.6669386710483283
Energy: 1.7614315864435766
Energy: 1.6397976062146176
Energy: 1.6020349149076718
Energy: 1.59142070528426
Energy: 1.6343165518960596
Energy: 1.7605141841192156
Energy: 1.6873939514133205
Energy: 1.6002990435089524
Energy: 1.777913875493293
Energy: 1.6230101871622908
Energy: 1.6233117594037716
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Energy: 1.738091228699544
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Energy: 1.6535068857149975
Energy: 1.6433725490612363
Energy: 1.6519929986472195
Energy: 1.6537914561242655
Energy: 1.62618530353782
Energy: 1.7682651922761052
Energy: 1.7348264446191208
Energy: 1.6528205375346117
Energy: 1.6240742261499588
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Energy: 1.7618118811447854
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Energy: 1.762037071275967
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Energy: 1.5978049038674567
Energy: 1.651220654952651
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Energy: 1.6158692285848495
Energy: 1.762083966030039
Energy: 1.5916001775958903
Energy: 1.651255407055693
Energy: 1.6219480310988967
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Energy: 1.650130470324909
Energy: 1.5904902586636098
Energy: 1.6467579016139124
Energy: 1.622133091430914
Energy: 1.6256390578631068
Energy: 1.6509945090186102
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Energy: 1.6411677115815535
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Energy: 1.6011786015117004
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Energy: 1.621053627559697
Energy: 1.6496381381706517
Energy: 1.6496379581061944
Energy: 1.5950151803600858
Energy: 1.7504256095645554
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Energy: 1.6254219705012807
Energy: 1.736701533308799
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Energy: 1.6938894815838037
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Energy: 1.5904011274751568
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Energy: 1.7458308236921791
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Energy: 1.6402433762829938
Energy: 1.602429156652285
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Energy: 1.7598742620379713
Energy: 1.6881426680948446
Energy: 1.6007179872450978
Energy: 1.737377700075972
Energy: 1.6231055852464518
Energy: 1.6234419843653851
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Energy: 1.6793157481720655
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Energy: 1.762591525928077
Energy: 1.5942831017907022
Energy: 1.5975337571503194
Energy: 1.6511992209316988
Energy: 1.7632703709573816
Energy: 1.7617863300389307
Energy: 1.5935430746676762
Energy: 1.599000585600144
Energy: 1.6517607362950686
Energy: 1.735787881309871
Energy: 1.6524872643284825
Energy: 1.600639826348751
Energy: 1.5931470001672654
Energy: 1.630489768905138
Energy: 1.635387383328286
Energy: 1.6517334246504598
Energy: 1.5992916927456704
Energy: 1.5937845625256493
Energy: 1.6263885900018868
Energy: 1.638223286643425
Energy: 1.6512865513940573
Energy: 1.7616964891154645
Energy: 1.6393382232889508
Energy: 1.6267767440806173
Energy: 1.6173387982882779
Energy: 1.6509824515130718
Energy: 1.761023836462322
Energy: 1.6411014368815315
Energy: 1.63547649803373
Energy: 1.615851947646018
Energy: 1.760225813775425
Energy: 1.5915827394844346
Energy: 1.6512512340126597
Energy: 1.622264550046617
Energy: 1.6400130459089381
Energy: 1.760694129860487
Energy: 1.5902567603721791
Energy: 1.6499571614318311
Energy: 1.6216981664649572
Energy: 1.6368344935127264
Energy: 1.6507799464632376
Energy: 1.7362934439550792
Energy: 1.64098050210094
Energy: 1.592831423164347
Energy: 1.6008540027105638
Energy: 1.6817211649640964
Energy: 1.7776981416119109
Energy: 1.6349727501466302
Energy: 1.590826652610831
Energy: 1.6014900413526578
Energy: 1.6218990060588354
Energy: 1.6195533701140818
Energy: 1.6509463725034335
Energy: 1.5964717110547333
Energy: 1.74394351231173
Energy: 1.6223354018671408
Energy: 1.6496969713723137
Energy: 1.649792984281682
Energy: 1.5950464625583454
Energy: 1.6333579560768543
Energy: 1.634432922421528
Energy: 1.6264174603272212
Energy: 1.7472573045651338
Energy: 1.6919320328279512
Energy: 1.6906794763763833
Energy: 1.641076016514048
Energy: 1.626222710292149
Energy: 1.7483269792304055
Energy: 1.6496010204058136
Energy: 1.6567550334991081
Energy: 1.5951143846598326
Energy: 1.6421489491296246
Energy: 1.6302504322275333
Energy: 1.6288568951395865
Energy: 1.7414519984155414
Energy: 1.5956305460866345
Energy: 1.6452900763339529
Energy: 1.5905065730300103
Energy: 1.6360259539065543
Energy: 1.741609954081674

minimum gb energy = 1.5902567603721791 eV
minimum distance =  2.29180739033862 Angstroms
sigma value = 15


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

Energy: 2.8170957606417115
Energy: 1.717385341764573
Energy: 1.7483562998108688
Energy: 1.6435911003049721
Energy: 1.6174372764857126
Energy: 1.6066834991019026
Energy: 1.6726612985963714
Energy: 1.7538695977473044
Energy: 1.6144857485607669
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Energy: 1.6285961482762656
Energy: 1.728425615385581
Energy: 1.6971133150892002
Energy: 1.6994848754419043
Energy: 1.675103837525352
Energy: 1.588655947759328
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Energy: 1.6426598029364874
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Energy: 1.7021976939005312
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Energy: 1.8670672300567537
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Energy: 1.872305273042183
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Energy: 1.61012891956972
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Energy: 1.6021663705698097
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Energy: 1.665541412895013
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Energy: 1.602483729679384
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Energy: 1.6139557613323106
Energy: 1.6561797280978832
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Energy: 1.7322912493838765
Energy: 1.9428330667312066
Energy: 1.6153924508967772
Energy: 1.634007569709259
Energy: 1.6297397324933183
Energy: 1.6386519758466997
Energy: 1.8549081704909707
Energy: 1.6633388488476986
Energy: 1.6604521065337354
Energy: 1.6619680066151894
Energy: 1.637744071120398
Energy: 1.7000424755022687
Energy: 1.6558274003603295
Energy: 1.6205167975407906
Energy: 1.7607319760005142
Energy: 1.880731788813358
Energy: 1.8820454981031782
Energy: 1.8267292244470192
Energy: 1.5846420173894238
Energy: 1.7737347487843906
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Energy: 1.6899102918376867
Energy: 1.6810922621901916
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Energy: 1.80618939880033
Energy: 1.7623372014924552
Energy: 1.717385895429768
Energy: 1.5651246147226894
Energy: 1.6063202632110885
Energy: 1.6890762511450157
Energy: 1.7401607205306755
Energy: 1.7272201660907889
Energy: 1.7494495140581967
Energy: 1.706353953732864
Energy: 1.7096487074989484
Energy: 1.6834264815505953
Energy: 1.6843168741668597
Energy: 1.6446546052438091
Energy: 1.6328783934835902
Energy: 1.6913789336209895
Energy: 1.6813686809341601
Energy: 1.690238785762078
Energy: 1.644839836485171
Energy: 1.8523434979702214
Energy: 1.7309993735835678
Energy: 1.6793375453165817
Energy: 1.7776229476527823
Energy: 1.6594604156674404
Energy: 1.8792919032786652
Energy: 1.7699297176510942
Energy: 1.7012210964346832
Energy: 1.6450219871707725
Energy: 1.8452400441819554
Energy: 1.847168300783818
Energy: 1.8628875020542266
Energy: 1.8246958490014242
Energy: 1.872344377884996
Energy: 1.8747941136185755
Energy: 1.8711202877453712
Energy: 1.8687634812496858
Energy: 1.7896548592649546
Energy: 1.8489720996985541
Energy: 1.8488771600142238
Energy: 1.9201503949872785
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Energy: 1.6570629327624804
Energy: 1.8083493287909724
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Energy: 1.7534193472450947
Energy: 1.658327108208364
Energy: 1.805112126237133
Energy: 1.7317461467695618
Energy: 1.8894711571911575
Energy: 1.6146328742594067
Energy: 1.6168323487150482
Energy: 1.9258044645073782
Energy: 1.9182661441223852
Energy: 1.8895842679668375
Energy: 1.6155270484578448
Energy: 1.640353316150082
Energy: 1.9496063693115044
Energy: 2.1298391757815187
Energy: 1.6209464216266762
Energy: 1.6142706195791765
Energy: 1.6581133142797269
Energy: 1.7083778673300116
Energy: 1.7471534427536557
Energy: 1.6195153331244616
Energy: 1.6223522893027427
Energy: 1.6609014016003047
Energy: 1.6905352049304196
Energy: 1.8624068753362208
Energy: 1.6243188885112858
Energy: 1.6186604640006559
Energy: 1.6320549715212889
Energy: 1.6565066343501191
Energy: 1.7464323080731408
Energy: 1.6230271453665661
Energy: 1.617378649696916
Energy: 1.6346496458761328
Energy: 1.6592405674311985
Energy: 1.7394137675353736
Energy: 1.784299428850556
Energy: 1.6929483382065023
Energy: 1.7573847284238553
Energy: 1.7472914843267915
Energy: 1.8123052914187163
Energy: 1.7176078507875374
Energy: 1.683366091132888
Energy: 1.7312995511013891
Energy: 1.7465298667620592
Energy: 1.6976083253231817
Energy: 1.6597252514025596
Energy: 1.926692163229625
Energy: 1.6979753775236617
Energy: 1.6440667287641282
Energy: 1.6490205889483889
Energy: 1.6647754247187052
Energy: 1.9204682890036013
Energy: 1.65220703313402
Energy: 1.6448667724626969
Energy: 1.650859000112009
Energy: 1.757521453978087
Energy: 1.7227591031390244
Energy: 1.6598626783678398
Energy: 1.64651406838513
Energy: 1.6464861018391974
Energy: 1.7140747718847076
Energy: 1.7057791405889604
Energy: 1.6674864092044848
Energy: 1.6471533884975265
Energy: 1.6488824716954935
Energy: 1.875936869269238
Energy: 1.6999795164980867
Energy: 1.646146564023668
Energy: 1.5909679600279614
Energy: 1.6521572205335935
Energy: 1.8758054818755754
Energy: 1.7095533811152455
Energy: 1.6432110924891608
Energy: 1.5911804341370357
Energy: 1.650474477250408
Energy: 1.7379337812335884
Energy: 1.6560302665253401
Energy: 1.6801799837445155
Energy: 1.660944842021043
Energy: 1.7151241096159162
Energy: 1.740258309560891
Energy: 1.6184163984928301
Energy: 1.6475946280300202
Energy: 1.663612312532747
Energy: 1.714109386462265
Energy: 1.6826578214039722
Energy: 1.6803502427762615
Energy: 1.822556131258963
Energy: 1.7080663215322995
Energy: 1.6516216197314655
Energy: 1.6838788322176763
Energy: 1.696550645351415
Energy: 1.6445451955211177
Energy: 1.7113130431555013
Energy: 1.6485512777392493
Energy: 1.6635586308476162
Energy: 1.7407794059755233
Energy: 1.8588065444761985
Energy: 1.7598157740050444
Energy: 1.7009387553021695
Energy: 1.6633237588025598
Energy: 1.742147621726895
Energy: 1.8600406726818566
Energy: 1.7168115905738957
Energy: 1.6963159768039229
Energy: 1.89067221959476
Energy: 1.8627384477476863
Energy: 1.8605224504738689
Energy: 1.8796234728612327
Energy: 1.6972421115907128
Energy: 1.8916871723917672
Energy: 1.8602267084963064
Energy: 1.8597786580269708
Energy: 1.8744939913151284
Energy: 1.5846560551709301
Energy: 1.6102497940594473
Energy: 1.8308311630406138
Energy: 1.6972852017757543
Energy: 1.9548271776752417
Energy: 1.7124834073661148
Energy: 1.6102095080866279
Energy: 1.8413152056624182
Energy: 1.8976284514197181
Energy: 1.9171637045592702
Energy: 1.7144638326114283
Energy: 1.9166604460306593
Energy: 1.9475602717234397
Energy: 1.9437894723130134
Energy: 1.9066442718379994
Energy: 1.6574954648357396
Energy: 1.9664706011243613
Energy: 1.9465684159851608
Energy: 1.9431266205024007
Energy: 1.81934457946438
Energy: 1.61764374941626
Energy: 1.632459341531401
Energy: 1.8759359547690175
Energy: 1.6264857830265516
Energy: 1.620491832346518
Energy: 1.6206143853652057
Energy: 1.6324720025288797
Energy: 1.8926834026583463
Energy: 1.6265273718561146
Energy: 1.6154068814398361
Energy: 1.6214940443434165
Energy: 1.6654174537351976
Energy: 1.7476112261734853
Energy: 1.6242337463776426
Energy: 1.6203401633549086
Energy: 1.6184936580570628
Energy: 1.749957744348569
Energy: 1.7509605920411184
Energy: 1.62252836057561
Energy: 1.6223548063818467
Energy: 1.619140304134551
Energy: 1.8216183158309351
Energy: 1.657522653001104
Energy: 1.6569388355279289
Energy: 1.7571399071578644
Energy: 1.7092796776756984
Energy: 1.8554633452904261
Energy: 1.656510615619146
Energy: 1.623012202431599
Energy: 1.785904130569394
Energy: 1.7679762873811737
Energy: 1.6171734461638048
Energy: 1.6186689890148767
Energy: 1.7168311226514463
Energy: 1.962280623284085
Energy: 1.72508431059574
Energy: 1.6538705582615962
Energy: 1.6668729590977427
Energy: 1.7269489118876125
Energy: 1.971847874775124
Energy: 1.6165207250697504
Energy: 1.6172983985215177
Energy: 1.6154998173992743
Energy: 1.6202440073860873
Energy: 1.7770843208648444
Energy: 1.6673933905676646
Energy: 1.6583324464907212
Energy: 1.6632530396831748
Energy: 1.6589499743212903
Energy: 1.744670802049782
Energy: 1.6407536112761922
Energy: 1.6449397817724638
Energy: 1.7056159109944682
Energy: 1.8770044247440982
Energy: 1.8804059203478005
Energy: 1.7322278583157138
Energy: 1.6686740248117817
Energy: 1.759531307892794
Energy: 1.8764789678319338
Energy: 1.6806561233224682
Energy: 1.660980441810386
Energy: 1.7835619761476933
Energy: 1.8041638811974126
Energy: 1.671340946677147
Energy: 1.6881158637222353
Energy: 1.567603238485343
Energy: 1.6104191295280403
Energy: 1.6754312433994814
Energy: 1.7861565984724121
Energy: 1.7614672293368996
Energy: 1.584688610475169

minimum gb energy = 1.5651246147226894 eV
minimum distance =  2.25169833823382 Angstroms
sigma value = 437


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

Energy: 2.160294485829197
Energy: 1.7015694396277354
Energy: 1.705406326388154
Energy: 1.5339730537710594
Energy: 1.5171736988401767
Energy: 2.158976543808236
Energy: 1.6234090939397487
Energy: 1.7033179814816277
Energy: 1.9103192136479457
Energy: 1.5030921429131046
Energy: 1.6706316601040465
Energy: 1.7152530156117565
Energy: 1.7991113973877237
Energy: 1.7993538014098085
Energy: 1.7164703302660662
Energy: 1.6682488490000846
Energy: 1.7111540946836348
Energy: 1.800127797090316
Energy: 1.7295023665323677
Energy: 1.5493981768295544
Energy: 1.6587526753798194
Energy: 1.6893278410922725
Energy: 1.7290010155425066
Energy: 1.553189419466258
Energy: 1.6538826136252318
Energy: 1.6618445976669896
Energy: 1.6868181355525151
Energy: 1.7291260755020343
Energy: 1.5521668619815272
Energy: 1.6531575468595472
Energy: 1.5496365928786053
Energy: 1.548832158755376
Energy: 1.725903092838474
Energy: 1.6599327369895547
Energy: 1.6509507364964542
Energy: 1.5511741086833206
Energy: 1.549580854077763
Energy: 1.7255744373725557
Energy: 1.6583834470025771
Energy: 1.6489283163441983
Energy: 1.5536233254472243
Energy: 1.7302170652900766
Energy: 1.5467319121821024
Energy: 1.55381382199417
Energy: 1.5787518800102651
Energy: 1.5513471372194232
Energy: 1.7268174869559498
Energy: 1.5456538704228906
Energy: 1.5538805087315988
Energy: 1.6713632039055064
Energy: 1.576888597370438
Energy: 1.5479015883500529
Energy: 1.5009565296535774
Energy: 1.5568192354225672
Energy: 2.156504232560767
Energy: 1.5780543789221722
Energy: 1.5473706007306822
Energy: 1.655589054049955
Energy: 1.558399952218282
Energy: 2.1597579629957435
Energy: 1.6831215187278448
Energy: 1.655748828576149
Energy: 1.650767480909626
Energy: 1.5533067819865969
Energy: 1.7319541190874723
Energy: 1.6646818087089
Energy: 1.6528735621559614
Energy: 1.651783455688832
Energy: 1.5547431905058307
Energy: 1.7351883309800047
Energy: 1.6880372496526903
Energy: 1.654841448509942
Energy: 1.5471448004012651
Energy: 1.7347085061016347
Energy: 1.730824139955104
Energy: 1.6899955063744605
Energy: 1.6531487006463172
Energy: 1.54771172218917
Energy: 1.9896228107617702
Energy: 1.730737302731821
Energy: 1.548491986812309
Energy: 1.7356669295279783
Energy: 1.5142311890826767
Energy: 1.7288481432581213
Energy: 1.5498673684424666
Energy: 1.54716445969974
Energy: 1.7291515760758673
Energy: 1.5141169233386198
Energy: 1.729081396739947
Energy: 1.5480512975243874
Energy: 1.5162890920917402
Energy: 1.6884074561426863
Energy: 1.5088770637165192
Energy: 1.5160397063666433
Energy: 1.6209394855627095
Energy: 1.6519824083209316
Energy: 1.6877567309062842
Energy: 1.5118056451440702
Energy: 1.5293940244221498
Energy: 1.624285113619364
Energy: 1.5019059866307913
Energy: 1.5011114590144619
Energy: 1.5111414166275545
Energy: 1.6551502650892895
Energy: 1.504579519149943
Energy: 1.5011369243181665
Energy: 1.5010930151688364
Energy: 1.5104101698789876
Energy: 1.6643790153107874
Energy: 1.5481846396639594
Energy: 1.5075241781969966
Energy: 1.510990466180727
Energy: 1.5048244084794304
Energy: 1.7651133046672811
Energy: 1.506243315313691
Energy: 1.5056648132475499
Energy: 1.5075381989483119
Energy: 1.5050985483430541
Energy: 1.788029419856471
Energy: 1.5038699922442638
Energy: 1.5026625301224141
Energy: 1.508374082887852
Energy: 1.7270875008006668
Energy: 1.7263368037758497
Energy: 1.5232781437541716
Energy: 1.5029640287963288
Energy: 1.5109733811621437
Energy: 1.7281665085605566
Energy: 1.7254797504395536
Energy: 1.5208170017144622
Energy: 1.8021658327209344
Energy: 1.5117760946272796
Energy: 1.776276075032977
Energy: 1.5936732275952685
Energy: 1.5046521544527982
Energy: 1.8024230960687937
Energy: 1.5117895209022907
Energy: 1.8342827457384243
Energy: 1.5096158833040956
Energy: 1.5713505958486287

minimum gb energy = 1.5009565296535774 eV
minimum distance =  2.32523702122011 Angstroms
sigma value = 33