Model name: model_name=EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614728152751923
cohesive_energy=3.524844861148951
mass=63.546
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: 0.016696274446419346
Energy: 0.3935387527265519
Energy: 0.8206966567161155
Energy: 0.3934287653247474
Energy: 0.01669627444590715
Energy: 0.3935387527257836
Energy: 0.5788846722422072
Energy: 0.4022821065440818
Energy: 0.017053722008119186
Energy: 0.22081271291861673
Energy: 0.017093844645641378
Energy: 0.4022821065438257
Energy: 0.01705372200837528
Energy: 0.22081271291912896
Energy: 0.016696274446163246
Energy: 0.3935387527260397
Energy: 0.5788846722432031
Energy: 0.39342876532500354
Energy: 0.016696274446163246
Energy: 0.3935387527257836
Energy: 0.402948011499445
Energy: 0.4022821065440818
Energy: 0.017053722008119186
Energy: 0.22081271291861673
Energy: 0.017093844645641378
Energy: 0.4022821065440818
Energy: 0.017053722008119186
Energy: 0.2208127129188729
Energy: 0.016696274446419346
Energy: 0.3935387527257836
Energy: 0.5788846722422072
Energy: 0.39342876532449134
Energy: 0.016696274446163246
Energy: 0.3935387527257836
Energy: 0.40294801149918885
Energy: 0.4022821065440818
Energy: 0.01705372200837528
Energy: 0.22081271291861673
Energy: 0.017093844645641378
Energy: 0.4022821065443379
Energy: 0.01705372200837528
Energy: 0.22081271291912896

minimum gb energy = 0.01669627444590715 eV
minimum distance =  2.53326239493296 Angstroms
sigma value = 5


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

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Energy: 0.9214265411440402
Energy: 0.9439295399883733
Energy: 0.952876181966358
Energy: 0.9684730960017641
Energy: 0.9214265411348626
Energy: 0.9439295399944917
Energy: 0.9068030902630088
Energy: 0.9034050665100765
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Energy: 0.9068030902477126
Energy: 0.903405066503958
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Energy: 0.9006718199679448
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Energy: 0.9006718199679448
Energy: 0.9592027228291069
Energy: 0.8977824839350647
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Energy: 0.903418090780101
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Energy: 0.9375077278354469
Energy: 0.9040966951868514
Energy: 0.9035408604981646
Energy: 0.9006016615609935
Energy: 0.9375077278385061
Energy: 0.9040966951868514
Energy: 0.9035408605134607
Energy: 0.9189671837610242
Energy: 0.927062142567482
Energy: 0.9274468193188053
Energy: 0.9458536245353854
Energy: 0.918967183757965
Energy: 0.9270621425766595
Energy: 0.9274468193096278
Energy: 0.9585270683387703
Energy: 0.9101330051066661
Energy: 0.9450723918769114
Energy: 0.9154650751130082
Energy: 0.958527068347948
Energy: 0.9101330050974883
Energy: 0.9450723918769114
Energy: 0.8888820674517977
Energy: 0.9178538598630418
Energy: 0.912987343435534
Energy: 0.9183825963231554
Energy: 0.8888820674517977
Energy: 0.9178538598538641
Energy: 0.9129873434324748
Energy: 0.9119154411329915
Energy: 0.93971697505279
Energy: 0.931725961458483
Energy: 0.9387150054473878
Energy: 0.9119154411329915
Energy: 0.9397169750497308
Energy: 0.9317259614523645
Energy: 0.8884487592465726
Energy: 0.9266885615636229
Energy: 0.9292908899820617
Energy: 0.9139794038971187
Energy: 0.8884487592190955
Energy: 0.9266885615636229
Energy: 0.9292908899729396

minimum gb energy = 0.8848956907836029 eV
minimum distance =  2.29772832298038 Angstroms
sigma value = 401


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

Energy: 0.9201437224839578
Energy: 0.9411348487373185
Energy: 0.9577263548471763
Energy: 0.9348588177299312
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Energy: 0.8974090066434923
Energy: 0.9236106931010448
Energy: 0.9173967446227363
Energy: 0.8935783932678689
Energy: 0.927597932421805
Energy: 0.939422007387106
Energy: 0.9109257276743854
Energy: 0.8935783932678689
Energy: 0.9275979324183325
Energy: 0.9394220073826234
Energy: 0.8934310083768445
Energy: 0.9022596060276667
Energy: 0.9099469303772084
Energy: 0.9258811393896647
Energy: 0.8934310083827794
Energy: 0.9022596060214162
Energy: 0.909946930380681
Energy: 0.8975856975678861
Energy: 0.90978556060639
Energy: 0.9566035706023941
Energy: 0.927720714331428
Energy: 0.8975856975668128
Energy: 0.909785560613335
Energy: 0.9566035706079503
Energy: 0.9107326645729587
Energy: 0.916071216597509
Energy: 0.9481527879957897
Energy: 0.9216510712663976
Energy: 0.91073266457258
Energy: 0.9160712165829243
Energy: 0.9481527879920016
Energy: 0.9107941073931127
Energy: 0.9449348147069224
Energy: 0.9060530980848095
Energy: 0.9220108872615967
Energy: 0.9107941074052981
Energy: 0.9449348147059123
Energy: 0.9060530980837993
Energy: 0.8976941461267601
Energy: 0.9329322494207101
Energy: 0.959349863874809
Energy: 0.9447684948985307
Energy: 0.8976941461388823
Energy: 0.9329322494162274
Energy: 0.9593498638803651
Energy: 0.9121331214837586
Energy: 0.9194547496095069
Energy: 0.9954405355738095
Energy: 0.9271009983051245
Energy: 0.912133121477508
Energy: 0.9194547496157576
Energy: 0.9954405355696425
Energy: 0.9196843813124596
Energy: 0.9411348487359295
Energy: 0.9173086587274878
Energy: 0.9348588177271532
Energy: 0.9196843813127752
Energy: 0.9411348487397175
Energy: 0.9173086587309603
Energy: 0.905905191826296
Energy: 0.9220888241123328
Energy: 0.9469996692675612
Energy: 0.9270156609334179
Energy: 0.9059051918238339
Energy: 0.9220888241141006
Energy: 0.946999669260616

minimum gb energy = 0.893431008373372 eV
minimum distance =  2.27808909562506 Angstroms
sigma value = 311


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

Energy: 0.9975980320079622
Energy: 0.937484280133941
Energy: 0.9872726544665682
Energy: 0.9243453381534485
Energy: 0.997598032009566
Energy: 0.937484280135545
Energy: 0.9593623140993812
Energy: 0.984997005985852
Energy: 0.9376500049111026
Energy: 0.9401212500722544
Energy: 0.9613981191846068
Energy: 0.9849970059854513
Energy: 0.9376500049091344
Energy: 0.9401212500758632
Energy: 0.9217440299246968
Energy: 0.9134736336223479
Energy: 0.9899864842868666
Energy: 0.9280479431086908
Energy: 0.9217440299267017
Energy: 0.9134736336251547
Energy: 0.9899864842864655
Energy: 0.9230772588429446
Energy: 0.924321592085044
Energy: 0.9923679678245441
Energy: 0.9335948621841588
Energy: 0.9230772588433456
Energy: 0.924321592085846
Energy: 0.9923679678225393
Energy: 0.9427138912111962
Energy: 0.928081953356857
Energy: 0.9673125105338422
Energy: 0.9290075372381446
Energy: 0.942713891214003
Energy: 0.928081953356456
Energy: 0.9673125105354462
Energy: 0.931499424933066
Energy: 0.9081425135648624
Energy: 0.9458226976128549
Energy: 0.9232354689393631
Energy: 0.9314994249338681
Energy: 0.9081425135604518
Energy: 0.9458226976124539
Energy: 0.9372152431914054
Energy: 0.9338093608510103
Energy: 0.9278888728718716
Energy: 0.9391362679557533
Energy: 0.9372152431894003
Energy: 0.9338093608486043
Energy: 0.9428551547778203
Energy: 0.9226386121838585
Energy: 0.9292046179810685
Energy: 0.942516209611236
Energy: 0.931721519134902
Energy: 0.9226386121834574
Energy: 0.9292046179822715
Energy: 0.9425162096096323
Energy: 0.9215011535485863
Energy: 0.9263379350123654
Energy: 0.9326906348870342
Energy: 0.9366934950022602
Energy: 0.9215011535465814
Energy: 0.9263379350131674
Energy: 0.9326906348858313
Energy: 0.9280216047721593
Energy: 0.9378284939530801
Energy: 0.9977054971893511
Energy: 0.9254641104473211
Energy: 0.9280216047733623
Energy: 0.9378284939510753
Energy: 0.997705497190955
Energy: 0.9780407852463747
Energy: 0.9191301017415826
Energy: 0.9414414326719491
Energy: 0.9211928992476249
Energy: 0.9780407852483795
Energy: 0.9191301017391769
Energy: 0.9414414326711472
Energy: 0.9713193286112615
Energy: 0.9482651154677529
Energy: 0.9613383440962356
Energy: 0.9536306214039235
Energy: 0.9713193286108605
Energy: 0.948265115466149
Energy: 0.9613383440958347
Energy: 0.957519563846393
Energy: 0.9323762225258546
Energy: 0.9879381347837816
Energy: 0.9385725206117861
Energy: 0.9575195638439873
Energy: 0.9323762225266566
Energy: 0.9879381347821777
Energy: 0.9330870422392228
Energy: 0.915691322954236
Energy: 0.9561667358716612
Energy: 0.9034318109534132
Energy: 0.9330870422388219
Energy: 0.9156913229538349
Energy: 0.9561667358700572
Energy: 0.9611462111908868
Energy: 0.9408606485737943
Energy: 0.9835069560985059
Energy: 0.9333205142413422
Energy: 0.9611462111948966
Energy: 0.9408606485770019
Energy: 0.9835069561009118
Energy: 0.9538729712024875
Energy: 0.9533720658607495
Energy: 0.9641531330490506
Energy: 0.9370332539895186
Energy: 0.9538729712000816
Energy: 0.9533720658619524
Energy: 0.9641531330486496
Energy: 0.9921712678336193
Energy: 0.907247239786336
Energy: 0.9521045035402399
Energy: 0.9424901741185194
Energy: 0.9921712678332184
Energy: 0.9072472397871381
Energy: 0.9521045035410418
Energy: 0.9258182393256945
Energy: 0.9257660162382856
Energy: 0.953557392286612
Energy: 0.9355594525036582
Energy: 0.9258182393252936
Energy: 0.9257660162386866
Energy: 0.953557392285409
Energy: 0.9375772692636665
Energy: 0.9368934496736937
Energy: 0.9513373052365051
Energy: 0.9279317407244745
Energy: 0.9375772692616979
Energy: 0.9368934496708868
Energy: 0.9513373052381089
Energy: 0.9224213556369633
Energy: 0.9304850257524221
Energy: 0.9425603118827146
Energy: 0.9289614637170733
Energy: 0.9224213556393691
Energy: 0.9304850257564317
Energy: 0.9425603118831154
Energy: 0.9213075122765095
Energy: 0.9407106908674772
Energy: 0.9490254495089717
Energy: 0.9339821252299871
Energy: 0.9213075122765095
Energy: 0.940710690869883
Energy: 0.9490254495053629
Energy: 0.922763223859687
Energy: 0.903250550112422
Energy: 0.9481468073641294
Energy: 0.9260617543846508
Energy: 0.9227632238600881
Energy: 0.9032505501156296
Energy: 0.9481468073657332
Energy: 0.9607832830833435
Energy: 0.9292983035695973
Energy: 0.8971987400912673
Energy: 0.9393839895630771
Energy: 0.9607832830833435
Energy: 0.9292983035675925
Energy: 0.8971987400920693
Energy: 0.9403910577573118
Energy: 0.9070717360541561
Energy: 1.0136702015942867
Energy: 0.9392918434921272
Energy: 0.9403910577589157
Energy: 0.9070717360489434
Energy: 1.0136702015950887
Energy: 0.9370458939181608
Energy: 0.9279762549045257
Energy: 0.9397221590494145
Energy: 0.9015413878982311
Energy: 0.9370458939181608
Energy: 0.927976254900516
Energy: 0.939722159054627
Energy: 0.9586911698570386
Energy: 0.9314784256879886
Energy: 0.9280315660119827
Energy: 0.9378850157009575
Energy: 0.9586911698566378
Energy: 0.9314784256883895
Energy: 0.9280315660163935
Energy: 0.9738286028323695
Energy: 0.9241977497899969
Energy: 0.9807102505936955
Energy: 0.9245873210413045
Energy: 0.9738286028315676
Energy: 0.9241977497916007
Energy: 0.9807102505952995
Energy: 0.9809713046695387
Energy: 0.9374899038400363
Energy: 0.9659903392261243
Energy: 0.9410915125503925
Energy: 0.9809713046687368
Energy: 0.9374899038392343
Energy: 0.9659903392285301
Energy: 0.9406859997855892
Energy: 0.9015650694677119
Energy: 0.9954237924296858
Energy: 0.9262701201327184
Energy: 0.9406859997855892
Energy: 0.9015650694701177
Energy: 0.9954237924308887
Energy: 0.9328172492984471
Energy: 0.919139264637773
Energy: 1.0019991380210034
Energy: 0.906995227793712
Energy: 0.9328172492988481
Energy: 0.9191392646361691
Energy: 1.0019991380193995
Energy: 0.9578838646884664
Energy: 0.928117537934481
Energy: 0.9664349141568245
Energy: 0.9369888816495271
Energy: 0.9578838646864615
Energy: 0.9281175379316742
Energy: 0.9664349141568245
Energy: 0.9225364888495908
Energy: 0.9434499292848995
Energy: 0.9439829498000626
Energy: 0.903208417100581
Energy: 0.9225364888511948
Energy: 0.9434499292861023
Energy: 0.9439829497988597
Energy: 0.9213086881672021
Energy: 0.9352733298330596
Energy: 0.9509597876674154
Energy: 0.9376815663871104
Energy: 0.9213086881696079
Energy: 0.9352733298334606
Energy: 0.9509597876666135
Energy: 0.9225066165580658
Energy: 0.9291993489283793
Energy: 0.9558730974756393
Energy: 0.9263916950273969
Energy: 0.9225066165584668
Energy: 0.929199348930785
Energy: 0.9558730974728324
Energy: 0.9432619147210379
Energy: 0.9278929795866047
Energy: 0.9597145341956476
Energy: 0.9336141573823673
Energy: 0.9432619147226053
Energy: 0.9278929795898123
Energy: 0.9597145341988554
Energy: 0.9267311384719944
Energy: 0.9357739939177504
Energy: 0.9778034665337265
Energy: 0.925615671781999
Energy: 0.9267311384687866
Energy: 0.9357739939157453
Energy: 0.9778034665341274

minimum gb energy = 0.8971987400912673 eV
minimum distance =  2.30744648576383 Angstroms
sigma value = 39


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

Energy: 0.9240107354520556
Energy: 0.9488253240926418
Energy: 0.9212882757078102
Energy: 0.9490972287769156
Energy: 0.92401073544827
Energy: 0.9488253240982775
Energy: 0.9368469803697301
Energy: 0.9142439373286241
Energy: 0.9221786459186726
Energy: 0.8561658379094764
Energy: 0.9189900523501493
Energy: 0.9142439373343026
Energy: 0.9221786459196192
Energy: 0.8561658379052174
Energy: 0.9240016933366637
Energy: 0.8636431807750249
Energy: 0.9149618736032522
Energy: 0.9246963806701317
Energy: 0.9240016933380834
Energy: 0.8636431807702926
Energy: 0.9149618736051451
Energy: 0.9201489361396469
Energy: 0.9533633153346018
Energy: 0.8561147235888796
Energy: 0.9354593589158533
Energy: 0.9201489361391737
Energy: 0.9533633153346018
Energy: 0.8561147235869866
Energy: 0.9767591834756449
Energy: 0.9249440865750518
Energy: 0.9033273359154487
Energy: 0.9248330044821619
Energy: 0.9767591834922079
Energy: 0.9249440865731589
Energy: 0.9033273359154487
Energy: 0.9200473222503205
Energy: 0.9247353136346967
Energy: 0.9926193303852028
Energy: 0.9343127178995436
Energy: 0.9200473222583654
Energy: 0.9247353136370627
Energy: 0.9926193303837831
Energy: 1.053407950731189
Energy: 0.924951539532402
Energy: 0.9399628472921412
Energy: 0.9240999095721999
Energy: 1.0534079507292962
Energy: 0.9249515395352413
Energy: 0.9399628472902484
Energy: 0.9270645575562226
Energy: 0.8592700572809755
Energy: 0.9814620086227431
Energy: 0.8592524265324907
Energy: 0.9270645575552761
Energy: 0.8592700572738772
Energy: 0.9814620086208503
Energy: 1.0533564943002642
Energy: 0.9240886553036959
Energy: 0.9676546979795321
Energy: 0.9242597936478725
Energy: 1.0533564942988445
Energy: 0.9240886553079549
Energy: 0.9676546979833179
Energy: 0.9200514809350924
Energy: 0.9352354759374237
Energy: 0.9928778828140137
Energy: 0.9246972018744605
Energy: 0.9200514809379318
Energy: 0.9352354759350576
Energy: 0.9928778828144869
Energy: 0.9808046858206283
Energy: 0.9250576242504185
Energy: 0.9020761297767625
Energy: 0.9239158837817296
Energy: 0.9808046858229943
Energy: 0.9250576242489987
Energy: 0.9020761297762891
Energy: 0.9201467957553296
Energy: 0.935487949200615
Energy: 0.8559528922634919
Energy: 0.9535802203110658
Energy: 0.920146795750124
Energy: 0.9354879492119723
Energy: 0.8559528922601792
Energy: 0.9240304383022304
Energy: 0.9247136189798407
Energy: 0.9159979778029528
Energy: 0.8637793626335215
Energy: 0.9240304383112216
Energy: 0.9247136189746783
Energy: 0.9159979777996402
Energy: 0.9142967145782748
Energy: 0.9213808343748578
Energy: 0.8562274903473236
Energy: 0.9219903764888925
Energy: 0.9142967145787481
Energy: 0.9213808343781705
Energy: 0.8562274903373858
Energy: 0.9240107354530022
Energy: 0.9488253240921686
Energy: 0.976209895361922
Energy: 0.949097228775969
Energy: 0.9240107354487431
Energy: 0.9488253240964274
Energy: 0.9762098953647614
Energy: 0.9142439373281507
Energy: 0.9221786459177261
Energy: 0.8561658379108961
Energy: 0.9189900523539349
Energy: 0.9142439373333563
Energy: 0.9221786459181994
Energy: 0.856165837906164
Energy: 0.9240016933376103
Energy: 0.8636431807740783
Energy: 0.9244525378916337
Energy: 0.9246963806720246
Energy: 0.9240016933380834
Energy: 0.8636431807717122
Energy: 0.9244525379044107
Energy: 0.9201489361377541
Energy: 0.9533633153355484
Energy: 0.8561147235879332
Energy: 0.9354593589158533
Energy: 0.9201489361387005
Energy: 0.953363315332709
Energy: 0.8561147235865134
Energy: 0.9767591834817969
Energy: 0.9249440865759982
Energy: 0.9240148945777449
Energy: 0.9248330044816885
Energy: 0.9767591834950472
Energy: 0.9249440865741052
Energy: 0.9240148945853164
Energy: 0.9200473222507937
Energy: 0.9247353136318573
Energy: 0.9926193303842562
Energy: 0.9343127179009634
Energy: 0.920047322257892
Energy: 0.9247353136365896
Energy: 0.9926193303828366
Energy: 1.053407950731189
Energy: 0.924951539532402
Energy: 0.9527039478943595
Energy: 0.924099909574566
Energy: 1.0534079507278764
Energy: 0.9249515395352413
Energy: 0.9527039478943595
Energy: 0.9270645575576422
Energy: 0.8592700572786094
Energy: 0.9814620086241629
Energy: 0.8592524265320175
Energy: 0.9270645575566959
Energy: 0.8592700572724575
Energy: 0.9814620086222701
Energy: 1.0533564943012106
Energy: 0.9240886553051155
Energy: 0.8972551124759092
Energy: 0.9242597936497653
Energy: 1.0533564942988445
Energy: 0.9240886553079549
Energy: 0.8972551124778021
Energy: 0.9200514809350924
Energy: 0.93523547593979
Energy: 0.9928778828144869
Energy: 0.9246972018763534
Energy: 0.9200514809393514
Energy: 0.9352354759355308
Energy: 0.9928778828149601
Energy: 0.9808046858225211
Energy: 0.9250576242527847
Energy: 0.9016228312744393
Energy: 0.9239158837807833
Energy: 0.9808046858234676
Energy: 0.9250576242489987
Energy: 0.9016228312753858
Energy: 0.9201467957548563
Energy: 0.9354879492020347
Energy: 0.8559528922634919
Energy: 0.9535802203129587
Energy: 0.9201467957487044
Energy: 0.9354879492124455
Energy: 0.8559528922601792
Energy: 0.9240304383022304
Energy: 0.9247136189793675
Energy: 0.9230210282893075
Energy: 0.8637793626335215
Energy: 0.9240304383098019
Energy: 0.9247136189751515
Energy: 0.9230210282954594
Energy: 0.9142967145778016
Energy: 0.9213808343748578
Energy: 0.8562274903468503
Energy: 0.9219903764893658
Energy: 0.9142967145792213
Energy: 0.9213808343795901
Energy: 0.8562274903364395
Energy: 0.924010735452529
Energy: 0.9488253240931149
Energy: 0.9705787796075602
Energy: 0.9490972287764423
Energy: 0.92401073544827
Energy: 0.9488253240982775
Energy: 0.9705787796118193
Energy: 0.9142439373281507
Energy: 0.9221786459186726
Energy: 0.8561658379094764
Energy: 0.9189900523496759
Energy: 0.9142439373333563
Energy: 0.9221786459200922
Energy: 0.8561658379047442

minimum gb energy = 0.8559528922601792 eV
minimum distance =  2.331236962507 Angstroms
sigma value = 21


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

Energy: 0.9723837191958732
Energy: 0.9938132199666655
Energy: 0.8991603300021549
Energy: 0.9939754885288432
Energy: 0.9723837191935752
Energy: 0.9938132199609209
Energy: 0.9098682668256947
Energy: 0.9746977465021791
Energy: 0.9165041065465194
Energy: 0.8498826974970423
Energy: 0.9156979976118589
Energy: 0.9746977465016047
Energy: 0.9165041065482168
Energy: 0.8498826975022125
Energy: 0.9552081642697955
Energy: 0.9024118864147931
Energy: 0.9183614166385557
Energy: 0.9190756678500838
Energy: 0.9552081642663487
Energy: 0.9024118864136441
Energy: 0.9183614166431514
Energy: 0.9743546227978449
Energy: 0.9165272511679613
Energy: 0.8814788769362039
Energy: 0.9151164430820138
Energy: 0.9743546228018665
Energy: 0.9165272511691104
Energy: 0.8814788769356293
Energy: 0.9191896429196384
Energy: 0.8796176376784668
Energy: 0.9198356078765605
Energy: 0.8792526585838046
Energy: 0.9191896429213618
Energy: 0.8796176376824881
Energy: 0.919835607877135
Energy: 0.9745646826090206
Energy: 0.8824127353636543
Energy: 0.9439524376213111
Energy: 0.9145537065828828
Energy: 0.9745646826049993
Energy: 0.8824127353648032
Energy: 0.9439524376259067
Energy: 0.9600363393994936
Energy: 0.879674703185936
Energy: 0.9439618456254238
Energy: 0.9347866218608719
Energy: 0.9600363393977702
Energy: 0.8796747031842126
Energy: 0.9439618456265728
Energy: 0.9546816082983229
Energy: 0.9209379733735473
Energy: 0.9424112357018747
Energy: 0.9143249440068469
Energy: 0.9546816083006208
Energy: 0.9209379733729729
Energy: 0.9424112357007258
Energy: 0.9599080825388998
Energy: 0.91432717348642
Energy: 0.8979023098463831
Energy: 0.883743086385815
Energy: 0.9599080825434958
Energy: 0.9143271734898668
Energy: 0.8920553074291501
Energy: 0.9468242551302218
Energy: 0.9428491759432255
Energy: 0.8825438987182683
Energy: 0.9141396700385672
Energy: 0.9468242551347914
Energy: 0.9428491759415019
Energy: 0.8825438987125498
Energy: 0.9815828353197177
Energy: 0.9214627179403118
Energy: 0.9318937926896157
Energy: 0.9200808131177606
Energy: 0.9815828353237389
Energy: 0.9214627179385882
Energy: 0.9318937926913391
Energy: 0.8706436485199998
Energy: 0.8792470995577373
Energy: 0.8789746660576674
Energy: 0.8780324405983101
Energy: 0.8706436485217232
Energy: 0.8792470995623332
Energy: 0.8789746660559439
Energy: 0.98116500788857
Energy: 0.9223417957972463
Energy: 0.9416610927081551
Energy: 0.9144710839466602
Energy: 0.981165007890868
Energy: 0.9223417957960974
Energy: 0.941661092711602
Energy: 0.8704106436331053
Energy: 0.8792471024007051
Energy: 0.9200976786243058
Energy: 0.8780924221153367
Energy: 0.8704106436267861
Energy: 0.8792471024058756
Energy: 0.9200976786289017
Energy: 0.9711403386440888
Energy: 0.8851960480359484
Energy: 0.9162370798586034
Energy: 0.914178530161095
Energy: 0.9711403386435143
Energy: 0.8851960480336504
Energy: 0.9162370798517356
Energy: 0.8705294304833315
Energy: 0.9616489952963925
Energy: 0.9242355133078144
Energy: 0.9275107169523216
Energy: 0.8705294304787359
Energy: 0.961648995295818
Energy: 0.9242355133055165
Energy: 0.9697444453216224
Energy: 0.8854274746283951
Energy: 0.9492859043319245
Energy: 0.9142416739512814
Energy: 0.969744445321048
Energy: 0.8854274746272462
Energy: 0.9492859043330734
Energy: 0.8704117422789606
Energy: 0.9310421868177798
Energy: 0.9243800191137742
Energy: 0.9167996061799839
Energy: 0.8704117422720667
Energy: 0.9310421868218011
Energy: 0.9243800191091784
Energy: 0.9552688849250304
Energy: 0.8852045637889923
Energy: 0.9645531812535448
Energy: 0.9165090563601327
Energy: 0.9552688849210089
Energy: 0.8852045637918646
Energy: 0.9645531812483745
Energy: 0.8704820486617442
Energy: 0.9497359067618574
Energy: 0.9248673638168563
Energy: 0.9498051776669146
Energy: 0.870482048664042
Energy: 0.9497359067618574
Energy: 0.9248673638168563
Energy: 0.9552804395245317
Energy: 0.9152418569317887
Energy: 0.9640694226293628
Energy: 0.8853310824810304
Energy: 0.9552804395251061
Energy: 0.9152418569323632
Energy: 0.964069422624767
Energy: 0.8703684078271798
Energy: 0.9167512754556676
Energy: 0.9246971417144295
Energy: 0.9310334676413389
Energy: 0.8703684078254564
Energy: 0.9167512754522208
Energy: 0.9246971417173018
Energy: 0.9695651014341432
Energy: 0.9145824127255159
Energy: 0.9493716615271877
Energy: 0.8854032266564945
Energy: 0.96956510143759
Energy: 0.9145824127249413
Energy: 0.9493716615277621
Energy: 0.8704844527693563
Energy: 0.9279452707678959
Energy: 0.9240822799653268
Energy: 0.9616779016381867
Energy: 0.8704844527693563
Energy: 0.9279452707650234
Energy: 0.9240822799641778
Energy: 0.9698968411093214
Energy: 0.9142113965047148
Energy: 0.8895670283946535
Energy: 0.8850969129882865
Energy: 0.9698968411093214
Energy: 0.914211396508162
Energy: 0.8895670283952279

minimum gb energy = 0.8498826974970423 eV
minimum distance =  2.3236230657648 Angstroms
sigma value = 113


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

Energy: 0.8983750365581196
Energy: 0.9299541796177745
Energy: 0.8556682310925119
Energy: 0.9301714151855868
Energy: 0.8983750365773563
Energy: 0.9299541796177745
Energy: 0.8634336903972896
Energy: 0.9623504788034021
Energy: 0.9405857723981611
Energy: 0.8539803812140961
Energy: 0.9406960342700504
Energy: 0.9623504788066082
Energy: 0.9405857723949549
Energy: 0.85398038121089
Energy: 0.8984706772647699
Energy: 0.8703473800609214
Energy: 0.8740954873795759
Energy: 0.9139765990737271
Energy: 0.8984706772775362
Energy: 0.870347380054509
Energy: 0.8740954873859881
Energy: 0.8528663448406604
Energy: 0.9443703690486505
Energy: 0.8580380571998298
Energy: 0.9446055861182964
Energy: 0.852866344831042
Energy: 0.9443703690358259
Energy: 0.8580380571966237
Energy: 0.9364424872091605
Energy: 0.8685595638453735
Energy: 0.8621422653855535
Energy: 0.8588313423515778
Energy: 0.9364424872155145
Energy: 0.8685595638549336
Energy: 0.8621422653824057
Energy: 0.8538769871663321
Energy: 0.8899053368609149
Energy: 0.9191170334125702
Energy: 0.8935582662101186
Energy: 0.8538769871759504
Energy: 0.8899053368545025
Energy: 0.919117033409364
Energy: 0.8745952985070075
Energy: 0.8699356530284131
Energy: 0.9050660659897377
Energy: 0.8774033334688633
Energy: 0.8745952984942411
Energy: 0.8699356530220008
Energy: 0.9050660659801193
Energy: 0.8664360202466587
Energy: 0.9039161471374384
Energy: 0.8953196570976707
Energy: 0.8875050042253835
Energy: 0.8664360202530709
Energy: 0.9039161471310262
Energy: 0.8953196570944646
Energy: 0.8745080296133734
Energy: 0.8842044406777364
Energy: 0.9232464321414398
Energy: 0.8626367153362817
Energy: 0.8745080296261979
Energy: 0.8842044406649703
Energy: 0.9511880261968537
Energy: 0.8624769219837091
Energy: 0.9043625248360513
Energy: 0.878713621650889
Energy: 0.877616809693871
Energy: 0.8624769219933275
Energy: 0.904362524852082
Energy: 0.8787136216637135
Energy: 0.8743444206271147
Energy: 0.8843628572429413
Energy: 0.9168926401706294
Energy: 0.8618432913082341
Energy: 0.8743444206207023
Energy: 0.8843628572525597
Energy: 0.9168926401738356
Energy: 0.862660296966316
Energy: 0.8879512003672249
Energy: 0.916576065672339
Energy: 0.8886170190388332
Energy: 0.862660296966316
Energy: 0.8879512003800495
Energy: 0.9165760656851636
Energy: 0.8749884878593109
Energy: 0.8765572204372442
Energy: 0.9318737953194622
Energy: 0.8878375524281935
Energy: 0.8749884878528987
Energy: 0.8765572204308318
Energy: 0.9318737953194622
Energy: 0.8948176433743917
Energy: 0.9172928194738467
Energy: 0.9221180661116825
Energy: 0.8684612317033329
Energy: 0.8948176433711855
Energy: 0.9172928194706405
Energy: 0.9221180661309193
Energy: 0.875015970900365
Energy: 0.8929222196536073
Energy: 0.9200467000919625
Energy: 0.9174151915715322
Energy: 0.8750159708811281
Energy: 0.8929222196568134
Energy: 0.9200467000855502
Energy: 0.894651451656593
Energy: 0.8884890204060204
Energy: 0.8866951543510321
Energy: 0.8559747300745923
Energy: 0.8946514516694175
Energy: 0.8884890204060204
Energy: 0.8866951543510321
Energy: 0.8935418469911952
Energy: 0.9010185721899149
Energy: 0.955663789053024
Energy: 0.8882290364808213
Energy: 0.8935418469815768
Energy: 0.9010185721963272
Energy: 0.955663789053024
Energy: 0.8627522230134792
Energy: 0.8554591690700817
Energy: 0.8867910961214186
Energy: 0.8631300587659652
Energy: 0.8627522230198915
Energy: 0.8554591690797001
Energy: 0.886791096131037
Energy: 0.8864840165204528
Energy: 0.8696248066785782
Energy: 0.913646472267387
Energy: 0.8967706460813315
Energy: 0.8864840165236589
Energy: 0.8696248066849905
Energy: 0.913646472264181
Energy: 0.8620057642517286
Energy: 0.8648934343209286
Energy: 0.8816185263854838
Energy: 0.8531144169151321
Energy: 0.8620057642549348
Energy: 0.8648934343145164
Energy: 0.8816185263726593
Energy: 0.8826428427067524
Energy: 0.8803269857444038
Energy: 0.8815202527020244
Energy: 0.8910916474758277
Energy: 0.8826428427035463
Energy: 0.8803269857379917
Energy: 0.881520252695612
Energy: 0.8622055609433796
Energy: 0.8784534284352916
Energy: 0.8732202780196261
Energy: 0.8519252124487428
Energy: 0.8622055609433796
Energy: 0.8784534284513222
Energy: 0.8732202780228323
Energy: 0.8908927124167709
Energy: 0.8774980028389289
Energy: 0.9170797377139907
Energy: 0.9398406162923074
Energy: 0.8908927124295954
Energy: 0.8774980028485471
Energy: 0.9170797377236091
Energy: 0.8702620766129628
Energy: 0.8935031921450167
Energy: 0.9052630814819768
Energy: 0.8522050496859872
Energy: 0.8702620766129628
Energy: 0.893503192151429
Energy: 0.905263081488389
Energy: 0.8814866288733935
Energy: 0.9256880255744223
Energy: 0.9247433650628868
Energy: 0.9984347283060445
Energy: 0.8814866288605688
Energy: 0.92568802556801
Energy: 0.9247433650692989
Energy: 0.8812787705468742
Energy: 0.9331614853634439
Energy: 0.9053395849638739
Energy: 0.8739119018746556
Energy: 0.8812787705372558
Energy: 0.9331614853570317
Energy: 0.9053395849702862
Energy: 1.002101215220433
Energy: 0.9352700412319394
Energy: 0.8908049647064508
Energy: 0.9935427559402339
Energy: 1.0021012152140205
Energy: 0.9352700412223209
Energy: 0.8908049647064508
Energy: 0.8808731154248091
Energy: 0.9898050611282947
Energy: 0.9226418753776713
Energy: 0.9347575445252393
Energy: 0.8808731154312215
Energy: 0.9898050611315009
Energy: 0.9226418753712591
Energy: 1.0018460696657419
Energy: 0.935162454707851
Energy: 0.8711898193861741
Energy: 0.9930258755351535
Energy: 1.0018460696753604
Energy: 0.935162454707851
Energy: 0.8711898193733496
Energy: 0.8822298535164295
Energy: 0.9320307115265823
Energy: 1.0034930790675618
Energy: 0.88745437735059
Energy: 0.882229853500457
Energy: 0.9320307115490254
Energy: 1.0034930790675618
Energy: 0.8823683588570423
Energy: 0.9350164913884127
Energy: 0.908258134043984
Energy: 0.9984914627246012
Energy: 0.8823683588410117
Energy: 0.9350164913852066
Energy: 0.9082581340375717
Energy: 0.8815911613805929
Energy: 0.8924094649830641
Energy: 0.9310729901586108
Energy: 0.878126406966332
Energy: 0.8815911613773868
Energy: 0.892409464979858
Energy: 0.9310729901586108
Energy: 0.8822780810719929
Energy: 0.8866036260859752
Energy: 0.9081891093907254
Energy: 0.9251493138010604
Energy: 0.8822780810624328
Energy: 0.8866036261116244
Energy: 0.9081891093971377
Energy: 0.8955119896320334
Energy: 0.8925945848435586
Energy: 0.9377482435260478
Energy: 0.8685749672593805
Energy: 0.8955119896224149
Energy: 0.8925945848531769
Energy: 0.9377482435132233
Energy: 0.8851659015482255
Energy: 0.8852630423787958
Energy: 0.9580234697822474
Energy: 0.9261148594178732
Energy: 0.8851659015482255
Energy: 0.8852630423723834
Energy: 0.958023469772629
Energy: 0.8951461878459873
Energy: 0.8858619315313172
Energy: 0.9662779361601763
Energy: 0.8852481179577542
Energy: 0.8951461878491935
Energy: 0.885861931528111
Energy: 0.9662779361730008
Energy: 0.8848120192945826
Energy: 0.8728237362592767
Energy: 0.9091501924988226
Energy: 0.9365492384304008
Energy: 0.8848120192881703
Energy: 0.8728237362528644
Energy: 0.909150192485998
Energy: 0.9049239541714703
Energy: 0.8802682520256176
Energy: 0.9424571805031419
Energy: 0.8850636456356685
Energy: 0.9049239541842948
Energy: 0.8802682520416485
Energy: 0.9424571805223786
Energy: 0.8849625336112978
Energy: 0.9245599359815815
Energy: 0.9416940427515283
Energy: 0.9276518668792253
Energy: 0.8849625336241225
Energy: 0.9245599359879936
Energy: 0.9416940427419098
Energy: 0.9058911839784486
Energy: 0.9204031315527068
Energy: 0.905734331817452
Energy: 0.8924348449905445
Energy: 0.905891183988067
Energy: 0.9204031315559129
Energy: 0.9057343318238058
Energy: 0.9372012230758325
Energy: 0.923842859128578
Energy: 0.9050694161835657
Energy: 0.9271414717928328
Energy: 0.937201223088657
Energy: 0.923842859128578
Energy: 0.9050694161803595
Energy: 0.9061143411748275
Energy: 0.8953842515619599
Energy: 0.9277172004374187
Energy: 0.9129492754506469
Energy: 0.9061143411652091
Energy: 0.8953842515523415
Energy: 0.9277172004342125
Energy: 0.8872889996753822
Energy: 0.9237199876624477
Energy: 0.8886618309125568
Energy: 0.9267433146475758
Energy: 0.887288999672176
Energy: 0.9237199876688599
Energy: 0.8886618309349998
Energy: 0.8990669910019856
Energy: 0.8773601068045085
Energy: 0.9337315689144294
Energy: 0.8849889923098372
Energy: 0.8990669910019856
Energy: 0.8773601067980961
Energy: 0.9337315688983988
Energy: 0.8625081186715766
Energy: 0.9213465049188299
Energy: 0.8883443117744428
Energy: 0.9114344485177109
Energy: 0.8625081186715766
Energy: 0.9213465049092113
Energy: 0.8883443117744428

minimum gb energy = 0.8519252124487428 eV
minimum distance =  2.33601813296767 Angstroms
sigma value = 365


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

Energy: 0.8565388833832217
Energy: 0.7481861084130683
Energy: 0.8745621903188121
Energy: 0.7481861084202641
Energy: 0.8565388833788844
Energy: 0.748186108420987
Energy: 0.9384692405905429
Energy: 0.8565388833824987
Energy: 0.7481861084188184
Energy: 0.8516200731214345
Energy: 0.7481861084159598
Energy: 0.856538883381776
Energy: 0.7481861084166826
Energy: 0.8516200731236031
Energy: 0.856538883381776
Energy: 0.7481861084195411
Energy: 0.8817530162057409
Energy: 0.7481861084159598
Energy: 0.8565388833824987
Energy: 0.7481861084166826
Energy: 0.8688341118130714
Energy: 0.8565388833824987
Energy: 0.7481861084137913
Energy: 0.9383175863334237
Energy: 0.7481861084195411
Energy: 0.8565388833781615
Energy: 0.7481861084202641
Energy: 0.8797894188757084
Energy: 0.8565388833824987
Energy: 0.7481861084188184
Energy: 0.9221970089622452
Energy: 0.7481861084166826
Energy: 0.8565388833832217
Energy: 0.7481861084166826
Energy: 0.9544004535982835
Energy: 0.856538883381776
Energy: 0.7481861084166826
Energy: 0.8824915330809993
Energy: 0.7481861084159598
Energy: 0.856538883381053
Energy: 0.7481861084173728
Energy: 0.8824915330788305
Energy: 0.8565388833832217
Energy: 0.7481861084159598
Energy: 0.8693114059208603
Energy: 0.7481861084173728
Energy: 0.8565388833788844
Energy: 0.7481861084188184
Energy: 0.9365049827554282
Energy: 0.856538883381053
Energy: 0.7481861084195411
Energy: 0.8527962455701844
Energy: 0.7481861084159598
Energy: 0.856538883381053
Energy: 0.7481861084166826
Energy: 0.8527962455730759
Energy: 0.8565388833832217
Energy: 0.7481861084180955
Energy: 0.8672695233259071
Energy: 0.748186108415237
Energy: 0.856538883381776
Energy: 0.7481861084166826
Energy: 0.8672695233287985
Energy: 0.8565388833824987
Energy: 0.748186108415237
Energy: 0.8799720598091771
Energy: 0.7481861084195411
Energy: 0.8565388833774388
Energy: 0.7481861084202641
Energy: 0.8799720598062857
Energy: 0.8565388833824987
Energy: 0.7481861084188184
Energy: 0.8516200731214345
Energy: 0.748186108415237
Energy: 0.8565388833839443
Energy: 0.7481861084159598
Energy: 0.8516200731243259
Energy: 0.856538883381776
Energy: 0.7481861084180955
Energy: 0.8098894124077743
Energy: 0.7481861084159598
Energy: 0.856538883381776
Energy: 0.7481861084159598
Energy: 0.8098894124063286
Energy: 0.8565388833846673
Energy: 0.748186108415237
Energy: 0.8098894124056059
Energy: 0.7481861084166826
Energy: 0.8565388833781615
Energy: 0.7481861084180955
Energy: 0.8098894124034371
Energy: 0.856538883381776
Energy: 0.7481861084195411
Energy: 0.8098894124034371
Energy: 0.7481861084173728
Energy: 0.856538883381776
Energy: 0.7481861084159598
Energy: 0.8098894124056059
Energy: 0.8565388833832217
Energy: 0.7481861084188184
Energy: 0.8098894124077743
Energy: 0.7481861084166826
Energy: 0.8565388833824987
Energy: 0.7481861084159598
Energy: 0.8098894124056059
Energy: 0.8565388833824987
Energy: 0.7481861084159598
Energy: 0.80988941240416
Energy: 0.7481861084195411
Energy: 0.8565388833774388
Energy: 0.7481861084217099
Energy: 0.8098894124034371
Energy: 0.856538883381776
Energy: 0.7481861084202641
Energy: 0.8098894124034371
Energy: 0.748186108415237
Energy: 0.8565388833839443
Energy: 0.7481861084166826
Energy: 0.8098894124063286
Energy: 0.856538883381776
Energy: 0.7481861084188184
Energy: 0.8098894124070516
Energy: 0.7481861084159598
Energy: 0.856538883381053
Energy: 0.7481861084173728
Energy: 0.80988941240416
Energy: 0.8565388833832217
Energy: 0.7481861084137913
Energy: 0.8098894124048829
Energy: 0.7481861084202641
Energy: 0.8565388833788844
Energy: 0.7481861084195411
Energy: 0.8098894124034371
Energy: 0.856538883381776
Energy: 0.7481861084202641
Energy: 0.8098894124027143
Energy: 0.7481861084166826
Energy: 0.856538883381053
Energy: 0.7481861084159598
Energy: 0.80988941240416

minimum gb energy = 0.7481861084130683 eV
minimum distance =  2.4207045727232 Angstroms
sigma value = 23