Model name: model_name=EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5224674642086033
cohesive_energy=4.44900897936396
mass=58.6934
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: 0.022201494168028926
Energy: 0.5164180029377873
Energy: 0.5602546594768949
Energy: 0.516406660561724
Energy: 0.022201494165391963
Energy: 0.5164180029404244
Energy: 0.5602546594742579
Energy: 0.5594743855761389
Energy: 0.022966171711279546
Energy: 0.2784663962685227
Energy: 0.022964576446154204
Energy: 0.5594743855761389
Energy: 0.022966171711279546
Energy: 0.2784663962685227
Energy: 0.022201494165391963
Energy: 0.5164180029377873
Energy: 0.5602546594768949
Energy: 0.516406660561724
Energy: 0.022201494165391963
Energy: 0.5164180029404244
Energy: 0.5602546594742579
Energy: 0.5594743855761389
Energy: 0.022966171708642576
Energy: 0.2784663962685227
Energy: 0.022964576446154204
Energy: 0.5594743855761389
Energy: 0.022966171711279546
Energy: 0.27846639626588576
Energy: 0.022201494165391963
Energy: 0.5164180029377873
Energy: 0.5602546594768949
Energy: 0.516406660561724
Energy: 0.022201494165391963
Energy: 0.5164180029404244
Energy: 0.5602546594768949
Energy: 0.5594743855761389
Energy: 0.022966171711279546
Energy: 0.2784663962685227
Energy: 0.022964576446154204
Energy: 0.5594743855761389
Energy: 0.022966171711279546
Energy: 0.27846639626588576

minimum gb energy = 0.022201494165391963 eV
minimum distance =  2.47291724585125 Angstroms
sigma value = 5


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

Energy: 1.4096440759321176
Energy: 1.4623866361078097
Energy: 1.4694769627337663
Energy: 1.461949474109527
Energy: 1.4096440759256748
Energy: 1.4623866361110311
Energy: 1.4689939126504439
Energy: 1.3151116760390782
Energy: 1.3198088834299426
Energy: 1.3779829025679151
Energy: 1.3337685047182657
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Energy: 1.3198088834267212
Energy: 1.3779829025711365
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Energy: 1.3063300894479468
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Energy: 1.28577208322285
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Energy: 1.3322564027453023
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Energy: 1.3413701834079275
Energy: 1.3544384464075665
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Energy: 1.4156964622747097
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Energy: 1.3793442666675995
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Energy: 1.3044835868955251
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Energy: 1.3812994327582633
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Energy: 1.4812521261039913
Energy: 1.3550089465964765
Energy: 1.314177082029518
Energy: 1.4100729877751883
Energy: 1.3245886663023276
Energy: 1.3550089465996984
Energy: 1.314177082029518
Energy: 1.4100729877687455
Energy: 1.421282228584489
Energy: 1.3416968360961925
Energy: 1.4753872448477061
Energy: 1.3744981385941926
Energy: 1.421282228578046
Energy: 1.3416968360961925
Energy: 1.4753872448508691
Energy: 1.3588752962128927
Energy: 1.3390773959887186
Energy: 1.4687285729209243
Energy: 1.3874881953810028
Energy: 1.3588752962064499
Energy: 1.3390773959887186
Energy: 1.468728572930589
Energy: 1.2831057712368306
Energy: 1.318220625275571
Energy: 1.4318630579380425
Energy: 1.3255366248906122
Energy: 1.2831057712271658
Energy: 1.3182206252820143
Energy: 1.431863057947707
Energy: 1.3022448676234717
Energy: 1.377453677503318
Energy: 1.5385780929539281
Energy: 1.3884144501148008
Energy: 1.3022448676331362
Energy: 1.3774536775000965
Energy: 1.538578092970036
Energy: 1.2851641157733584
Energy: 1.361038953550986
Energy: 1.3799291004529353
Energy: 1.3167147069301022
Energy: 1.285164115799131
Energy: 1.361038953541321
Energy: 1.3799291004464924

minimum gb energy = 1.2831057712271658 eV
minimum distance =  2.28412629657831 Angstroms
sigma value = 401


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

Energy: 1.467691912700786
Energy: 1.3311298010048065
Energy: 1.4541922330928045
Energy: 1.3313396711847056
Energy: 1.467691912700786
Energy: 1.3311298010048065
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Energy: 1.3087097678826822
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Energy: 1.335512309937409
Energy: 1.3719518916390792
Energy: 1.308709767889996
Energy: 1.3501839612473725
Energy: 1.3080546011927743
Energy: 1.3225923252428566
Energy: 1.3749741776115558
Energy: 1.3197649355284082
Energy: 1.3080546011891174
Energy: 1.3225923252428566
Energy: 1.3749741776115558
Energy: 1.3203095295055225
Energy: 1.4064707202708404
Energy: 1.3716235238185917
Energy: 1.3190223817372881
Energy: 1.3203095295091793
Energy: 1.4064707202708404
Energy: 1.3716235238259051
Energy: 1.3188759473949037
Energy: 1.3801176512708586
Energy: 1.4319252472767963
Energy: 1.315490208616183
Energy: 1.3188759473875904
Energy: 1.380117651259888
Energy: 1.4319252472804533
Energy: 1.3076939186735241
Energy: 1.3175960099254114
Energy: 1.5271178430417007
Energy: 1.329931456868781
Energy: 1.3076939186771808
Energy: 1.317596009929068
Energy: 1.5271178430563284
Energy: 1.3218817866405972
Energy: 1.3097575565662307
Energy: 1.4122814188518187
Energy: 1.3201938228415178
Energy: 1.32188178662597
Energy: 1.3097575565625739
Energy: 1.412281418862789
Energy: 1.4218584667732985
Energy: 1.3311298010048065
Energy: 1.3845118096306643
Energy: 1.3313396711920196
Energy: 1.4218584667623282
Energy: 1.3311298010048065
Energy: 1.3845118096233506
Energy: 1.3100820517927854
Energy: 1.3100474770749555
Energy: 1.3736672245789918
Energy: 1.3253771168078774
Energy: 1.3100820517964422
Energy: 1.3100474770786126
Energy: 1.373667224571678

minimum gb energy = 1.3022383746101345 eV
minimum distance =  2.28034783214197 Angstroms
sigma value = 311


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

Energy: 1.3411532222644567
Energy: 1.3099032613065027
Energy: 1.5298323536370233
Energy: 1.309963458564433
Energy: 1.3411532222640343
Energy: 1.3099032613048134
Energy: 1.4309588029117317
Energy: 1.3452703229517018
Energy: 1.3156131108715292
Energy: 1.3892811748555798
Energy: 1.3774834053532992
Energy: 1.3452703229529688
Energy: 1.3156131108660398
Energy: 1.3892811748543132
Energy: 1.3418936267132768
Energy: 1.33557894875966
Energy: 1.4944253414462876
Energy: 1.3450345128091072
Energy: 1.3418936267166164
Energy: 1.3355789487638825
Energy: 1.476466140275314
Energy: 1.3314054465453455
Energy: 1.322583191541164
Energy: 1.426224625548144
Energy: 1.3138385474033483
Energy: 1.3314054465461902
Energy: 1.3225831915398973
Energy: 1.4262246255485662
Energy: 1.3510463126169077
Energy: 1.3103984943462061
Energy: 1.4791898282932376
Energy: 1.3541504762774612
Energy: 1.3510463126177519
Energy: 1.310398494349584
Energy: 1.4323023316008112
Energy: 1.3297878325984185
Energy: 1.3191407105909791
Energy: 1.400028115393849
Energy: 1.3753800371025386
Energy: 1.3297878326047525
Energy: 1.3191407105867565
Energy: 1.4000281153925822
Energy: 1.324316204672081
Energy: 1.3196791143905489
Energy: 1.4254239313266701
Energy: 1.3552443885647403
Energy: 1.3243162046766876
Energy: 1.31967911439266
Energy: 1.4149403000010545
Energy: 1.3244765050488736
Energy: 1.316477563763771
Energy: 1.4963057131454853
Energy: 1.3234948110970521
Energy: 1.3244765050467622
Energy: 1.316477563762082
Energy: 1.4963057131471744
Energy: 1.3450981942956441
Energy: 1.3249385578256259
Energy: 1.4719021057120663
Energy: 1.316060263531922
Energy: 1.3450981942922664
Energy: 1.3249385578281594
Energy: 1.5157834057988833
Energy: 1.3243511286154515
Energy: 1.3603376267934457
Energy: 1.3516004048559294
Energy: 1.3191303803421557
Energy: 1.324351128615029
Energy: 1.3603376267951348
Energy: 1.3516004048635302
Energy: 1.4134542393443381
Energy: 1.3751789515754373
Energy: 1.4073354916291692
Energy: 1.3288586385511603
Energy: 1.4134542393447602
Energy: 1.375178951578815
Energy: 1.4073354916262135
Energy: 1.3415567185312363
Energy: 1.3413982841829548
Energy: 1.438693858733544
Energy: 1.3249390963760217
Energy: 1.3415567185299693
Energy: 1.3413982841837995
Energy: 1.4386938587310105
Energy: 1.343558698964076
Energy: 1.3598227196596153
Energy: 1.4071946849383812
Energy: 1.3226199197076745
Energy: 1.3435586989687205
Energy: 1.3598227196613042
Energy: 1.4071946849442927
Energy: 1.336248962124417
Energy: 1.3332679297268464
Energy: 1.370219041775942
Energy: 1.3333363840879204
Energy: 1.3362489621231501
Energy: 1.3332679297306467
Energy: 1.3702190417801645
Energy: 1.3438149214343376
Energy: 1.3226197953753402
Energy: 1.407013071952068
Energy: 1.359824342756381
Energy: 1.3438149214326485
Energy: 1.3226197953778738
Energy: 1.4070130719499567
Energy: 1.3417132772506342
Energy: 1.3251637916195296
Energy: 1.4387641646644735
Energy: 1.341392622149809
Energy: 1.341713277251901
Energy: 1.3251637916161514
Energy: 1.4387641646703848
Energy: 1.4132716489722448
Energy: 1.328839912304022
Energy: 1.4076368328994988
Energy: 1.3749666379172818
Energy: 1.4132716489768897
Energy: 1.3288399123031776
Energy: 1.4076368329024547
Energy: 1.3241507182209713
Energy: 1.3191649465504576
Energy: 1.3506800070634593
Energy: 1.360330609873197
Energy: 1.3241507182226602
Energy: 1.3191649465517246
Energy: 1.3506800070643041
Energy: 1.3451154789420148
Energy: 1.3160763963960764
Energy: 1.4314482520904506
Energy: 1.3248989668947955
Energy: 1.3451154789415924
Energy: 1.3160763963922764
Energy: 1.4314482520900282
Energy: 1.3244968882441104
Energy: 1.3234106257423772
Energy: 1.4770099297970687
Energy: 1.316704513363131
Energy: 1.3244968882445327
Energy: 1.3234106257373097
Energy: 1.4770099297954178
Energy: 1.3241518399062173
Energy: 1.3552577873864151
Energy: 1.4246735210113652
Energy: 1.3199215266565767
Energy: 1.324151839907484
Energy: 1.3552577873817704
Energy: 1.4246735210088322
Energy: 1.329820823028955
Energy: 1.3753897769586432
Energy: 1.3993163029617879
Energy: 1.3191478157473044
Energy: 1.329820823027266
Energy: 1.3753897769561096
Energy: 1.3993163029617879
Energy: 1.351454291397539
Energy: 1.3538565527436073
Energy: 1.467894531785233
Energy: 1.3103977486724998
Energy: 1.3514542913912053
Energy: 1.3538565527381181
Energy: 1.444962291547626
Energy: 1.3313782094449018
Energy: 1.3134891685568326
Energy: 1.42641655770015
Energy: 1.322472854100079
Energy: 1.3313782094470132
Energy: 1.3134891685593661
Energy: 1.4264165576959658
Energy: 1.3419522108106576
Energy: 1.3449289158389766
Energy: 1.509629141253035
Energy: 1.330428236371063
Energy: 1.341952210809391
Energy: 1.3449289158372875
Energy: 1.486311759299399
Energy: 1.3451897946932465
Energy: 1.3777029575323263
Energy: 1.3893060238709916
Energy: 1.315563225231988
Energy: 1.3451897946995803
Energy: 1.3777029575323263
Energy: 1.389306023866769
Energy: 1.341153222261501
Energy: 1.3099032613098804
Energy: 1.4654731162185513
Energy: 1.309963458569078
Energy: 1.3411532222623452
Energy: 1.3099032613077695
Energy: 1.4309588029113096
Energy: 1.3452703229521241
Energy: 1.3156131108630842
Energy: 1.389281174857691
Energy: 1.3774834053566771
Energy: 1.3452703229491683
Energy: 1.3156131108685736
Energy: 1.3892811748555798
Energy: 1.3418936267094765
Energy: 1.335578948764305
Energy: 1.481783253433624
Energy: 1.3450345128112182
Energy: 1.3418936267069432
Energy: 1.3355789487655718
Energy: 1.4764661402719363
Energy: 1.3314054465440788
Energy: 1.3225831915415864
Energy: 1.426224625548144
Energy: 1.3138385474029262
Energy: 1.3314054465453455
Energy: 1.3225831915436976
Energy: 1.4262246255489885
Energy: 1.3510463126147962
Energy: 1.310398494349162
Energy: 1.4657593271073925
Energy: 1.3541504762787282
Energy: 1.3510463126215524
Energy: 1.3103984943432505
Energy: 1.4323023315999666
Energy: 1.3297878325996852
Energy: 1.3191407105901347
Energy: 1.400028115395538
Energy: 1.3753800371008496
Energy: 1.3297878326001076
Energy: 1.319140710592246
Energy: 1.4000281153963823
Energy: 1.324316204674154
Energy: 1.3196791143909712
Energy: 1.4254239313224477
Energy: 1.355244388566851
Energy: 1.3243162046729258
Energy: 1.3196791143960382
Energy: 1.4149403000023213
Energy: 1.3244765050471847
Energy: 1.3164775637595485
Energy: 1.4963057131496695
Energy: 1.3234948111021194
Energy: 1.324476505045918
Energy: 1.3164775637616595
Energy: 1.4963057131496695
Energy: 1.3450981942909996
Energy: 1.3249385578315371
Energy: 1.501396271432894
Energy: 1.3160602635310776
Energy: 1.3450981942922664
Energy: 1.3249385578252038
Energy: 1.5157834057908608
Energy: 1.3243511286162957
Energy: 1.3603376267955571
Energy: 1.3516004048597297
Energy: 1.3191303803392382
Energy: 1.3243511286091174
Energy: 1.3603376267921792
Energy: 1.3516004048563517

minimum gb energy = 1.3099032613048134 eV
minimum distance =  2.29657532154229 Angstroms
sigma value = 39


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

Energy: 1.281486120836328
Energy: 1.3227372780679274
Energy: 1.4008468474101212
Energy: 1.3230154070997324
Energy: 1.281486120843803
Energy: 1.3227372780704192
Energy: 1.377221034546288
Energy: 1.263959906102089
Energy: 1.3488478485799045
Energy: 1.3185451129081691
Energy: 1.3491816300248296
Energy: 1.2639599060961086
Energy: 1.3488478485813995
Energy: 1.318545112915146
Energy: 1.2813914855866166
Energy: 1.2587324294259266
Energy: 1.3567547202363675
Energy: 1.2863592133694097
Energy: 1.2813914855856199
Energy: 1.258732429420943
Energy: 1.3567547202363675
Energy: 1.2657161090846494
Energy: 1.3489379744926626
Energy: 1.3192163225397275
Energy: 1.317565816090196
Energy: 1.2657161090746827
Energy: 1.3489379744802041
Energy: 1.3192163225402258
Energy: 1.3819771261832123
Energy: 1.2862931064855898
Energy: 1.27855405016386
Energy: 1.3581428579985673
Energy: 1.3819771261862024
Energy: 1.2862931064821015
Energy: 1.2790330441202316
Energy: 1.2653192537138565
Energy: 1.320434011263483
Energy: 1.4105932427469445
Energy: 1.3172044466025357
Energy: 1.2653192536989517
Energy: 1.320434011265476
Energy: 1.410593242744453
Energy: 1.486603910975834
Energy: 1.2871172238420938
Energy: 1.3450612756720999
Energy: 1.2870657639002543
Energy: 1.486603910977329
Energy: 1.2871172238445856
Energy: 1.3451379509122525
Energy: 1.2647185113407517
Energy: 1.2868650550375367
Energy: 1.4102442565360331
Energy: 1.2865676314376477
Energy: 1.2647185113382597
Energy: 1.2868650550335499
Energy: 1.4102442565400202
Energy: 1.4865297987351738
Energy: 1.2871255822783245
Energy: 1.3956036846253939
Energy: 1.2869645022824796
Energy: 1.4865297987331803
Energy: 1.2871255822708947
Energy: 1.3899394585578855
Energy: 1.2655162646717257
Energy: 1.3173439997944034
Energy: 1.4105583238681425
Energy: 1.3203975104399643
Energy: 1.265516264672224
Energy: 1.3173439997899183
Energy: 1.410558323868641
Energy: 1.382278882372167
Energy: 1.3579658911734995
Energy: 1.4344784331707978
Energy: 1.2862621658203721
Energy: 1.3822788823731635
Energy: 1.3579658911779844
Energy: 1.361974400628069
Energy: 1.2657288989989495
Energy: 1.346839695416935
Energy: 1.3191290234017343
Energy: 1.3485455007845362
Energy: 1.265728898995461
Energy: 1.3468396954238668
Energy: 1.3191290234007376
Energy: 1.28119540279042
Energy: 1.2862617763445103
Energy: 1.321572293727174
Energy: 1.258689901886817
Energy: 1.2811954027859347
Energy: 1.2862617763370354
Energy: 1.319732825840209
Energy: 1.2637781636872767
Energy: 1.3485895277102247
Energy: 1.3185082180509737
Energy: 1.348658984691122
Energy: 1.2637781636788048
Energy: 1.3485895277057391
Energy: 1.3185082180659238
Energy: 1.2814861208368262
Energy: 1.3227372780679274
Energy: 1.3772210345408062
Energy: 1.3230154070987357
Energy: 1.2814861208462949
Energy: 1.3227372780689242
Energy: 1.3772210345472848
Energy: 1.2639599061025872
Energy: 1.3488478485764162
Energy: 1.3185451129071724
Energy: 1.3491816300253279
Energy: 1.2639599060971054
Energy: 1.3488478485813995
Energy: 1.3185451129126542
Energy: 1.281391485590105
Energy: 1.258732429426923
Energy: 1.3567547202373638
Energy: 1.2863592133664195
Energy: 1.2813914855896065
Energy: 1.2587324294204447
Energy: 1.356754720240354
Energy: 1.2657161090836528
Energy: 1.3489379744891743
Energy: 1.3192163225397275
Energy: 1.317565816088701
Energy: 1.265716109073686
Energy: 1.348937974477214
Energy: 1.3192163225402258
Energy: 1.3819771261832123
Energy: 1.2862931064865863
Energy: 1.2860164937499832
Energy: 1.358142857995079
Energy: 1.3819771261862024
Energy: 1.2862931064821015
Energy: 1.294758293109179
Energy: 1.2653192537128597
Energy: 1.3204340112609907
Energy: 1.4105932427469445
Energy: 1.3172044466025357
Energy: 1.2653192536999485
Energy: 1.320434011263483
Energy: 1.4105932427454495
Energy: 1.486603910977329
Energy: 1.2871172238415955
Energy: 1.3451379509102592
Energy: 1.2870657639002543
Energy: 1.4866039109778273
Energy: 1.287117223842592
Energy: 1.3451379509072692
Energy: 1.2647185113362667
Energy: 1.286865055038035
Energy: 1.4102442565395217
Energy: 1.286567631438146
Energy: 1.2647185113387582
Energy: 1.2868650550355434
Energy: 1.4102442565455018
Energy: 1.4865297987356718
Energy: 1.2871255822768748
Energy: 1.3512652316743627
Energy: 1.2869645022864666
Energy: 1.4865297987351738
Energy: 1.2871255822703962
Energy: 1.3395868540024107
Energy: 1.265516264670729
Energy: 1.3173439997929082
Energy: 1.4105583238636574
Energy: 1.3203975104414594
Energy: 1.2655162646717257
Energy: 1.3173439997914131
Energy: 1.410558323864654
Energy: 1.3822788823726653
Energy: 1.3579658911730013
Energy: 1.4463334318560335
Energy: 1.286262165821867
Energy: 1.3822788823801404
Energy: 1.3579658911764896
Energy: 1.3925877180334891
Energy: 1.2657288989984512
Energy: 1.346839695416935
Energy: 1.3191290234022326
Energy: 1.3485455007825429
Energy: 1.2657288989934676
Energy: 1.3468396954268567
Energy: 1.3191290233987443
Energy: 1.2811954027874297
Energy: 1.2862617763390287
Energy: 1.3197328258481824
Energy: 1.2586899018878135
Energy: 1.2811954027844397
Energy: 1.2862617763350421
Energy: 1.3197328258392123
Energy: 1.26377816368927
Energy: 1.3485895277162046
Energy: 1.3185082180494785
Energy: 1.3486589846916204
Energy: 1.2637781636832897
Energy: 1.3485895277087296
Energy: 1.3185082180619372
Energy: 1.281486120836328
Energy: 1.3227372780679274
Energy: 1.3772210345413047
Energy: 1.3230154070997324
Energy: 1.2814861208443014
Energy: 1.3227372780699205
Energy: 1.377221034546288
Energy: 1.263959906102089
Energy: 1.3488478485794062
Energy: 1.3185451129081691
Energy: 1.349181630026823
Energy: 1.2639599060956104
Energy: 1.3488478485818978
Energy: 1.3185451129146475

minimum gb energy = 1.258689901886817 eV
minimum distance =  2.33040115447753 Angstroms
sigma value = 21


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

Energy: 1.3282374620846058
Energy: 1.4487988420553861
Energy: 1.434769748871774
Energy: 1.448821029613514
Energy: 1.3282374620870259
Energy: 1.448798842054176
Energy: 1.3865062958012007
Energy: 1.2953617286343604
Energy: 1.288916841863298
Energy: 1.380648749482868
Energy: 1.289402539996532
Energy: 1.2953617286325456
Energy: 1.2889168418645078
Energy: 1.380648749483473
Energy: 1.3282945866522142
Energy: 1.284559909707651
Energy: 1.373021222209697
Energy: 1.3369385265821048
Energy: 1.328294586655844
Energy: 1.2845599097094658
Energy: 1.373021222208487
Energy: 1.3245887112798198
Energy: 1.2888736597578365
Energy: 1.3562025479431674
Energy: 1.3112308206845402
Energy: 1.3245887112822397
Energy: 1.2888736597566266
Energy: 1.3562025479407473
Energy: 1.2771916820776892
Energy: 1.353063457986665
Energy: 1.392344393951312
Energy: 1.342315851849055
Energy: 1.2771916820752693
Energy: 1.3530634579902947
Energy: 1.411086222722392
Energy: 1.3248288151613699
Energy: 1.2599872398801866
Energy: 1.3291129659880683
Energy: 1.337085157085657
Energy: 1.32482881515895
Energy: 1.2599872398801866
Energy: 1.3291129659868584
Energy: 1.3279510653363473
Energy: 1.348753576855707
Energy: 1.3520061631450877
Energy: 1.3097906563927295
Energy: 1.3279510653327176
Energy: 1.3487535768526824
Energy: 1.352006163138433
Energy: 1.319569880316847
Energy: 1.254881160144182
Energy: 1.3309641424520833
Energy: 1.3366209238656
Energy: 1.319569880315637
Energy: 1.2548811601532563
Energy: 1.3309641424508734
Energy: 1.3281059526392192
Energy: 1.335330894852402
Energy: 1.3240970187271466
Energy: 1.3353322356672066
Energy: 1.328105952639824
Energy: 1.3353308948560043
Energy: 1.3240970187259369
Energy: 1.3296732440704955
Energy: 1.2567122717537629
Energy: 1.3415964788619266
Energy: 1.2969874309088152
Energy: 1.3296732440753078
Energy: 1.2567122717507382
Energy: 1.3415964788589019
Energy: 1.3507802855135989
Energy: 1.3884936148189748
Energy: 1.3366896881923136
Energy: 1.3194309964144255
Energy: 1.3507802855081543
Energy: 1.3884936148195797
Energy: 1.308342389042014
Energy: 1.2292696715751343
Energy: 1.3216741968269796
Energy: 1.3007207182441
Energy: 1.2521505337053298
Energy: 1.2292696715769493
Energy: 1.3216741968245598
Energy: 1.3007207182471248
Energy: 1.3506115466538677
Energy: 1.3378745797041056
Energy: 1.314525188524186
Energy: 1.2896737772764073
Energy: 1.3506115466478181
Energy: 1.3378745797065255
Energy: 1.3145251885223712
Energy: 1.2284798892930566
Energy: 1.3210379102328362
Energy: 1.3180256449067633
Energy: 1.253179271029182
Energy: 1.2284798892900317
Energy: 1.3210379102322314
Energy: 1.3180256449019234
Energy: 1.3069953207104623
Energy: 1.3374010192644947
Energy: 1.3142163177777513
Energy: 1.290294440710314
Energy: 1.3069953207104623
Energy: 1.3374010192681243
Energy: 1.3142163177765416
Energy: 1.2185348182067883
Energy: 1.383906998717973
Energy: 1.3150803988555682
Energy: 1.2988053871021055
Energy: 1.2185348182110232
Energy: 1.3839069987216028
Energy: 1.3150803988543585
Energy: 1.3073618793806365
Energy: 1.337163407245167
Energy: 1.3824724787092353
Energy: 1.2901266124081088
Energy: 1.3073618793812416
Energy: 1.337163407245167
Energy: 1.3824724787092353
Energy: 1.2183400079724958
Energy: 1.2873675495791577
Energy: 1.2822035719566782
Energy: 1.318117663415183
Energy: 1.2183400079779407
Energy: 1.287367549576738
Energy: 1.282203571957888
Energy: 1.3288396596991252
Energy: 1.3367733914210742
Energy: 1.4472702943717637
Energy: 1.3096891960435189
Energy: 1.3288396596954952
Energy: 1.3367733914222841
Energy: 1.4472702943735787
Energy: 1.2179068919673552
Energy: 1.3453496723323146
Energy: 1.2930547192063366
Energy: 1.3453938011039437
Energy: 1.217906891970985
Energy: 1.3453496723292897
Energy: 1.2930547192014972
Energy: 1.3287829234834674
Energy: 1.3099499669344574
Energy: 1.4468743987565365
Energy: 1.3368158172709117
Energy: 1.3287829234846775
Energy: 1.3099499669362447
Energy: 1.4468743987577464
Energy: 1.218523130946983
Energy: 1.3181577038039554
Energy: 1.2824913544955243
Energy: 1.2873670868826315
Energy: 1.2185231309445637
Energy: 1.3181577038039554
Energy: 1.2824913544943144
Energy: 1.3079058079215788
Energy: 1.2905113086104534
Energy: 1.3824756338936333
Energy: 1.3370654855354989
Energy: 1.3079058079215788
Energy: 1.2905113086146882
Energy: 1.3824756338966582
Energy: 1.2189388870968256
Energy: 1.2985753451866282
Energy: 1.314979808283399
Energy: 1.3837340894784311
Energy: 1.2189388870956157
Energy: 1.2985753451829984
Energy: 1.314979808282189
Energy: 1.3072441219239648
Energy: 1.2902678549887656
Energy: 1.3668281143010024
Energy: 1.3374367677392411
Energy: 1.307244121925175
Energy: 1.2902678549875557
Energy: 1.3668281143022123

minimum gb energy = 1.2179068919673552 eV
minimum distance =  2.31424357497789 Angstroms
sigma value = 113


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

Energy: 1.4452607321281024
Energy: 1.4565186413871918
Energy: 1.4269846900702288
Energy: 1.4567447858968943
Energy: 1.4452607321112212
Energy: 1.4565186413500526
Energy: 1.4269846900634762
Energy: 1.4097389118908157
Energy: 1.3843564063136806
Energy: 1.4627299234123536
Energy: 1.3681714517944852
Energy: 1.4097389118908157
Energy: 1.3843564063238096
Energy: 1.4627299233954723
Energy: 1.445928729020507
Energy: 1.3701794120899455
Energy: 1.407162987364366
Energy: 1.3863538425855393
Energy: 1.4459287290171308
Energy: 1.370179412106827
Energy: 1.40716298736099
Energy: 1.2800331975138082
Energy: 1.3837058662460702
Energy: 1.417138847816299
Energy: 1.373978515302191
Energy: 1.2800331974834216
Energy: 1.3837058662426938
Energy: 1.417138847816299
Energy: 1.4488472134821533
Energy: 1.3062378516718458
Energy: 1.3805809870942645
Energy: 1.3183450144078939
Energy: 1.4488472134821533
Energy: 1.3062378516650934
Energy: 1.4176579062789425
Energy: 1.2797904760242058
Energy: 1.3259204650758212
Energy: 1.3613145258251709
Energy: 1.3134821901482583
Energy: 1.2797904760410872
Energy: 1.3259204650825738
Energy: 1.361314525815042
Energy: 1.345869781638786
Energy: 1.306128002039624
Energy: 1.3563138368606402
Energy: 1.3174765890146163
Energy: 1.3458697816455387
Energy: 1.3061280020430002
Energy: 1.3563138368640162
Energy: 1.2700480213785552
Energy: 1.3171147547154352
Energy: 1.3924255276878388
Energy: 1.2959755278689287
Energy: 1.270048021375179
Energy: 1.3171147547053061
Energy: 1.3924255276945914
Energy: 1.3459176076409791
Energy: 1.3243235527627053
Energy: 1.4952126226428717
Energy: 1.2963605180403022
Energy: 1.3459176076409791
Energy: 1.3243235527593291
Energy: 1.4952126226361193
Energy: 1.2894246937587186
Energy: 1.3087020016189579
Energy: 1.4751935039546495
Energy: 1.3127521062370988
Energy: 1.2894246937756002
Energy: 1.3087020016155817
Energy: 1.4751935039681547
Energy: 1.3466674089599187
Energy: 1.3056263413925877
Energy: 1.5213667085092484
Energy: 1.2963185877123056
Energy: 1.3466674089599187
Energy: 1.3056263414027163
Energy: 1.521366708516001
Energy: 1.289616535003617
Energy: 1.291791492788239
Energy: 1.564124769346226
Energy: 1.3348642345790225
Energy: 1.289616535003617
Energy: 1.291791492788239
Energy: 1.5641247693394735
Energy: 1.417674250978368
Energy: 1.3440865702500562
Energy: 1.523155832807272
Energy: 1.297065753069413
Energy: 1.4176742509614866
Energy: 1.3440865702568083
Energy: 1.523155832814025
Energy: 1.414344506618882
Energy: 1.4333562634006918
Energy: 1.5975482604194975
Energy: 1.3987808330910287
Energy: 1.414344506632387
Energy: 1.433356263380434
Energy: 1.5975482604296263
Energy: 1.4170892533502628
Energy: 1.4037284851342757
Energy: 1.5727635117332779
Energy: 1.3789195377541115
Energy: 1.4170892533772728
Energy: 1.4037284851342757
Energy: 1.5727635117366543
Energy: 1.4139626704633574
Energy: 1.2915130895703772
Energy: 1.3851282188627705
Energy: 1.3348480989407163
Energy: 1.4139626704566046
Energy: 1.2915130895703772
Energy: 1.3851282188560181
Energy: 1.419215719435143
Energy: 1.3441333921305672
Energy: 1.5205069775893867
Energy: 1.2956523542109624
Energy: 1.4192157194283903
Energy: 1.344133392113747
Energy: 1.5412589133853374
Energy: 1.2892736340868403
Energy: 1.2919451041829193
Energy: 1.4120245790431911
Energy: 1.3160466132235953
Energy: 1.2892736340767115
Energy: 1.2919451041829193
Energy: 1.412024579039815
Energy: 1.4179162964873495
Energy: 1.334590287202873
Energy: 1.521898716014263
Energy: 1.3179110060256494
Energy: 1.4179162964772207
Energy: 1.3345902872230693
Energy: 1.5218987160243918
Energy: 1.2910922491549308
Energy: 1.3116070070366956
Energy: 1.481758515874983
Energy: 1.2924649304442468
Energy: 1.2910922491515544
Energy: 1.3116070070265666
Energy: 1.4817585158682305
Energy: 1.2815442422580716
Energy: 1.3065123557303824
Energy: 1.4719513660473307
Energy: 1.3231313579563222
Energy: 1.2815442422344374
Energy: 1.3065123557101246
Energy: 1.4719513660338255
Energy: 1.2913314312859787
Energy: 1.3045109368863153
Energy: 1.393792728072849
Energy: 1.305819169838802
Energy: 1.291331431279226
Energy: 1.304510936906573
Energy: 1.3937927280627203
Energy: 1.3465321882181702
Energy: 1.2906148292198816
Energy: 1.4338458644675809
Energy: 1.3875596144961617
Energy: 1.3465321881945362
Energy: 1.2906148292131288
Energy: 1.4338458644642043
Energy: 1.3261651579405067
Energy: 1.3141660710926273
Energy: 1.433562963328332
Energy: 1.306053133946801
Energy: 1.326165157930378
Energy: 1.3141660711027565
Energy: 1.4335629633148268
Energy: 1.2819445831479042
Energy: 1.3708112705629656
Energy: 1.4077945872450601
Energy: 1.4626071702253394
Energy: 1.2819445831614091
Energy: 1.3708112705697182
Energy: 1.4077945872349313
Energy: 1.3177445393341538
Energy: 1.39493527547476
Energy: 1.5037920256724362
Energy: 1.3416283005779468
Energy: 1.3177445393274014
Energy: 1.394935275471384
Energy: 1.5037920256825652
Energy: 1.3787070799305357
Energy: 1.359812937756716
Energy: 1.3813232718937738
Energy: 1.4545159086496056
Energy: 1.3787070799271595
Energy: 1.35981293775334
Energy: 1.381323271883645
Energy: 1.3103488291956809
Energy: 1.4530304460419707
Energy: 1.5149726215221118
Energy: 1.4355859005756135
Energy: 1.310348829185552
Energy: 1.4530304460520995
Energy: 1.5149726215254877
Energy: 1.3728989834670244
Energy: 1.3603024850073346
Energy: 1.4139139280716222
Energy: 1.4544246813226158
Energy: 1.3728989834670244
Energy: 1.360302485010711
Energy: 1.4139139280716222
Energy: 1.3114169358587646
Energy: 1.3830909395176472
Energy: 1.4558814853193516
Energy: 1.3651412945926371
Energy: 1.3114169358486358
Energy: 1.383090939510895
Energy: 1.4558814853327953
Energy: 1.3389891961142235
Energy: 1.3599111188085609
Energy: 1.475161843858275
Energy: 1.4472014989633304
Energy: 1.3389891961344813
Energy: 1.3599111188018083
Energy: 1.475161843851584
Energy: 1.310227623350365
Energy: 1.3118303182942341
Energy: 1.440197462083203
Energy: 1.3006909917649176
Energy: 1.310227623340236
Energy: 1.3118303183009867
Energy: 1.440197462079827
Energy: 1.3390679895967632
Energy: 1.3037892912206914
Energy: 1.4610606608781107
Energy: 1.386279448370627
Energy: 1.3390679895900104
Energy: 1.3037892912240678
Energy: 1.4610606608680434
Energy: 1.282585395848294
Energy: 1.3076392402186192
Energy: 1.3630896291772499
Energy: 1.2941692003090552
Energy: 1.2825853958550464
Energy: 1.3076392402186192
Energy: 1.3630896291772499
Energy: 1.2792582122829625
Energy: 1.284290552343724
Energy: 1.4967202560574686
Energy: 1.368821876941313
Energy: 1.2792582122930913
Energy: 1.2842905523605441
Energy: 1.496720256070974
Energy: 1.282643067183412
Energy: 1.3064491822340867
Energy: 1.3715384423666386
Energy: 1.2740933483475965
Energy: 1.2826430671800357
Energy: 1.3064491822475917
Energy: 1.3715384423733912
Energy: 1.2792337523599937
Energy: 1.302721065798721
Energy: 1.4320044409123487
Energy: 1.3856623790071207
Energy: 1.2792337523667463
Energy: 1.3027210657919681
Energy: 1.4320044409055959
Energy: 1.2677354098777112
Energy: 1.3046760678600193
Energy: 1.385722018929305
Energy: 1.274040228770946
Energy: 1.2677354098810876
Energy: 1.3046760678701481
Energy: 1.3857220189393726
Energy: 1.279160370542601
Energy: 1.3563203465929006
Energy: 1.560279035511968
Energy: 1.3897335792588679
Energy: 1.279160370542601
Energy: 1.356320346596277
Energy: 1.560279035511968
Energy: 1.2742901032293175
Energy: 1.363351146925689
Energy: 1.3879369113934077
Energy: 1.3384799977038377
Energy: 1.2742901032293175
Energy: 1.363351146929065
Energy: 1.3879369113731501
Energy: 1.371749799881858
Energy: 1.3543166675539982
Energy: 1.5557280089656798
Energy: 1.3899855681722166
Energy: 1.371749799881858
Energy: 1.354316667567503
Energy: 1.555728008945422
Energy: 1.268156008928133
Energy: 1.4063017938400542
Energy: 1.5009724019151238
Energy: 1.3824947991140977
Energy: 1.2681560089247566
Energy: 1.4063017938468068
Energy: 1.5009724019151238
Energy: 1.3059408806563635
Energy: 1.3545561792434115
Energy: 1.4132292913911297
Energy: 1.3928920377046494
Energy: 1.30594088065974
Energy: 1.3545561792434115
Energy: 1.413229291404635
Energy: 1.3145598508802039
Energy: 1.3564140147427015
Energy: 1.5068080335117309
Energy: 1.2987847901181742
Energy: 1.3145598509072145
Energy: 1.3564140147258201
Energy: 1.5068080335218597
Energy: 1.2899535599718297
Energy: 1.3512293671547957
Energy: 1.4379935405391506
Energy: 1.394115474940353
Energy: 1.2899535599752059
Energy: 1.351229367171677
Energy: 1.4379935405526558

minimum gb energy = 1.2677354098777112 eV
minimum distance =  2.26548567090762 Angstroms
sigma value = 365


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

Energy: 1.2248268836913314
Energy: 1.099885846655162
Energy: 1.3667967034781754
Energy: 1.0998858466635355
Energy: 1.2248268836882867
Energy: 1.0998858466612518
Energy: 1.2983564778137848
Energy: 1.2248268836905705
Energy: 1.099885846662013
Energy: 1.4263946665841871
Energy: 1.0998858466566843
Energy: 1.224826883692854
Energy: 1.0998858466582067
Energy: 1.3667967034758917
Energy: 1.2248268836905705
Energy: 1.0998858466650578
Energy: 1.291303334397938
Energy: 1.099885846658968
Energy: 1.2248268836920928
Energy: 1.0998858466574455
Energy: 1.2983564778153072
Energy: 1.2248268836890477
Energy: 1.0998858466566843
Energy: 1.3667967034789366
Energy: 1.0998858466627741
Energy: 1.224826883686764
Energy: 1.0998858466604904
Energy: 1.2983564778191135
Energy: 1.224826883689809
Energy: 1.0998858466612518
Energy: 1.1557033759904098
Energy: 1.099885846655923
Energy: 1.224826883692854
Energy: 1.0998858466604904
Energy: 1.1814339750062486
Energy: 1.2248268836905705
Energy: 1.0998858466642967
Energy: 1.2048889961383422
Energy: 1.0998858466604904
Energy: 1.2248268836905705
Energy: 1.0998858466566843
Energy: 1.2983564778168297
Energy: 1.2248268836905705
Energy: 1.0998858466566843
Energy: 1.2983564778198746
Energy: 1.0998858466604904
Energy: 1.2248268836882867
Energy: 1.0998858466612518
Energy: 1.2983564778168297
Energy: 1.2248268836905705
Energy: 1.0998858466627741
Energy: 1.3920202948275515
Energy: 1.0998858466574455
Energy: 1.2248268836920928
Energy: 1.0998858466604904
Energy: 1.4257667002094725
Energy: 1.2248268836905705
Energy: 1.0998858466635355
Energy: 1.3667967034751303
Energy: 1.0998858466627741
Energy: 1.2248268836920928
Energy: 1.099885846655162
Energy: 1.3667967034796977
Energy: 1.224826883689809
Energy: 1.099885846655162
Energy: 1.1602317639265318
Energy: 1.0998858466612518
Energy: 1.2248268836875253
Energy: 1.0998858466604904
Energy: 1.298356477818352
Energy: 1.224826883689809
Energy: 1.0998858466612518
Energy: 1.343915903057575
Energy: 1.0998858466536394
Energy: 1.224826883692854
Energy: 1.0998858466582067
Energy: 1.1834964340897156
Energy: 1.224826883689809
Energy: 1.0998858466650578
Energy: 1.3667967034751303
Energy: 1.099885846658968
Energy: 1.2248268836913314
Energy: 1.0998858466582067
Energy: 1.3667967034781754
Energy: 1.2248268836913314
Energy: 1.0998858466566843
Energy: 1.298356477817591
Energy: 1.0998858466635355
Energy: 1.2248268836875253
Energy: 1.0998858466627741
Energy: 1.298356477817591
Energy: 1.2248268836905705
Energy: 1.0998858466627741
Energy: 1.298356477814546
Energy: 1.0998858466566843
Energy: 1.2248268836920928
Energy: 1.0998858466597292
Energy: 1.425766700210995
Energy: 1.2248268836905705
Energy: 1.0998858466627741
Energy: 1.2983564778130237
Energy: 1.0998858466597292
Energy: 1.2248268836920928
Energy: 1.0998858466574455
Energy: 1.2983564778168297
Energy: 1.2248268836905705
Energy: 1.099885846655162
Energy: 1.298356477818352
Energy: 1.0998858466612518
Energy: 1.2248268836875253
Energy: 1.0998858466597292
Energy: 1.298356477818352
Energy: 1.2248268836913314
Energy: 1.0998858466604904
Energy: 1.2983564778153072
Energy: 1.099885846655923
Energy: 1.224826883692854
Energy: 1.099885846658968
Energy: 1.1814339451345068
Energy: 1.2248268836905705
Energy: 1.0998858466627741
Energy: 1.2983564778122623
Energy: 1.099885846658968
Energy: 1.2248268836920928
Energy: 1.0998858466566843
Energy: 1.3667967034766528
Energy: 1.2248268836913314
Energy: 1.099885846655162
Energy: 1.2983564778153072
Energy: 1.0998858466612518
Energy: 1.2248268836890477
Energy: 1.0998858466627741
Energy: 1.2983564778137848
Energy: 1.2248268836905705
Energy: 1.0998858466612518
Energy: 1.298356477817591
Energy: 1.0998858466566843
Energy: 1.224826883692854
Energy: 1.0998858466604904
Energy: 1.2983564778122623

minimum gb energy = 1.0998858466536394 eV
minimum distance =  2.37626562122309 Angstroms
sigma value = 23