Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Cu__MO_087820130586_000
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=3.613315634429455
cohesive_energy=3.5402784386325172
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.91030724425088e-19, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-17]
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: 0.016739188813131228
Energy: 0.608737361931366
Energy: 1.3912447124806415
Energy: 0.9166884539868178
Energy: 0.9184516596844214
Energy: 0.2827083561312667
Energy: 0.017211240271644782
Energy: 0.2818401011197864
Energy: 0.8479395017105394
Energy: 0.231810340750937
Energy: 0.608397185224316
Energy: 0.6094414903172728
Energy: 0.01779952857801481
Energy: 0.0888000071711389
Energy: 0.017011403646071736
Energy: 0.8480122608313546
Energy: 0.8093352734476191
Energy: 0.811230725613051
Energy: 0.6091285019398084
Energy: 0.08745079818366468
Energy: 0.08877045192197804
Energy: 0.019116345809130093
Energy: 0.6086958479665067
Energy: 1.2851277470355889
Energy: 0.9166857522934458
Energy: 0.918257378261085
Energy: 0.28137241359740134
Energy: 0.017337379713607548
Energy: 0.28140343273691143
Energy: 0.8514338302433843
Energy: 0.23180463566330844
Energy: 0.6085402292754113
Energy: 0.6371204023265248
Energy: 0.01758037557064572
Energy: 0.28281636552934275
Energy: 0.017127403234678915
Energy: 0.7848156659755816
Energy: 0.8090683508879737
Energy: 0.8106679090047109
Energy: 0.7653788219873079
Energy: 0.08735585780764328
Energy: 0.0886083329283131

minimum gb energy = 0.016739188813131228 eV
minimum distance =  2.53110369267376 Angstroms
sigma value = 5


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

Energy: 1.1845629294094617
Energy: 1.4623511291570737
Energy: 1.2680230493642084
Energy: 1.3652119810640435
Energy: 1.2897124722922648
Energy: 1.281168851019981
Energy: 1.4258385170788235
Energy: 1.1271543311739463
Energy: 1.1794016042606497
Energy: 1.1807493037614272
Energy: 1.3884951469696099
Energy: 1.333229750255497
Energy: 1.133225465450806
Energy: 1.2626462785327828
Energy: 1.245814493212101
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Energy: 1.2486680959134324
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Energy: 1.3331272067761986
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Energy: 1.1341303334245665
Energy: 1.3353403370003953
Energy: 1.242360334087193
Energy: 1.4012951455995337
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Energy: 1.2466112253795667
Energy: 1.1541070566253044
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Energy: 1.3593241509064615
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Energy: 1.3439155159908673
Energy: 1.2501737365285868
Energy: 1.2895511355971057
Energy: 1.2956247669743335
Energy: 1.259020254672296
Energy: 1.3920481549663368
Energy: 1.2078834118377264
Energy: 1.3550247160764
Energy: 1.2103731892930532
Energy: 1.221998774371062
Energy: 1.2042916256760605
Energy: 1.172634629106187
Energy: 1.331744473223857
Energy: 1.107918131524887
Energy: 1.325455774683873
Energy: 1.2690671981033705
Energy: 1.3242798793818111
Energy: 1.311076662084495
Energy: 1.3227309101827631
Energy: 1.268300037631282
Energy: 1.2023795381887994
Energy: 1.3045745617407174
Energy: 1.186981768304852
Energy: 1.3164957739090106
Energy: 1.3886474135598195
Energy: 1.2199974049350293
Energy: 1.3000120152448016
Energy: 1.0970216744384116
Energy: 1.2559424631237655
Energy: 1.267566734979416
Energy: 1.3300202271373651
Energy: 1.2450754872533507
Energy: 1.2301594269650797
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Energy: 1.2201796812725174
Energy: 1.3125826601936192
Energy: 1.3550329089228204
Energy: 1.1784651736795944
Energy: 1.3418258737928805

minimum gb energy = 1.0743579614462555 eV
minimum distance =  2.26299498265101 Angstroms
sigma value = 401


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

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Energy: 1.3507812325869522
Energy: 1.206421834783352
Energy: 1.3253966424757622
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Energy: 1.245101580468038
Energy: 1.195872581615176
Energy: 1.177848150829134
Energy: 1.1842089235054847
Energy: 1.1810670220595625
Energy: 1.282283655009241
Energy: 1.2647425886909278
Energy: 1.369914667992102
Energy: 1.2042667085329357
Energy: 1.2299277124822716
Energy: 1.2713195325451734
Energy: 1.22280495617614
Energy: 1.337289376054508
Energy: 1.105637500381951
Energy: 1.1983229795074888
Energy: 1.2299312363806605
Energy: 1.3430048868623417
Energy: 1.4106081659384766
Energy: 1.2175748772754116
Energy: 1.195708856600904
Energy: 1.1089944406099277
Energy: 1.1747069615179553
Energy: 1.2406285569600446
Energy: 1.4442900098243863
Energy: 1.2574709772512536
Energy: 1.165528692660696
Energy: 1.208745350748817
Energy: 1.0833464766230563
Energy: 1.1419645481849519
Energy: 1.2422831917175607
Energy: 1.4013670511563692
Energy: 1.2288898540575754
Energy: 1.2124107884972586
Energy: 1.1696850828577654
Energy: 1.0880290635177579
Energy: 1.117471439307036
Energy: 1.1919555283734928
Energy: 1.3752334687584675
Energy: 1.3147055302615556
Energy: 1.196241852228674
Energy: 1.1689060401558025
Energy: 1.1163223068006074
Energy: 1.2345889287968554
Energy: 1.1261455168813965
Energy: 1.3431543679574491
Energy: 1.3682858611992144
Energy: 1.1490041556069197
Energy: 1.1635795358437833
Energy: 1.1871663074096521
Energy: 1.2290045129881397
Energy: 1.1633367201147646
Energy: 1.2546680020660805
Energy: 1.25483323553638
Energy: 1.2257834666027618
Energy: 1.3465820244337463
Energy: 1.1374557862612829
Energy: 1.2077294035684487
Energy: 1.1286939895658876
Energy: 1.2046436977991544
Energy: 1.234956078020117
Energy: 1.2628576007582168
Energy: 1.29972117993454
Energy: 1.216190251569483
Energy: 1.433972850315703
Energy: 1.1365444963762064
Energy: 1.155043215122048
Energy: 1.3358712973231655
Energy: 1.3070381919653413
Energy: 1.419510656431966
Energy: 1.198471406497327
Energy: 1.2002944723594573
Energy: 1.1187388432915484
Energy: 1.1900354588821422
Energy: 1.1866004051154009
Energy: 1.211950412779828
Energy: 1.3181801773287212
Energy: 1.257103093468143
Energy: 1.2979267949917812
Energy: 1.2018837996094234
Energy: 1.209691685378914
Energy: 1.1553611830373571
Energy: 1.2218489973045032
Energy: 1.4282499967197744
Energy: 1.11020030787855
Energy: 1.277811577596875
Energy: 1.2066540692635113
Energy: 1.2851591335077883
Energy: 1.3622160487823123
Energy: 1.204540191605478
Energy: 1.2130636143208084
Energy: 1.1401982469719716
Energy: 1.1808222214611517
Energy: 1.2542532146211773
Energy: 1.35428555865261
Energy: 1.25495175637958
Energy: 1.2535250393083808
Energy: 1.1875860541972931
Energy: 1.1240679808397265
Energy: 1.2200305937183784
Energy: 1.23731593433999
Energy: 1.4401764886921973
Energy: 1.3230195423749658
Energy: 1.14085358746577
Energy: 1.1869489918586529

minimum gb energy = 1.0814772399431607 eV
minimum distance =  2.25480720617086 Angstroms
sigma value = 311


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

Energy: 1.1522568348150488
Energy: 1.3174120276249313
Energy: 1.221025625161237
Energy: 1.229548500132021
Energy: 1.2045439304355303
Energy: 1.1550547156751192
Energy: 1.1535974636860904
Energy: 1.1348113246109723
Energy: 1.2797208149576669
Energy: 1.2078708118287436
Energy: 1.2781196935224952
Energy: 1.194415402801802
Energy: 1.1284312874671345
Energy: 1.3625595602843248
Energy: 1.3247887765413202
Energy: 1.2750217058984625
Energy: 1.3047738875874357
Energy: 1.2924735525893714
Energy: 1.195843997293708
Energy: 1.1749392219642836
Energy: 1.2903184716252272
Energy: 1.127414834129479
Energy: 1.2139478224994897
Energy: 1.1811912397641233
Energy: 1.3542571452914591
Energy: 1.2796885336796535
Energy: 1.1628276921738574
Energy: 1.279651193453288
Energy: 1.233841905825969
Energy: 1.1897794805073951
Energy: 1.1835832716716481
Energy: 1.2052398914997984
Energy: 1.2501303657310645
Energy: 1.2844726644647333
Energy: 1.2134218397619103
Energy: 1.2562386924103812
Energy: 1.211865550883355
Energy: 1.1128282233613707
Energy: 1.2462089795946878
Energy: 1.2365496355475982
Energy: 1.2310392085801445
Energy: 1.300050176988659
Energy: 1.2225952725829972
Energy: 1.2778927122648467
Energy: 1.1527053135510996
Energy: 1.2386724292665272
Energy: 1.2964636116509518
Energy: 1.1586046631549112
Energy: 1.3278155765016655
Energy: 1.177407316418118
Energy: 1.2692215227912576
Energy: 1.1736896280649398
Energy: 1.286638438624137
Energy: 1.2911071897205593
Energy: 1.1700877028957601
Energy: 1.2930250265137633
Energy: 1.1790766484032082
Energy: 1.2905977219296823
Energy: 1.2789712987233923
Energy: 1.2527745548126463
Energy: 1.193201390574394
Energy: 1.271772083424247
Energy: 1.1825717188769465
Energy: 1.186431341074096
Energy: 1.257782436033825
Energy: 1.1739388936264092
Energy: 1.2449653456527774
Energy: 1.1947705848261962
Energy: 1.1318087604794453
Energy: 1.213228706047961
Energy: 1.1758744521024065
Energy: 1.2784370581487146
Energy: 1.2698357823187751
Energy: 1.2436384691046931
Energy: 1.161584063278853
Energy: 1.1957786976721154
Energy: 1.1949548722451437
Energy: 1.19522744227323
Energy: 1.2307784237704025
Energy: 1.1738893090369884
Energy: 1.2558263617761356
Energy: 1.1687524867859753
Energy: 1.264466420351834
Energy: 1.2432701059178306
Energy: 1.1685958266366907
Energy: 1.2269110404212804
Energy: 1.1663116802334585
Energy: 1.2262072125727428
Energy: 1.262711662967144
Energy: 1.185241034021158
Energy: 1.23613978250169
Energy: 1.1815272816666886
Energy: 1.2775283662597405
Energy: 1.1681006044990703
Energy: 1.2506867628147662
Energy: 1.2473708554718732
Energy: 1.1917629728445853
Energy: 1.2582435392207552
Energy: 1.209589819797363
Energy: 1.209130825405589
Energy: 1.1327756036600094
Energy: 1.2362762510159226
Energy: 1.335615238102025
Energy: 1.3091620583799024
Energy: 1.2133651936613834
Energy: 1.0920772897768163
Energy: 1.2497684889266074
Energy: 1.16144384925361
Energy: 1.2037372374493354
Energy: 1.2750522690469808
Energy: 1.300415122788082
Energy: 1.3277241866430016
Energy: 1.3073861472936033
Energy: 1.3370334415169862
Energy: 1.2590383841879778
Energy: 1.294365754114392
Energy: 1.1583970253897624
Energy: 1.23033307416296
Energy: 1.3194183972588927
Energy: 1.1991732315983104
Energy: 1.2599277631969867
Energy: 1.22854745829376
Energy: 1.2463416841272812
Energy: 1.2806138369732345
Energy: 1.2698388759099706
Energy: 1.2741511414513118
Energy: 1.1518074201319535
Energy: 1.2712198772983185
Energy: 1.2207013900027481
Energy: 1.23284105730692
Energy: 1.2923461912365786
Energy: 1.1878936129516817
Energy: 1.2923616265677524
Energy: 1.2134124582043333
Energy: 1.3340809806716232
Energy: 1.2360704536681402
Energy: 1.2096375376718425
Energy: 1.2785836157713295
Energy: 1.1891762337006724
Energy: 1.2994146965242876
Energy: 1.1610565998640674
Energy: 1.2192263721507164
Energy: 1.2147071311503541
Energy: 1.301796918551238
Energy: 1.2679167040686847
Energy: 1.1765617573957425
Energy: 1.2130398644087708
Energy: 1.0991531100959384
Energy: 1.2099776152738166
Energy: 1.1692840847351493
Energy: 1.2810323542082243
Energy: 1.2995948064531078
Energy: 1.3215427635121844
Energy: 1.217279912124958
Energy: 1.2522650596168632
Energy: 1.327916343949184
Energy: 1.201835394317866
Energy: 1.2264976733383954
Energy: 1.2135355342885854
Energy: 1.3108030788296428
Energy: 1.4980817101848818
Energy: 1.2015640798712177
Energy: 1.238676003167883
Energy: 1.1524768398902185
Energy: 1.1797706815924023
Energy: 1.154822635497564
Energy: 1.156863198506542
Energy: 1.3267225393940563
Energy: 1.2196702801989343
Energy: 1.2154709536256012
Energy: 1.157718204399942
Energy: 1.2783503521074873
Energy: 1.3027258832425883
Energy: 1.1553082587226897
Energy: 1.2606719182490598
Energy: 1.164257724755794
Energy: 1.2613655573614395
Energy: 1.1739314159060843
Energy: 1.2008198325782857
Energy: 1.3319697605460166
Energy: 1.246632247056511
Energy: 1.367561808625779
Energy: 1.1969409679734468
Energy: 1.2155458581410081
Energy: 1.1511003485759401
Energy: 1.2456254962460152
Energy: 1.2838483453685468
Energy: 1.1474493874098832
Energy: 1.2360896411991118
Energy: 1.2126192166075607
Energy: 1.2776345886541864
Energy: 1.2188405047199193
Energy: 1.2727273058366972
Energy: 1.2940124930221968
Energy: 1.143405115505056
Energy: 1.29623753005253
Energy: 1.2341863413419076
Energy: 1.4102581839024755
Energy: 1.270396298939771
Energy: 1.2455853525539238
Energy: 1.1551627137613687
Energy: 1.2653070859707607
Energy: 1.250534081248557
Energy: 1.2169637647015468
Energy: 1.2670770620591665
Energy: 1.1729532175500867
Energy: 1.2320713437421358
Energy: 1.2817307374399314
Energy: 1.1566959055720174
Energy: 1.2715747178123373
Energy: 1.2377457538461913
Energy: 1.1909626061958871
Energy: 1.2177938241706543
Energy: 1.2315445080410585
Energy: 1.2084279069016166
Energy: 1.2524781630903097
Energy: 1.228208062876402
Energy: 1.2087239129969172
Energy: 1.3049631119302179
Energy: 1.1664892924119263
Energy: 1.2831861734656584
Energy: 1.244067501149896
Energy: 1.200396016217227
Energy: 1.2942617165853962
Energy: 1.1670831095779508
Energy: 1.1550104885434147
Energy: 1.1379991420729845
Energy: 1.2103783209304542
Energy: 1.2768985538968034
Energy: 1.2122232877069092
Energy: 1.343960261317022
Energy: 1.232930460259785
Energy: 1.195382563319249
Energy: 1.1792789394475691
Energy: 1.2304459714740839
Energy: 1.0893718869791233
Energy: 1.1936883629488344
Energy: 1.3133788569057625
Energy: 1.2388585099106486
Energy: 1.1988485534236133
Energy: 1.2610347502603023
Energy: 1.2410038150821847
Energy: 1.0955135955553845
Energy: 1.1741845727824747
Energy: 1.1841568174802188
Energy: 1.1407360398684494
Energy: 1.35674950458296
Energy: 1.2430060144006183
Energy: 1.2317683742843997
Energy: 1.2347472320083763
Energy: 1.1520063859382041
Energy: 1.2062351212818057

minimum gb energy = 1.0893718869791233 eV
minimum distance =  2.27159011125723 Angstroms
sigma value = 39


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

Energy: 1.0050808017414932
Energy: 1.3060243790246517
Energy: 1.3039113436326077
Energy: 1.0727933465376933
Energy: 1.183621290238691
Energy: 1.1534464251816543
Energy: 1.0048071398425178
Energy: 1.0536315225121347
Energy: 1.1028137242646354
Energy: 1.1132182186343953
Energy: 1.1761416859076097
Energy: 1.0788420991292809
Energy: 1.0751283277692334
Energy: 1.306822609371779
Energy: 1.4838607247779743
Energy: 1.0593018794268025
Energy: 1.1123640742227672
Energy: 1.059828185569516
Energy: 1.0941332568596673
Energy: 1.073770817882249
Energy: 1.181170786983175
Energy: 1.0451754524249932
Energy: 1.362249863834367
Energy: 1.0885359285915528
Energy: 1.1501320942710775
Energy: 1.135148971865578
Energy: 1.1582980326522143
Energy: 1.1355746910814821
Energy: 1.0547106152423875
Energy: 1.082158286674012
Energy: 1.095390552818544
Energy: 1.109583615260554
Energy: 1.3878821694643382
Energy: 1.2830977199523559
Energy: 1.0685931017695902
Energy: 0.9699530513014817
Energy: 1.0289208640134784
Energy: 1.0730465229746255
Energy: 1.2895895898736849
Energy: 1.1243035410105697
Energy: 1.0546045152689638
Energy: 1.227972653379184
Energy: 1.2787238712442082
Energy: 1.105007414705493
Energy: 1.063977776626517
Energy: 1.2761627957709685
Energy: 0.9855335008166749
Energy: 0.9843432126990234
Energy: 1.2892910601742193
Energy: 0.9914167356668662
Energy: 1.1003015565250922
Energy: 1.2932919004966954
Energy: 1.1320862461793835
Energy: 1.1461825725002013
Energy: 1.155107777614719
Energy: 1.1571385964530343
Energy: 0.9731542883654627
Energy: 1.1006005318506626
Energy: 1.2636920880167009
Energy: 1.098855553583712
Energy: 1.1436291358376434
Energy: 1.2672198068375984
Energy: 1.1574926091413915
Energy: 1.2936547354696502
Energy: 1.1277279674629281
Energy: 1.115354907917603
Energy: 1.1186610761261342
Energy: 1.1020051088750331
Energy: 1.0737338188771326
Energy: 1.06653000496667
Energy: 1.0261558744154584
Energy: 1.0327857529886746
Energy: 1.0859781999494174
Energy: 1.1201211951024017
Energy: 1.0734785526831816
Energy: 1.1087664718678143
Energy: 1.2814092552007472
Energy: 1.0550090412614272
Energy: 1.0898207516829865
Energy: 1.0861681432441748
Energy: 1.1439184697817217
Energy: 1.315376972856637
Energy: 1.1144410724833724
Energy: 1.28745446255026
Energy: 0.9881968872599765
Energy: 1.0849591021660652
Energy: 1.1149155235930124
Energy: 1.203643578880083
Energy: 1.1560206481213982
Energy: 1.154092989650002
Energy: 1.0674615179906073
Energy: 1.2906517501408208
Energy: 1.0291094737124558
Energy: 1.2593901876322657
Energy: 1.214940911769786
Energy: 0.9882925804487505
Energy: 0.9908651563078111
Energy: 1.2812190154034089
Energy: 0.9707894431575995
Energy: 1.1007143219056763
Energy: 1.068742525032276
Energy: 1.2761189644818027
Energy: 0.9847265508409889
Energy: 0.9702991109520862
Energy: 1.0987886137679617
Energy: 1.0052414959827523
Energy: 1.3061534010538542
Energy: 1.3035140174365043
Energy: 1.0705044525519138
Energy: 1.1840574508450956
Energy: 1.2667685809923463
Energy: 1.0049439931859554
Energy: 1.0536693557212449
Energy: 1.1028392384605783
Energy: 1.1085999173783407
Energy: 1.1769461688920804
Energy: 1.0786933043202633
Energy: 1.0741658775786131
Energy: 1.3070769565466922
Energy: 1.4836945009591151
Energy: 1.0583634893327674
Energy: 1.1106468088456858
Energy: 1.0601719272529742
Energy: 1.0937335125559473
Energy: 1.0738040043804402
Energy: 1.1813720243241024
Energy: 1.044735497629828
Energy: 1.3623623461333252
Energy: 1.0886840651586385
Energy: 1.1488470864263547
Energy: 1.134854741662601
Energy: 1.1125652711976284
Energy: 1.29574966838016
Energy: 1.071763464158483
Energy: 1.0772458088628216
Energy: 1.0958481390838941
Energy: 1.16637856402008
Energy: 1.3871629110352812
Energy: 1.2827497185557377
Energy: 1.0692943085430562
Energy: 0.9699374265972611
Energy: 1.0277434994969274
Energy: 1.0734254838590078
Energy: 1.2197466134736064
Energy: 1.1248656978859028
Energy: 0.9839634145047204
Energy: 1.22989956258653
Energy: 1.2737497811776384
Energy: 1.112812402560209
Energy: 1.0697016295066366
Energy: 1.2741513705236562
Energy: 0.9865804114012334
Energy: 0.9848877795036238
Energy: 1.2755700876905265
Energy: 0.972798133855217
Energy: 1.1048637437378153
Energy: 1.2884239964787025
Energy: 1.1318871724114314
Energy: 1.1530438905374631
Energy: 1.154976943283921
Energy: 1.157039705314329
Energy: 0.9728008691097514
Energy: 1.0566449119580648
Energy: 1.2662820534620782
Energy: 1.0998722355842852
Energy: 1.0845405397612558
Energy: 1.2672519491621197
Energy: 1.1572065071434494
Energy: 1.2931481006043488
Energy: 1.1460379138858126
Energy: 1.1089525043784736
Energy: 1.1218964399396718
Energy: 1.1042751583372608
Energy: 1.0745033345268242
Energy: 1.066295946837701
Energy: 1.0265613793467154
Energy: 1.0683803754764314
Energy: 1.0858856567296498
Energy: 1.1199522331446812
Energy: 1.0870555230608423
Energy: 1.144279862843992
Energy: 1.2814958870168633
Energy: 1.0552883113795983
Energy: 1.089468497076538
Energy: 1.086218957580675
Energy: 1.1438827037449288
Energy: 1.3156602230152128
Energy: 1.1069633009477062
Energy: 1.0703697796595406
Energy: 0.9722990738878711
Energy: 1.0851822298150464
Energy: 1.1146313068297105
Energy: 1.2041031810453355
Energy: 1.1557327294411006
Energy: 1.1540431386210979
Energy: 1.0672424885319238
Energy: 1.290503709768465
Energy: 1.0290283211123359
Energy: 1.272749072087942
Energy: 1.2149706207138757
Energy: 0.9838408923369936
Energy: 0.9875900340754741
Energy: 1.2801682504338838
Energy: 0.970424799465112
Energy: 1.1000695376216458
Energy: 1.072506259294988
Energy: 1.2188764486852333
Energy: 0.9851009677276673
Energy: 0.970415699572636
Energy: 1.1006961002048694

minimum gb energy = 0.9699374265972611 eV
minimum distance =  2.26640829973681 Angstroms
sigma value = 21


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

Energy: 1.2909398686634759
Energy: 1.416454614872901
Energy: 1.2645513161131359
Energy: 1.358972551714616
Energy: 1.0986589491065921
Energy: 1.285890625296024
Energy: 1.2709336841049836
Energy: 1.2926937233084619
Energy: 1.2492898996320108
Energy: 1.3356438319416089
Energy: 1.3287723777646492
Energy: 1.2934194284425182
Energy: 1.23977357477019
Energy: 1.4000451056630399
Energy: 1.219851496404026
Energy: 1.1663358642632877
Energy: 1.2167797536591864
Energy: 1.2845341415908555
Energy: 1.2943865179483296
Energy: 1.2313419114885225
Energy: 1.2605485370252458
Energy: 1.2311572287657873
Energy: 1.320847158124156
Energy: 1.14875019698349
Energy: 1.3100792620862372
Energy: 1.1254483188180953
Energy: 1.1276596503466656
Energy: 1.4242748336061668
Energy: 1.1053934437564692
Energy: 1.1108375531421715
Energy: 1.3006172791247956
Energy: 1.0856517700280264
Energy: 1.2811796642018016
Energy: 1.3440658045555767
Energy: 1.152244304785674
Energy: 0.9816318472326026
Energy: 1.0462646587305156
Energy: 1.2034161263630763
Energy: 1.1423942294449714
Energy: 1.2959501999648597
Energy: 1.2731907163394593
Energy: 1.1370156057612313
Energy: 1.2794264443343577
Energy: 1.5432985616887718
Energy: 1.1238110545540025
Energy: 1.2059964207522205
Energy: 0.9937499049643365
Energy: 0.9963285034156973
Energy: 1.1663143625353847
Energy: 1.156764143716721
Energy: 1.0899310324419267
Energy: 1.2503195219971384
Energy: 1.1528289901706534
Energy: 1.260819586750078
Energy: 1.1722637858984142
Energy: 1.1542030095924858
Energy: 1.115784596824899
Energy: 1.135488558354017
Energy: 1.2484078581903282
Energy: 1.3338608294178316
Energy: 1.3425116512512063
Energy: 1.2455944222165556
Energy: 1.2002702678146588
Energy: 1.2198631341765056
Energy: 1.2748926059552825
Energy: 1.1067902664616263
Energy: 1.2857023755558448
Energy: 1.0957070775989206
Energy: 1.261761026934578
Energy: 1.3260518539278434
Energy: 1.2510744046430509
Energy: 1.2564682720444607
Energy: 1.2211863406976557
Energy: 1.3299493979091437
Energy: 1.1890565162649012
Energy: 1.073606026115151
Energy: 1.4406890861517734
Energy: 1.2564211344780871
Energy: 1.4044396902825655
Energy: 1.3045920959904935
Energy: 1.3509921528464217
Energy: 1.2450759023414548
Energy: 1.232807367938065
Energy: 1.3344081168463162
Energy: 1.2501828089526816
Energy: 1.2292559324221777
Energy: 1.3241934185855864
Energy: 1.2434221507460643
Energy: 1.3006081996071175
Energy: 1.2446558033650632
Energy: 1.2729871561011799
Energy: 1.1300716677912082
Energy: 1.304490780299305
Energy: 1.328269800586084
Energy: 1.2064436614207306
Energy: 1.333280375248181
Energy: 1.348251775119736
Energy: 1.4269086710940861
Energy: 1.2455062703689095
Energy: 1.172601454435068
Energy: 1.1400659730939222
Energy: 1.2818286438486253
Energy: 1.2869064369619994
Energy: 1.277480439800988
Energy: 1.3712794927885619
Energy: 1.2557793154839
Energy: 1.2579356374445962
Energy: 1.1072369452268722
Energy: 1.3031760066769873
Energy: 1.1245221768625433
Energy: 1.1753495839288821
Energy: 1.3432596667516299
Energy: 1.172143751002391
Energy: 1.2543940981968364
Energy: 1.2013031727482877
Energy: 1.0981591277471343
Energy: 1.2242791573980831
Energy: 1.2670364539686394
Energy: 1.146347909339824
Energy: 0.9821936420082619
Energy: 1.0461747795162222
Energy: 1.3101272642648798
Energy: 1.210766040605816
Energy: 1.3847136111618041
Energy: 1.3906365753404453
Energy: 1.1554217071642372
Energy: 1.1283579388053289
Energy: 1.0841634572932113
Energy: 1.244653280440817
Energy: 1.116018342072819
Energy: 0.991149068687535
Energy: 0.995811361592104
Energy: 1.1329985622395375
Energy: 1.155709711507425
Energy: 1.1166634365067707
Energy: 1.271102154907517
Energy: 1.2016368182063404
Energy: 1.03723382232955
Energy: 1.1192251363629984
Energy: 1.1485905399451009
Energy: 1.0788825475037245
Energy: 1.1216046881264636
Energy: 1.246765352201281
Energy: 1.2482594781509524
Energy: 1.2525976225143813
Energy: 1.3700850066955534
Energy: 1.2035243841230059
Energy: 1.2305355239955507
Energy: 1.3004696985182638
Energy: 1.1058959926360792
Energy: 1.1865353946955999
Energy: 1.20538256570416
Energy: 1.324679127310394
Energy: 1.2503643948502754
Energy: 1.2425949148639481
Energy: 1.2661767016535914
Energy: 1.4012996333194025
Energy: 1.3759403447608458
Energy: 1.2519709761671731
Energy: 1.3503192284734225
Energy: 1.3603437960398213
Energy: 1.2834129060929866
Energy: 1.3591415055679261
Energy: 1.1832141957157
Energy: 1.4217223262835397
Energy: 1.2394032750560704
Energy: 1.2452879890851023
Energy: 1.4745321677501044
Energy: 1.1300979121054708
Energy: 1.2494395898255706
Energy: 1.408840110506292
Energy: 1.2208300841086732
Energy: 1.2490971584434873
Energy: 1.1875694937547616
Energy: 1.426566978364813

minimum gb energy = 0.9816318472326026 eV
minimum distance =  2.27518565197943 Angstroms
sigma value = 113


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

Energy: 1.199057163151157
Energy: 1.3998535286127476
Energy: 1.3002803177980202
Energy: 1.3331170023545826
Energy: 1.268427990685688
Energy: 1.2777412682748446
Energy: 1.3548451265221324
Energy: 1.360779817761506
Energy: 1.409248647816236
Energy: 1.3765706446159014
Energy: 1.3851366080475696
Energy: 1.398415186169869
Energy: 1.359283842602839
Energy: 1.3892260362808857
Energy: 1.4221434938571584
Energy: 1.3824316033251842
Energy: 1.2521184785532047
Energy: 1.299823033290136
Energy: 1.2997086279390768
Energy: 1.2679144784913534
Energy: 1.417537226238407
Energy: 1.2120319749697985
Energy: 1.4124171535921968
Energy: 1.2148008661372056
Energy: 1.2811863482959756
Energy: 1.276806046946965
Energy: 1.208034182987576
Energy: 1.4264110150121003
Energy: 1.207585207041731
Energy: 1.3548128048826578
Energy: 1.3784927226668466
Energy: 1.3356980986651232
Energy: 1.3234520902015734
Energy: 1.3840094138710182
Energy: 1.3173753766889902
Energy: 1.0806592068750749
Energy: 1.2390294729765663
Energy: 1.2653165901765937
Energy: 1.3344221926887425
Energy: 1.253381611224343
Energy: 1.2567399868599336
Energy: 1.2030053372878138
Energy: 1.3072195752939642
Energy: 1.5017617860918884
Energy: 1.3404428663980839
Energy: 1.2948052915827544
Energy: 1.2607307456959023
Energy: 1.3010724377078648
Energy: 1.3726651963784728
Energy: 1.3718413234951192
Energy: 1.264114774639847
Energy: 1.293650798699143
Energy: 1.3200217779486882
Energy: 1.3264467291903579
Energy: 1.3065707421789434
Energy: 1.1794221601087462
Energy: 1.1210843861449822
Energy: 1.2939116578418428
Energy: 1.2488000878440513
Energy: 1.331369401192885
Energy: 1.2836716890450879
Energy: 1.2901128149253465
Energy: 1.274775045345103
Energy: 1.2354284892871943
Energy: 1.2999482377762546
Energy: 1.326899581282673
Energy: 1.3132260685978645
Energy: 1.4152767634470504
Energy: 1.2738590660211908
Energy: 1.24133558798867
Energy: 1.2603375649065143
Energy: 1.2109730210329643
Energy: 1.2427994644557985
Energy: 1.2691238502504747
Energy: 1.3718974084366615
Energy: 1.2209573332837251
Energy: 1.363525610680308
Energy: 1.2134184349307928
Energy: 1.3712939936228077
Energy: 1.2718300162640437
Energy: 1.313170763265453
Energy: 1.224150139198416
Energy: 1.2346587835584049
Energy: 1.2928281237513457
Energy: 1.3398000702877337
Energy: 1.1887255750253582
Energy: 1.2274339899173723
Energy: 1.262764630036068
Energy: 1.3138960891264233
Energy: 1.2421582877250674
Energy: 1.2107008749610655
Energy: 1.2766445754341267
Energy: 1.3337542154927933
Energy: 1.3526681208633253
Energy: 1.278923488140669
Energy: 1.3038845362631248
Energy: 1.413617106319025
Energy: 1.3298347721548978
Energy: 1.101028363080393
Energy: 1.289540902943906
Energy: 1.2373435225113638
Energy: 1.2889279736356942
Energy: 1.3196573383933372
Energy: 1.3171066081861542
Energy: 1.2419530943753125
Energy: 1.1804827788513448
Energy: 1.27089780187521
Energy: 1.3465137649280916
Energy: 1.3950816111846462
Energy: 1.323690850924744
Energy: 1.3364112596094477
Energy: 1.3810167211812996
Energy: 1.2309258503081535
Energy: 1.455813344059224
Energy: 1.3067717335435696
Energy: 1.3150027613269455
Energy: 1.2397015334820158
Energy: 1.2307901333256042
Energy: 1.3810261774111943
Energy: 1.1886720570531843
Energy: 1.3055688051747136
Energy: 1.2220449647260416
Energy: 1.2387931941469115
Energy: 1.2206482284678524
Energy: 1.2180393611920848
Energy: 1.292036027417583
Energy: 1.3539418203194955
Energy: 1.3987315313634572
Energy: 1.3021138079144512
Energy: 1.3804364139339593
Energy: 1.4530780691989533
Energy: 1.4872874231854956
Energy: 1.4124477027563431
Energy: 1.2265823162737126
Energy: 1.420328404686956
Energy: 1.2321654713724126
Energy: 1.3099490413531454
Energy: 1.277007738622183
Energy: 1.2776081753491375
Energy: 1.3893966798477135
Energy: 1.3740221585016505
Energy: 1.473070166423055
Energy: 1.3564080554956333
Energy: 1.3678785536531664
Energy: 1.3177893813653754
Energy: 1.2391789590030517
Energy: 1.3685924430214815
Energy: 1.362053751916666
Energy: 1.476738199848804
Energy: 1.324261019297004
Energy: 1.462163132233778
Energy: 1.2834566542792527
Energy: 1.231744482136144
Energy: 1.3136123756742506
Energy: 1.2004668204841202
Energy: 1.3027881168039013
Energy: 1.3084758799785752
Energy: 1.3260116813698584
Energy: 1.2683937730020716
Energy: 1.2872832041780045
Energy: 1.3540605598370286
Energy: 1.4105731575405496
Energy: 1.4406899113556435
Energy: 1.3788995602998826
Energy: 1.4030212944452107
Energy: 1.4039258284664005
Energy: 1.3551780390325676
Energy: 1.3836697091718126
Energy: 1.2999412211111825
Energy: 1.3808493461645308
Energy: 1.2329942658678863
Energy: 1.297688310567505
Energy: 1.2346756499209564
Energy: 1.2325202097751993
Energy: 1.4180802690763399
Energy: 1.2104399240127568
Energy: 1.4127463072998518
Energy: 1.219657079479381
Energy: 1.2819322832144655
Energy: 1.2640305533429554
Energy: 1.2388984965510437
Energy: 1.4241605419687438
Energy: 1.2434615983666382
Energy: 1.3740401661441681
Energy: 1.3395152753593336
Energy: 1.3119307565179013
Energy: 1.3981551877310978
Energy: 1.367688285709993
Energy: 1.3157894675388786
Energy: 1.0964852141793238
Energy: 1.2376250610994204
Energy: 1.2622183645264655
Energy: 1.3265599011979254
Energy: 1.251715804882724
Energy: 1.2359508858777652
Energy: 1.2733422483552561
Energy: 1.3317907711286023
Energy: 1.28533021164303
Energy: 1.3735435278782562
Energy: 1.328649290326423
Energy: 1.277727922512475
Energy: 1.311408662539416
Energy: 1.3740667476063937
Energy: 1.3707677880494393
Energy: 1.1723000654545326
Energy: 1.2328569271312615
Energy: 1.316151411024915
Energy: 1.3174538823151056
Energy: 1.2137517046155248
Energy: 1.1902739368666737
Energy: 1.1120666622630342
Energy: 1.29414097297674
Energy: 1.2637547923559882
Energy: 1.3221220307930743
Energy: 1.2683525142418868
Energy: 1.2928705753564822
Energy: 1.2647967820725137
Energy: 1.2765857381146315
Energy: 1.3102068265845372
Energy: 1.3158217007071114
Energy: 1.3391819521822699
Energy: 1.4111531166758595
Energy: 1.2531142518793807
Energy: 1.2422599977233673
Energy: 1.2589328260242798
Energy: 1.2404435781582195
Energy: 1.2167622225242676
Energy: 1.3987130742040814
Energy: 1.3327188481650005
Energy: 1.2345975924740438
Energy: 1.3357721456566551
Energy: 1.214876810418417
Energy: 1.3897014306016982
Energy: 1.2903627631398462
Energy: 1.3193342057512571
Energy: 1.2234082376797524
Energy: 1.238042619472472
Energy: 1.3243122970452308
Energy: 1.3420803370181584
Energy: 1.2816995225731407
Energy: 1.2309411544383575
Energy: 1.259140907712184
Energy: 1.3063633904182514
Energy: 1.2646481589267025
Energy: 1.199818810806062
Energy: 1.2767075455257442
Energy: 1.2658760756291492
Energy: 1.3479906021635137
Energy: 1.3346490757062013
Energy: 1.366594536783218
Energy: 1.3917345944406623
Energy: 1.3316349615367
Energy: 1.098136757142596
Energy: 1.3128906828128037
Energy: 1.2349312955400518
Energy: 1.2690304848590948
Energy: 1.3269010745982601
Energy: 1.3034819887136735
Energy: 1.2518898222455968
Energy: 1.2078535955392362
Energy: 1.2834099487404813
Energy: 1.342554817388726
Energy: 1.289086070989911
Energy: 1.301595265624837
Energy: 1.3428976045880856
Energy: 1.3740525963825394
Energy: 1.2257323575378933
Energy: 1.4614975149146403
Energy: 1.2349532445972196
Energy: 1.3131396807735611
Energy: 1.228094258018385
Energy: 1.157423047748057
Energy: 1.3847464659155695
Energy: 1.1456802655097953
Energy: 1.3022863874990847
Energy: 1.2393242846620665
Energy: 1.2402363840239616
Energy: 1.282378947260226
Energy: 1.2188917830997865
Energy: 1.2927051709698845
Energy: 1.3568970005061194
Energy: 1.3973991779844384
Energy: 1.2393265768248933
Energy: 1.3856046819096257
Energy: 1.4474308009847996
Energy: 1.4719216983191143
Energy: 1.2897397047713939
Energy: 1.218753455199451
Energy: 1.3714718703562985
Energy: 1.2258411583076898
Energy: 1.3062259419692053
Energy: 1.276793888145357
Energy: 1.275999415466785
Energy: 1.3868372308952022
Energy: 1.3732310612366307
Energy: 1.4839195075206157
Energy: 1.2950675656459982
Energy: 1.4662966020768107
Energy: 1.2777036957464978
Energy: 1.197700422081589
Energy: 1.3892045335888101
Energy: 1.358614862501247
Energy: 1.387661009462794
Energy: 1.2971162031509864
Energy: 1.3634359681366106
Energy: 1.2932032217444889
Energy: 1.2454840565993697
Energy: 1.3136792590220812
Energy: 1.2044729592745105
Energy: 1.4458095749431656
Energy: 1.308471060015257
Energy: 1.329570811880136
Energy: 1.2720844311471686
Energy: 1.2908982926261257
Energy: 1.3551478420566567

minimum gb energy = 1.0806592068750749 eV
minimum distance =  2.22102240380836 Angstroms
sigma value = 365


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

Energy: 1.1069426387182677
Energy: 1.2795513890263333
Energy: 1.0814942744502993
Energy: 1.1106595496174945
Energy: 1.1105481314311016
Energy: 1.0811804527034785
Energy: 1.0768698262359537
Energy: 1.0907965374137956
Energy: 1.318996175619498
Energy: 1.0240078850294172
Energy: 1.0245174547710865
Energy: 1.0242039603789375
Energy: 1.023833179643211
Energy: 1.307751814419724
Energy: 1.0877934960514768
Energy: 1.277384365200908
Energy: 1.024732021774376
Energy: 1.0231084692189474
Energy: 1.0228490350731927
Energy: 1.023912400705578
Energy: 1.026366122642637
Energy: 1.061841513044783
Energy: 1.2792853328397351
Energy: 1.060095338665443
Energy: 1.0236998140995863
Energy: 1.0230808110679608
Energy: 1.0240516927214796
Energy: 1.0798374817784266
Energy: 1.1052873210539806
Energy: 1.318913332875005
Energy: 1.0708705569928392
Energy: 1.3743336509620536
Energy: 1.024228491191961
Energy: 1.0698399283425752
Energy: 1.3192652524111022
Energy: 1.0889684640364907
Energy: 1.2788934197098925
Energy: 1.0602529124876952
Energy: 1.0794667312845458
Energy: 1.1106581205778918
Energy: 1.0806534158778036
Energy: 1.077217865854225
Energy: 1.0615635375236645
Energy: 1.319188078824441
Energy: 1.024147360084945
Energy: 1.0234517412824395
Energy: 1.0235403563238878
Energy: 1.0242159259107018
Energy: 1.3075526797593595
Energy: 1.0620149440815592
Energy: 1.3212029117835782
Energy: 1.0250376889451724
Energy: 1.0230794510808399
Energy: 1.0229467995819372
Energy: 1.024621618050189
Energy: 1.3206255355968757
Energy: 1.0886231963991064
Energy: 1.2796639305569018
Energy: 1.059971035208715
Energy: 1.0244675457129022
Energy: 1.0236868975612867
Energy: 1.0602034017615782
Energy: 1.0780879039625393
Energy: 1.1057182927611564
Energy: 1.3899830830686921
Energy: 1.070677253152727
Energy: 1.3741126772118084
Energy: 1.3739831803380318
Energy: 1.0695100881953192
Energy: 1.3885080924814481
Energy: 1.0884478287369463
Energy: 1.279696217134446
Energy: 1.0603762345803591
Energy: 1.0239302701486201
Energy: 1.023947651157424
Energy: 1.0243020972305172
Energy: 1.0786985699808027
Energy: 1.0610791356439062
Energy: 1.3067281767827477
Energy: 1.0243022289772272
Energy: 1.023176415857287
Energy: 1.0226925418818746
Energy: 1.0246943752306303
Energy: 1.3083757441933026
Energy: 1.0616592533852742
Energy: 1.3180842742641836
Energy: 1.0242976052334607
Energy: 1.0239058292982115
Energy: 1.0242239196681855
Energy: 1.023669325982385
Energy: 1.3220151546949546
Energy: 1.107936502539516
Energy: 1.2798352059163887
Energy: 1.0815341539773557
Energy: 1.022652182820602
Energy: 1.1108813526664956
Energy: 1.0813081888544402
Energy: 1.078038951071704
Energy: 1.1060328871902645
Energy: 1.318565989116711
Energy: 1.0712117600407145
Energy: 1.02425282560375
Energy: 1.0233312610872807
Energy: 1.0225164571791734
Energy: 1.3202815192807837
Energy: 1.0877640586574564
Energy: 1.278357143431913
Energy: 1.0248188701208696
Energy: 1.0234092419793606
Energy: 1.0230094925560325
Energy: 1.0243715074802928
Energy: 1.080641527798917
Energy: 1.0876921867913325
Energy: 1.2783687989780508
Energy: 1.0254273598771546
Energy: 1.0231565241323608
Energy: 1.0228567796121943
Energy: 1.0244586895086372
Energy: 1.0805935215137992
Energy: 1.1113826665066209
Energy: 1.3187052550334852
Energy: 1.0225743969370238
Energy: 1.0245321607114068
Energy: 1.0248937405198415
Energy: 1.0243110841720455
Energy: 1.320372624883909
Energy: 1.1072563885657478
Energy: 1.2793191074401151
Energy: 1.0815571410643718
Energy: 1.110953487626838
Energy: 1.1107918771292562
Energy: 1.0812481723285068
Energy: 1.0767338560017485
Energy: 1.0605737040968999
Energy: 1.318861735362854
Energy: 1.0244962977970773
Energy: 1.0239528128097424
Energy: 1.023856457795743
Energy: 1.0238949370744679
Energy: 1.3215467760683297

minimum gb energy = 1.0225164571791734 eV
minimum distance =  2.27524949208769 Angstroms
sigma value = 23