Model name: model_name=EAM_Dynamo_HaleWongZimmerman_2008PairMorse_PdAgH__MO_108983864770_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.884859305620196
cohesive_energy=3.9107321447526497
mass=106.42
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=[9.87708249151686e-20, 1.6354698644545198e-19, 2.2192229210524197e-19, 2.7662861327317196e-19, 3.24194033183364e-19, 3.6551256639759e-19, 4.0101359625376197e-19, 4.31262691103682e-19, 4.56935969486898e-19, 4.786839151168139e-19, 4.97056074578892e-19, 5.12497852977384e-19, 5.305335553463219e-19, 5.482408115052899e-19, 5.64152027657544e-19, 5.78010855541644e-19, 5.899102214023619e-19, 5.999831059003199e-19, 6.08335252693362e-19, 6.150387597300179e-19, 6.201513053691119e-19, 6.237289657928339e-19, 6.25832623713276e-19, 6.265183553126279e-19, 6.2577814970772e-19, 6.233796912866219e-19, 6.190281795486779e-19, 6.120859481935559e-19, 6.03209889641196e-19, 5.918873073687179e-19, 5.76987064672518e-19, 5.57530231629222e-19, 5.32472189073462e-19, 5.00548819641012e-19, 4.60143527108166e-19, 4.0918629926379594e-19, 3.45075201254286e-19, 2.64597868928466e-19, 1.63836980416206e-19, 4.06975295508876e-20, -1.1404036932550558e-19, -3.0838856068895397e-19, -5.53685007707622e-19, -8.672421902178599e-19, -1.2728091724654499e-18, -1.80598952361114e-18, -2.5183012333212e-18, -3.5006758364582994e-18, -4.916999980914299e-18, -9.14423087735892e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.015994504009498596
Energy: 0.01844668264793663
Energy: 0.30594471590127326
Energy: 0.6638657794343544
Energy: 0.6552713661925045
Energy: 0.25115217924413796
Energy: 0.016958151659822545
Energy: 0.0165949184700004
Energy: 0.5085045802123161
Energy: 0.07684228473183417
Energy: 0.31608026740034145
Energy: 0.5075681042144666
Energy: 0.0170523933245747
Energy: 0.07877072246259187
Energy: 0.016436776808323963
Energy: 2.6561270890274997
Energy: 5.0801057279635735
Energy: 0.3066124769135468
Energy: 0.5054331561834393
Energy: 2.6283142040745595
Energy: 0.07841926417316843
Energy: 0.018354198306362028
Energy: 2.6768345800920375
Energy: 0.3068514806897287
Energy: 0.663556161911725
Energy: 0.5085076293157466
Energy: 0.07722927021743992
Energy: 0.016905100006651082
Energy: 2.667581556299878
Energy: 0.506653342331235
Energy: 0.0767012563777515
Energy: 5.408862603202349
Energy: 2.7274059117355636
Energy: 0.01653313296149162
Energy: 0.07744443718226175
Energy: 0.016306440259640245
Energy: 2.6840458119752895
Energy: 5.306079988916026
Energy: 0.3138465884435755
Energy: 0.5040535538925235
Energy: 0.07687665572924844
Energy: 2.7149664009094536

minimum gb energy = 0.015994504009498596 eV
minimum distance =  0.880230455678177 Angstroms
sigma value = 5


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

Energy: 0.7838058309848979
Energy: 0.8411121141604
Energy: 1.096987858832314
Energy: 1.0357264335111827
Energy: 1.1561636933132262
Energy: 1.0953916911586181
Energy: 1.3698867388527396
Energy: 0.9696832900870634
Energy: 0.7125579816159892
Energy: 1.0674929880539168
Energy: 1.6313537147814992
Energy: 1.0650989039910381
Energy: 1.0319698520623246
Energy: 0.7422473151008527
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Energy: 0.7794421193475299
Energy: 1.1070014293409496
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Energy: 0.787005745972871
Energy: 0.8161956168560695
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Energy: 1.0875136137814334
Energy: 0.6922652837677711
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Energy: 0.986326202626687
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Energy: 0.7051026411817536
Energy: 0.7030762918429316
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Energy: 0.7232241004187829
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Energy: 1.0249369779087916
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Energy: 0.722583400882682
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Energy: 0.9803986413303315
Energy: 0.7316748958913062
Energy: 0.7324550103900574
Energy: 1.000527509495535
Energy: 0.757662268515269
Energy: 0.7218989061174766
Energy: 1.3334664973084054
Energy: 0.7757042767822141
Energy: 0.7554819243855727
Energy: 0.706670597610122
Energy: 0.7588840357448765
Energy: 0.7928095183406967
Energy: 1.3325211915481747
Energy: 0.7641979489638587
Energy: 1.013971969859516
Energy: 0.7337543618369502
Energy: 0.7438770323280686
Energy: 1.0436288146205885
Energy: 1.0430164758380058
Energy: 0.7325783929734149
Energy: 0.7902536467242748
Energy: 1.1112259595952183
Energy: 1.0887568890821193
Energy: 1.098588282225938
Energy: 0.7451419967116393
Energy: 0.7394500526963235
Energy: 0.697990900956573
Energy: 0.7479545534721951
Energy: 0.7439023102082812
Energy: 1.052673623431673
Energy: 0.788946097262531
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Energy: 1.1038267642484085
Energy: 0.7182356193602575
Energy: 0.7524960026523477
Energy: 1.1835025318319827
Energy: 0.6991259510986142
Energy: 0.7292862115954037

minimum gb energy = 0.6724988232830649 eV
minimum distance =  2.43503461902842 Angstroms
sigma value = 401


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

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Energy: 0.7259834004889327
Energy: 0.7236599221501909
Energy: 0.6953723796690526
Energy: 1.1299503916035762
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Energy: 0.7638874661039724
Energy: 0.7600651670132679
Energy: 0.6948293730099147
Energy: 0.6946858279988016
Energy: 0.6892208994340177
Energy: 0.706580404360056
Energy: 0.7881269732648619
Energy: 0.808177747701936
Energy: 0.7636033077569988
Energy: 1.3475457406212832
Energy: 0.7021101737866103
Energy: 0.67944627917159
Energy: 0.960864118138172
Energy: 0.7847756722537198
Energy: 0.6869831091433769
Energy: 0.7314357670976539
Energy: 1.3538700580121625
Energy: 0.8042138807797389
Energy: 0.7101871047183153
Energy: 0.780423107793251
Energy: 0.7362365263218816
Energy: 0.6983267949736776
Energy: 0.7440832708477304
Energy: 0.7103220126125788
Energy: 0.6896931614633611
Energy: 1.2550445563255381
Energy: 0.6985315806357788
Energy: 0.7262562540193164
Energy: 0.6858877124673022
Energy: 0.7057760195473326
Energy: 0.7030075632400214
Energy: 0.9731681269742368
Energy: 0.6860718302892975
Energy: 0.736056203261936
Energy: 0.6876522574390667
Energy: 0.6942893829385876
Energy: 0.7179628002405937
Energy: 1.3951640481788063
Energy: 0.7062927324652777
Energy: 0.6865834588624911
Energy: 0.9093456703655358
Energy: 0.6922531131924433
Energy: 0.7001656257390356
Energy: 0.7184417979740473
Energy: 0.7204186995070021
Energy: 0.7148872747890911
Energy: 0.72963234945102
Energy: 0.762562216408092
Energy: 0.7878179341481483
Energy: 0.8359620444352045
Energy: 0.7639481652953765
Energy: 0.8651594704453702
Energy: 0.7075657925150807
Energy: 0.7031292158129028
Energy: 0.7712557519062305
Energy: 0.777440518170717
Energy: 0.69713032892924
Energy: 0.6988179186893779
Energy: 0.7162888105559487
Energy: 0.6911379665060449
Energy: 0.6940981854170217
Energy: 1.0233156270426915
Energy: 0.7978789792768309
Energy: 0.794809736377837
Energy: 0.7638280078784471
Energy: 0.7120475669400534
Energy: 0.7202477548586225
Energy: 0.6890626788782586
Energy: 0.6979416308975274
Energy: 0.7485226900613935
Energy: 0.7036962884066664
Energy: 0.7324809980209361
Energy: 0.6988836479066143
Energy: 0.7002175121278039
Energy: 0.6809688343143928
Energy: 0.8815962762089176
Energy: 0.8059626618334841
Energy: 0.7732217725659599
Energy: 0.7307100068106631
Energy: 0.6824361601763248
Energy: 0.7056181490166082
Energy: 0.6864010477470704
Energy: 0.783980521206127
Energy: 0.7604678676258155
Energy: 0.7506285919090376
Energy: 0.7389661148945982
Energy: 1.4347207065268455
Energy: 0.8222893617500657
Energy: 0.7184140635223636
Energy: 0.7863277135114529
Energy: 0.7485149234193695
Energy: 0.9065616562676712
Energy: 0.7366622717429809
Energy: 0.7363788303066603
Energy: 0.7382704508010487
Energy: 0.7277997968870946
Energy: 1.0537967003287143
Energy: 0.7533765153023964
Energy: 0.6949544690074368
Energy: 0.9138787862297583
Energy: 0.6951989973479943
Energy: 0.9315567801653658
Energy: 1.9974756718754672
Energy: 0.7492288919035794
Energy: 0.7153819216613131

minimum gb energy = 0.67944627917159 eV
minimum distance =  2.413462748968 Angstroms
sigma value = 311


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

Energy: 0.7219893373151389
Energy: 0.6802937940257844
Energy: 0.6911967701583581
Energy: 1.4848403639157277
Energy: 0.7134350256314401
Energy: 0.7133619487672896
Energy: 0.7078045122321346
Energy: 0.7127768008492869
Energy: 0.7381133724372309
Energy: 0.7128928786100902
Energy: 0.7146202189426446
Energy: 0.9315585993309626
Energy: 0.9292956871081114
Energy: 0.7324644906882499
Energy: 1.3417826026439548
Energy: 0.7245417615270502
Energy: 0.7085866522804186
Energy: 0.6888859480752545
Energy: 0.7142693639212505
Energy: 0.9300296216199915
Energy: 0.923465805728055
Energy: 0.7196683379168782
Energy: 0.7189724993112323
Energy: 0.7376550143959446
Energy: 1.1211815463052692
Energy: 1.8850861212123278
Energy: 0.700407425026414
Energy: 0.765972519408218
Energy: 0.909839128350081
Energy: 0.7205215891901408
Energy: 0.9011912871237507
Energy: 0.703703860985176
Energy: 0.7266051311698168
Energy: 0.7176879284010089
Energy: 1.1595471647539117
Energy: 0.7035469015345955
Energy: 0.7258406379097705
Energy: 0.7085905287340915
Energy: 1.4445274331859965
Energy: 1.095890960127041
Energy: 0.6836399952004508
Energy: 0.94378107230629
Energy: 0.7089056870093735
Energy: 1.1395616715631938
Energy: 0.6964679016712152
Energy: 1.4685308073873824
Energy: 1.1150356987613004
Energy: 0.7104397193195189
Energy: 0.7134771968938732
Energy: 0.9171876042456085
Energy: 0.9848144403117516
Energy: 0.9597716226010098
Energy: 0.7538192013069785
Energy: 0.7231660713381238
Energy: 0.9765811627876111
Energy: 0.7303828872731158
Energy: 0.6777092541629235
Energy: 0.9262447835366725
Energy: 1.287596579870035
Energy: 0.6799499590800813
Energy: 0.7172927892797291
Energy: 1.1024638101891522
Energy: 0.7150555338376602
Energy: 0.6938084633298357
Energy: 0.7354134658595204
Energy: 0.7080055479541222
Energy: 1.6553880609118106
Energy: 1.6284317095726073
Energy: 0.6976233569443191
Energy: 0.7343031407816858
Energy: 0.7211941835681895
Energy: 1.3252118531754633
Energy: 0.7022371538443852
Energy: 0.7169778221843327
Energy: 0.7020490373025476
Energy: 0.6802397991129723
Energy: 1.485149696927433
Energy: 0.6928376686205628
Energy: 0.7210889571186012
Energy: 0.6966079084689478
Energy: 1.326608453043607
Energy: 1.4586859554469163
Energy: 0.7034404679018669
Energy: 0.7056748845969124
Energy: 0.724292983605713
Energy: 0.6950439811671935
Energy: 0.6955421389835985
Energy: 1.271951728749288
Energy: 1.264448639225027
Energy: 0.6991016992064633
Energy: 0.7437239457237742
Energy: 0.7089581264306883
Energy: 0.9850240898094169
Energy: 0.700224860464613
Energy: 0.7442679412497316
Energy: 0.7599391643674183
Energy: 0.7486316204120457
Energy: 0.9762711134309782
Energy: 0.6842022981612865
Energy: 0.7291338886648753
Energy: 0.6874016629250791
Energy: 0.9100362333498251
Energy: 1.1099279676324554
Energy: 1.299412735817341
Energy: 0.7457613031530244
Energy: 1.1119678383531133
Energy: 0.7690366720410332
Energy: 0.679882353740828
Energy: 0.9269557019215029
Energy: 1.2505129894244402
Energy: 1.442442702443219
Energy: 0.7359605954444624
Energy: 0.7478011648989079
Energy: 1.3376875043906757
Energy: 0.7242852367444998
Energy: 0.7191411945226089
Energy: 0.7178816298649359
Energy: 0.7466744752014707
Energy: 1.502598081992569
Energy: 2.1673431800533396
Energy: 0.9841053245329362
Energy: 1.801767720415916
Energy: 0.6917902414447851
Energy: 0.8845709213941455
Energy: 1.4341489731455221
Energy: 0.7408875889370931
Energy: 0.6807937511731713
Energy: 1.1349343946904034
Energy: 0.7503092159555617
Energy: 1.475515378008746
Energy: 1.4650493806558855
Energy: 0.7095135759555815
Energy: 0.7515047017044133
Energy: 0.7688924941050592
Energy: 0.7596261776004162
Energy: 0.7076339375446404
Energy: 0.7517866667273793
Energy: 0.7624261137444356
Energy: 0.7638070855681574
Energy: 0.9776549044044803
Energy: 0.7045416835059489
Energy: 0.7320148507351711
Energy: 0.6866217960454194
Energy: 1.1118876833514695
Energy: 1.6445742872556592
Energy: 0.7220088854178983
Energy: 0.7407509939095782
Energy: 1.2598253584114159
Energy: 0.6986909852325396
Energy: 1.9732498953866477
Energy: 0.8962201850214468
Energy: 1.466380308823047
Energy: 1.4964972740833873
Energy: 0.7298348445647974
Energy: 0.7213032471417973
Energy: 1.3146379381018327
Energy: 0.7276392496353151
Energy: 0.7343112897250134
Energy: 0.7100311805057856
Energy: 0.7140791257731082
Energy: 1.160827721832863
Energy: 1.3216239038899602
Energy: 1.1871422138678571
Energy: 1.6385014024132172
Energy: 0.7211397300364856
Energy: 0.9361847999700899
Energy: 1.2616859425659173
Energy: 0.7101655443903189
Energy: 0.7232269584601473
Energy: 1.1304392605587221
Energy: 0.6964892444473876
Energy: 0.6880502126829787
Energy: 0.9116848227462168
Energy: 0.7105314374696731
Energy: 0.9620770213745847
Energy: 0.7237083286286661
Energy: 1.0250525708579536
Energy: 0.7188417755049965
Energy: 0.7847139555560156
Energy: 0.7636123882220982
Energy: 0.7593952864212911
Energy: 1.1397107020670587
Energy: 0.7006990120353583
Energy: 0.6906831121625279
Energy: 1.073227642924753
Energy: 1.4684139807016117
Energy: 1.2503365198060048
Energy: 0.875748130179808
Energy: 0.7728113066271707
Energy: 1.4502567533031925
Energy: 0.7158296930469227
Energy: 1.0683875924271444
Energy: 0.7496775461510846
Energy: 1.4519024432880576
Energy: 1.44200211699506
Energy: 0.7307599629078805
Energy: 0.7278677387611803
Energy: 1.1306771408532
Energy: 0.7002520248889968
Energy: 0.7211682923517729
Energy: 0.73572292696209
Energy: 0.707948767415404
Energy: 1.5546801306516906
Energy: 0.7293690707679498
Energy: 0.9599472352483318
Energy: 0.7106121873152741
Energy: 1.1005883317153495
Energy: 0.8998541604052487
Energy: 0.7155764819115028
Energy: 0.7306728552500902
Energy: 1.142097559698433
Energy: 0.9684079074256663
Energy: 1.230943556933186
Energy: 0.7366895702420835
Energy: 0.9036350530158148
Energy: 1.8626398150168504
Energy: 0.7449482782547566
Energy: 0.7250561243553759
Energy: 0.9911441019491524
Energy: 0.7012058647614141
Energy: 0.8085362340580436
Energy: 0.7443123066964241
Energy: 0.7545292780926963
Energy: 0.7294991950267096
Energy: 1.11818100443681
Energy: 0.6922549700849812
Energy: 0.9060183750900892
Energy: 1.2699767532839517
Energy: 1.6084372710882415
Energy: 0.8791367445033015
Energy: 0.7244331491670197
Energy: 0.6936052195012812
Energy: 0.7281793307694446
Energy: 0.7200097863339728
Energy: 1.6479955903944281
Energy: 0.7016041495888357
Energy: 0.6922919075961129
Energy: 0.7290428594500744
Energy: 0.7128111555434093
Energy: 0.9531379152031877
Energy: 0.7127647860105643
Energy: 0.7158001613608773
Energy: 0.7270543965492299
Energy: 0.7187779513945789
Energy: 1.4824710006141857
Energy: 0.7661288784949233
Energy: 1.1584355447142207
Energy: 0.7239294113499589
Energy: 0.9250524746514497
Energy: 1.4570578903943374
Energy: 0.7075691688597346
Energy: 0.6970856823822537

minimum gb energy = 0.6777092541629235 eV
minimum distance =  2.43155622025909 Angstroms
sigma value = 39


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

Energy: 0.6418742079133415
Energy: 0.6312797677356833
Energy: 0.7123693844595194
Energy: 0.8094632580172102
Energy: 0.7634894839092798
Energy: 0.7611459133830033
Energy: 0.6314903471485201
Energy: 1.5165186313653596
Energy: 0.714866752536358
Energy: 0.7654123335703753
Energy: 0.7681093477867673
Energy: 0.7116379866190577
Energy: 0.702105789611874
Energy: 0.6940678488042366
Energy: 3.28369032993212
Energy: 0.7076305241575673
Energy: 0.7145699909730361
Energy: 0.779285392342494
Energy: 0.7126426764754226
Energy: 0.6970601366953593
Energy: 0.6962332959751213
Energy: 0.6984122038279637
Energy: 0.7139505553580933
Energy: 0.7708585993771035
Energy: 0.709358673729749
Energy: 0.7701091675348597
Energy: 0.7147770767785727
Energy: 0.801790805143846
Energy: 0.6958958338294808
Energy: 0.711260978338294
Energy: 0.7605640613818997
Energy: 0.7143185408661472
Energy: 0.7709366310835528
Energy: 1.6593307796759844
Energy: 0.6966536594280888
Energy: 0.6315299447710694
Energy: 0.7151348224522144
Energy: 1.6136382201909965
Energy: 2.5204044649284474
Energy: 2.466825453441424
Energy: 2.4332329006270292
Energy: 0.7001252540989285
Energy: 0.6962166198336569
Energy: 0.7156815988310705
Energy: 0.7059194174900827
Energy: 0.7870298740596685
Energy: 0.6318752151572595
Energy: 0.6380500781408759
Energy: 0.69297878862644
Energy: 0.6323999184636159
Energy: 1.6249575201189257
Energy: 0.776332116262859
Energy: 1.5828621160049912
Energy: 0.7962204804422426
Energy: 0.7038307733773633
Energy: 1.6013347966687845
Energy: 0.6323947603348258
Energy: 1.6099450969388711
Energy: 1.6368971566196469
Energy: 1.557047180230121
Energy: 1.6149332535670649
Energy: 0.7026934963708084
Energy: 1.5751780815137841
Energy: 0.6949216892096739
Energy: 0.7187385851437351
Energy: 0.7129684488209334
Energy: 0.7678045152654037
Energy: 0.7113859028068494
Energy: 0.6955801198703209
Energy: 0.6968536376153409
Energy: 0.6970581013063827
Energy: 0.7124505552268522
Energy: 0.7252946679911643
Energy: 1.6229156173978376
Energy: 1.6271301389137294
Energy: 1.5809763645100052
Energy: 0.7697440313950666
Energy: 0.7048354584292177
Energy: 0.7150271539375027
Energy: 1.6312445753231857
Energy: 0.7110942452586219
Energy: 0.7656994841063469
Energy: 1.6134547979806793
Energy: 0.7082182466064803
Energy: 0.6319924160749696
Energy: 0.7128033639289804
Energy: 0.7586851645420971
Energy: 0.7002648725363808
Energy: 0.763008746465429
Energy: 0.701234802142548
Energy: 0.6957395485319714
Energy: 1.616924421962735
Energy: 0.7049752987012601
Energy: 0.7153022829491247
Energy: 0.7674591097004174
Energy: 0.6342730856513562
Energy: 0.6321780412006602
Energy: 0.6942034791751716
Energy: 0.6316257501632633
Energy: 0.7196929308208084
Energy: 0.708687430854093
Energy: 0.7688810544642761
Energy: 0.6313492520437896
Energy: 0.6316460093198696
Energy: 0.6943835232016368
Energy: 0.641738843844016
Energy: 1.6817755175221243
Energy: 0.7120563404198342
Energy: 0.7161144708302697
Energy: 0.7610648928811394
Energy: 0.7616637429386364
Energy: 0.6321418855030783
Energy: 2.431182757788725
Energy: 0.7158048570630083
Energy: 0.7631296573857775
Energy: 0.7682583617014489
Energy: 0.7124897444681852
Energy: 0.7011524412681209
Energy: 0.6938176768879007
Energy: 3.277546946759696
Energy: 0.7071696703801594
Energy: 0.7175684221782087
Energy: 0.7786004300737605
Energy: 0.7137574351320279
Energy: 0.6971468583769517
Energy: 0.6979890268934978
Energy: 0.6980352753190179
Energy: 0.70484833021643
Energy: 0.7653586330982118
Energy: 0.7097394060564597
Energy: 0.7692450935156021
Energy: 0.7147294880390022
Energy: 0.7998187602208955
Energy: 0.6956453218871173
Energy: 0.7120102195108858
Energy: 0.7603300286652802
Energy: 0.7145286159503242
Energy: 0.7710245565981401
Energy: 0.7051792347131893
Energy: 0.6963385240486616
Energy: 0.6317776697914035
Energy: 0.7080617622113599
Energy: 1.6476454196185224
Energy: 2.4914998062620795
Energy: 2.4643410399499412
Energy: 0.6326766395029078
Energy: 0.6945089007620522
Energy: 0.6959360458103264
Energy: 0.7158933460959823
Energy: 0.7060110153362901
Energy: 0.7907154984933661
Energy: 0.6329811128568167
Energy: 0.6383960498169231
Energy: 0.6934396760963539
Energy: 0.6321147639083882
Energy: 1.6456098680962148
Energy: 0.7766858440384047
Energy: 1.58225676234143
Energy: 0.7648641972700609
Energy: 0.6525120775723797
Energy: 1.6105126590936567
Energy: 0.632342918495382
Energy: 1.6683701376089817
Energy: 1.6351155631516092
Energy: 0.7048589175002379
Energy: 1.6242143923350576
Energy: 0.7023862821745169
Energy: 1.5743894203147901
Energy: 0.6961353130467802
Energy: 0.7183916777357918
Energy: 0.7134985782461117
Energy: 0.7672378670081481
Energy: 0.7202779774535434
Energy: 0.6958476343374083
Energy: 0.696379159524958
Energy: 0.697058439276224
Energy: 0.7121308036643066
Energy: 1.589336313110263
Energy: 1.627942474066794
Energy: 1.6097172265950057
Energy: 0.7261518272691191
Energy: 0.7682646801303368
Energy: 0.7043946881263634
Energy: 0.7151627512478049
Energy: 1.6189618422223746
Energy: 0.712597478939499
Energy: 0.765462801412276
Energy: 1.6256053116040736
Energy: 0.7075540078222009
Energy: 0.6323907989764244
Energy: 0.7125582558541443
Energy: 0.7582537810563602
Energy: 0.7004775110756297
Energy: 0.7646437883005053
Energy: 0.701207967441838
Energy: 0.6971591747104786
Energy: 1.6064057548506858
Energy: 0.7046216949544489
Energy: 0.7154091427599599
Energy: 0.8065162444185281
Energy: 0.6344035363117353
Energy: 0.6327093191423995
Energy: 0.6943085081433162
Energy: 0.6317934155377976
Energy: 0.7200872581445452
Energy: 0.706058353341356
Energy: 1.705088251664484
Energy: 0.6316964603681268
Energy: 0.6309769705930164
Energy: 0.6941060187533333

minimum gb energy = 0.6309769705930164 eV
minimum distance =  2.48651091086492 Angstroms
sigma value = 21


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

Energy: 0.8316949999675112
Energy: 0.8311392409957024
Energy: 0.6856121169607897
Energy: 1.397874836525427
Energy: 0.6699330675870058
Energy: 0.7429785336338155
Energy: 0.829561851440665
Energy: 0.6924967063304995
Energy: 0.740434247048686
Energy: 1.3503554718322968
Energy: 0.7272470810919448
Energy: 0.6649740782580149
Energy: 1.3425984275310714
Energy: 0.7445708175040198
Energy: 0.6695192052448614
Energy: 0.7464233201797584
Energy: 0.7076432034452436
Energy: 0.7272439160690511
Energy: 0.7368891630004095
Energy: 0.6695846397407476
Energy: 1.2616007845527237
Energy: 0.7628696888233164
Energy: 0.7368200330139083
Energy: 0.7127689293815896
Energy: 1.2847037850993686
Energy: 1.226008198062732
Energy: 0.6762439498979902
Energy: 0.7053683304856898
Energy: 1.1766574971800912
Energy: 0.6478127224230663
Energy: 0.6957816710794922
Energy: 0.6719920287886094
Energy: 1.1806548299485449
Energy: 1.262154226937095
Energy: 0.6924361708466924
Energy: 0.6443768867597313
Energy: 0.6513713806006542
Energy: 0.7031732415064696
Energy: 0.7348540598051241
Energy: 0.6453608614784162
Energy: 0.6693585907711163
Energy: 1.2456144566287126
Energy: 0.803396941060084
Energy: 0.6706468357962825
Energy: 0.6785390836007844
Energy: 1.291500798556699
Energy: 0.6451793585680815
Energy: 0.6477003752058222
Energy: 0.6916962106933121
Energy: 0.6711914984900409
Energy: 0.6779660289723257
Energy: 0.7311989690680236
Energy: 0.7066132664303632
Energy: 0.7074565912754329
Energy: 1.1861071685114661
Energy: 0.6931583280195056
Energy: 0.6772289952178192
Energy: 0.6765696708188501
Energy: 0.6973280738542236
Energy: 0.7334364431396952
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Energy: 1.2844572149294429
Energy: 1.2344622850178437
Energy: 0.8581077666195203
Energy: 0.7958510839851353
Energy: 0.7807489161691539
Energy: 1.2281452993827617
Energy: 0.6725628361544959
Energy: 0.678103364253861
Energy: 0.7598647325520935
Energy: 0.7267891051829853
Energy: 0.6820424970281476
Energy: 1.261276286906559
Energy: 1.8119955375142582
Energy: 1.3561392973615216
Energy: 1.2548717210528615
Energy: 0.7579841828028835
Energy: 0.6773786889599893
Energy: 1.3424900231903238
Energy: 1.3227739827865233
Energy: 0.7638962639574798
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Energy: 1.2849281850191265
Energy: 1.7971440131963712
Energy: 0.8288009694089095
Energy: 1.3795718249255053
Energy: 0.6993703997067949
Energy: 0.8419292211039988
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Energy: 0.6755642590462937
Energy: 0.6456460618819923
Energy: 1.7796616102906064
Energy: 1.495930823583563
Energy: 1.7312756577620037
Energy: 1.793097340928667
Energy: 0.7322920547801733
Energy: 0.7076497160669936
Energy: 1.3651150396903788
Energy: 0.6698295365578971
Energy: 1.2415085528753793
Energy: 0.6931554269543139
Energy: 0.6913700394930538
Energy: 1.3394883913483124
Energy: 1.3232609903712045
Energy: 1.9615782225182723
Energy: 0.7637561062749151
Energy: 0.6743609305440927
Energy: 0.7143290565067903
Energy: 0.7005165207410018
Energy: 0.626685817150931
Energy: 1.2879082692397212
Energy: 0.6888543326462742
Energy: 0.6685080205310507
Energy: 0.696271187357699
Energy: 0.7002742867361
Energy: 1.191598438163208
Energy: 0.6219191499840053
Energy: 0.6807355973135134
Energy: 0.6927912624262692
Energy: 0.6433036329743532
Energy: 1.2346972605427642
Energy: 0.6972361962891748
Energy: 0.7347040048055856
Energy: 0.6881326039311746
Energy: 0.666961929459823
Energy: 1.268912687298425
Energy: 0.6435043166459354
Energy: 0.6876719731840554
Energy: 0.6983897317962068
Energy: 1.2556906778794636
Energy: 0.645497241111375
Energy: 0.6450430293632112
Energy: 0.6850999316988157
Energy: 0.6692103036737983
Energy: 0.6748987305448643
Energy: 0.6891303036664527
Energy: 0.7353697119332359
Energy: 0.6679117145268192
Energy: 0.6656502175752775
Energy: 0.6931035445152942
Energy: 0.6806254008384711
Energy: 1.1996098849943402
Energy: 1.230679152749489
Energy: 0.8029575725410133
Energy: 0.8426328500121835
Energy: 1.3612237027518987
Energy: 1.8140190906748677
Energy: 0.7636166226774825
Energy: 0.7324802967488923
Energy: 0.6915650451011743
Energy: 0.7162380767083901
Energy: 1.1712105774084254
Energy: 0.6804702458610146
Energy: 0.6900227230386041
Energy: 0.7597107293474981
Energy: 0.6519173337175242
Energy: 1.8437940429108988
Energy: 0.8329867242892744
Energy: 1.8932905172646703
Energy: 1.208354281715661
Energy: 0.6666284738438691
Energy: 0.7439473759738614
Energy: 1.7648671736244592
Energy: 0.7029177798089196
Energy: 0.8095566196936292
Energy: 1.3393306174400332
Energy: 1.2833417130634912
Energy: 1.811528942015003
Energy: 1.3221032927384189
Energy: 1.4750811344061707
Energy: 1.9057649992413817
Energy: 1.795384949050596
Energy: 1.2284486134410983
Energy: 1.8861593839165505
Energy: 1.3704846420491095

minimum gb energy = 0.6219191499840053 eV
minimum distance =  0.94367014704996 Angstroms
sigma value = 113


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

Energy: 0.8366173069715667
Energy: 1.4681931526232954
Energy: 1.196032286267307
Energy: 1.1957090149233163
Energy: 1.1172535937435215
Energy: 1.0994212366511367
Energy: 1.4866755045271922
Energy: 0.8739772112308876
Energy: 1.1906616679861552
Energy: 1.7355997838398973
Energy: 1.2793817720074525
Energy: 1.7788465639897988
Energy: 1.7368564813562593
Energy: 1.5647016309339024
Energy: 1.1158030216593453
Energy: 1.4793707537574947
Energy: 0.8351777524596541
Energy: 1.1684239533387912
Energy: 1.1815752889563957
Energy: 0.7442580941949921
Energy: 1.5256794275944683
Energy: 0.8036462000455806
Energy: 0.758800438588764
Energy: 1.096361200828542
Energy: 1.1642938466283757
Energy: 1.1100047989621311
Energy: 0.7899794062181464
Energy: 1.5447973663893872
Energy: 0.6617773424969452
Energy: 0.7941553501502823
Energy: 1.1044667067630594
Energy: 0.772109158941425
Energy: 1.3961341272288534
Energy: 1.0990548695233808
Energy: 0.8539273251329493
Energy: 0.7286478875791813
Energy: 0.7809250807986677
Energy: 0.7444959527501801
Energy: 1.0813444333926552
Energy: 0.7537119560317509
Energy: 0.6899906896178118
Energy: 0.750053395487437
Energy: 1.1236577848702285
Energy: 0.7524624752056303
Energy: 1.1035605022595212
Energy: 0.7038621047741596
Energy: 0.7428757358860297
Energy: 1.059755902710646
Energy: 0.8186381921039712
Energy: 1.0151617793192855
Energy: 0.7516978059820315
Energy: 0.7270019365855827
Energy: 0.7243473886456486
Energy: 0.7745350309931351
Energy: 0.7154302358578651
Energy: 0.7366354671780685
Energy: 0.6583303444158771
Energy: 0.7620136698155094
Energy: 0.7373727186260938
Energy: 1.1240730402838897
Energy: 0.7981440516480104
Energy: 0.7827105425579849
Energy: 0.7971754208661354
Energy: 0.798164787738847
Energy: 0.7655040870691803
Energy: 1.1238167295654955
Energy: 0.7261353095782348
Energy: 0.7277646089239378
Energy: 1.3314078134088703
Energy: 0.7418943370776427
Energy: 0.7274699442737843
Energy: 0.731975143968846
Energy: 1.362855635659137
Energy: 0.7422094845172605
Energy: 0.7333384090143302
Energy: 1.0082719930196988
Energy: 0.7696609789861417
Energy: 1.383146002073218
Energy: 0.7072807852429567
Energy: 0.7647199697657269
Energy: 1.379740001525761
Energy: 1.1159268229759085
Energy: 0.7973237100323514
Energy: 0.7574541827124107
Energy: 0.7355315669031511
Energy: 0.7267965082083673
Energy: 0.7590816708498921
Energy: 1.1131141531929656
Energy: 0.757159172310931
Energy: 0.7466929276529243
Energy: 0.7500127968323267
Energy: 0.7958571444750527
Energy: 0.7605332688046763
Energy: 1.6489234190255702
Energy: 0.7593642840390927
Energy: 0.7300918902062692
Energy: 0.7555608770375492
Energy: 0.7710431951780956
Energy: 0.6895010499221658
Energy: 0.8244476254117044
Energy: 0.7354384997303886
Energy: 1.0405012725850025
Energy: 0.7917322638977277
Energy: 0.7327307856300516
Energy: 0.8413073546493213
Energy: 0.6589618600986141
Energy: 0.799048092641745
Energy: 0.7972814959763299
Energy: 0.7581687208529878
Energy: 0.7708999662692116
Energy: 1.1328056472500123
Energy: 0.7988435164738065
Energy: 0.757094218214502
Energy: 0.7366618787434392
Energy: 0.7113302868532817
Energy: 0.7572059457765129
Energy: 1.0767312615879858
Energy: 1.087975086717211
Energy: 0.7934775053433921
Energy: 0.7391390521457524
Energy: 1.2253634006825989
Energy: 0.7930717088432148
Energy: 1.1056217184886061
Energy: 0.7597121335246574
Energy: 0.6952674082884611
Energy: 1.189959527454691
Energy: 0.8242426983703417
Energy: 0.7945842136719514
Energy: 1.1262963061926135
Energy: 1.7747557197879231
Energy: 1.7149047580442007
Energy: 1.435409138497426
Energy: 1.2333481110902598
Energy: 0.8556185350430665
Energy: 1.2503907818025386
Energy: 1.1258037272490111
Energy: 1.108910121374382
Energy: 1.0961979074523884
Energy: 0.789603976449618
Energy: 1.546755797640307
Energy: 1.3682680299475456
Energy: 1.4740866091248546
Energy: 0.846853544594239
Energy: 1.2771140363594164
Energy: 0.7374410277256948
Energy: 0.751425786074748
Energy: 1.5643545052686925
Energy: 0.8475677222730845
Energy: 1.1966072764917013
Energy: 1.1584235367609947
Energy: 1.3942288556930555
Energy: 0.7600847818359358
Energy: 0.751078617462515
Energy: 1.5501964538896107
Energy: 0.8351536128553797
Energy: 1.8025448529773194
Energy: 1.191965789909627
Energy: 1.1026978592591266
Energy: 1.1184204234974393
Energy: 1.0879278160074595
Energy: 1.4698963480107459
Energy: 1.3841620772061909
Energy: 1.1750490424478195
Energy: 1.4750775369256617
Energy: 1.8441663510884414
Energy: 1.4394878371622495
Energy: 1.5045687484361892
Energy: 1.4675742270165224
Energy: 0.7389887959340927
Energy: 1.1844504899177024
Energy: 0.7843352933783649
Energy: 1.1966319739492237
Energy: 0.8655660647338784
Energy: 0.7414445129828395
Energy: 1.1955441327017131
Energy: 0.8052009051905938
Energy: 0.775887633490208
Energy: 0.7999598733052398
Energy: 1.1367004657010487
Energy: 1.1193977520549792
Energy: 0.8312446429616622
Energy: 1.1044118275634278
Energy: 1.0399687476482888
Energy: 0.799958858658118
Energy: 1.1066580214843333
Energy: 0.7732956795078108
Energy: 0.7510598762569058
Energy: 1.1297551102440184
Energy: 0.8176892342192077
Energy: 0.727536951342306
Energy: 0.8311475968788603
Energy: 0.7449000020256386
Energy: 1.0816204555354563
Energy: 0.7556023139019252
Energy: 0.6901199216421126
Energy: 0.7621039313119485
Energy: 1.1136181312541296
Energy: 0.7703098798514564
Energy: 1.4031480446510616
Energy: 1.1667704857447638
Energy: 0.742065575597804
Energy: 1.0604231132944157
Energy: 0.815357032149581
Energy: 0.7228587334852391
Energy: 0.7239184015740777
Energy: 0.7505041039176911
Energy: 1.1677472116953613
Energy: 1.1540226618615255
Energy: 0.7605133359860383
Energy: 0.7366216440793729
Energy: 0.9847249691006082
Energy: 0.7561755484726556
Energy: 0.735353589642914
Energy: 1.1494892770436294
Energy: 0.7730064642436331
Energy: 0.7633164904656861
Energy: 0.7948036965026062
Energy: 1.108246058561668
Energy: 0.7749976161054868
Energy: 0.6738320336869652
Energy: 0.7349858926944606
Energy: 1.0213301285532883
Energy: 0.666186847201818
Energy: 0.7351975681838675
Energy: 0.7985249715523415
Energy: 0.7297158050815321
Energy: 1.0687016065437365
Energy: 0.7368982841971259
Energy: 0.7194976191760643
Energy: 1.0356873513951002
Energy: 0.767918720373782
Energy: 1.4074181818503357
Energy: 0.7064568079267391
Energy: 0.7632488115849462
Energy: 0.7974317333684394
Energy: 0.8018921202863515
Energy: 0.7969985394608645
Energy: 0.7719527926880356
Energy: 0.7322999678148132
Energy: 0.7253006846822585
Energy: 0.7418354703993808
Energy: 1.4340521256721004
Energy: 0.7681801794328272
Energy: 1.0217101248842768
Energy: 0.7486325521138213
Energy: 0.7957037037688869
Energy: 0.76138490804987
Energy: 1.4258115730708156
Energy: 0.7098722758863729
Energy: 0.6951588218165373
Energy: 1.113006135855361
Energy: 0.7955629641480746
Energy: 0.6894422667410498
Energy: 0.7580026828100063
Energy: 0.7345633844858512
Energy: 0.7266845006291837
Energy: 0.7882900706504697
Energy: 0.7461141254622131
Energy: 0.7061763949660481
Energy: 0.660452222643863
Energy: 0.798839441647738
Energy: 1.3242619567627378
Energy: 1.140907795259434
Energy: 0.7568522738544806
Energy: 0.7277102658417834
Energy: 0.7984244938497432
Energy: 0.7536764115606447
Energy: 0.7782527759274991
Energy: 0.7494110097402875
Energy: 0.7998070740521713
Energy: 1.1093877382144661
Energy: 0.7790183155168695
Energy: 1.4192013354003632
Energy: 0.7401293606957132
Energy: 1.4689301093494458
Energy: 0.7932433974234907
Energy: 1.1006494457603049
Energy: 1.1369142038074305
Energy: 0.6967391503091213
Energy: 1.4941239457331374
Energy: 1.431988890866009
Energy: 1.1487513695538818
Energy: 1.3744933681484963
Energy: 0.7855229655130483
Energy: 1.8792986838047498
Energy: 1.719534272369265
Energy: 0.8594163286807938
Energy: 0.8545708829792321
Energy: 1.508745600567652
Energy: 1.1109755815900866
Energy: 1.1865029005388763
Energy: 1.0971804072017546
Energy: 1.119839508304299
Energy: 1.43937776329523
Energy: 1.3574535281775673
Energy: 1.2168359734815495
Energy: 1.1485156822909408
Energy: 1.5380649663839798
Energy: 1.1755755431366195
Energy: 0.750449181607014
Energy: 1.5699392357194184
Energy: 1.741251779779587
Energy: 1.2327781102761308
Energy: 0.8645367468430585
Energy: 1.2835328202323832
Energy: 0.7183363860414755
Energy: 0.7511607092303997
Energy: 1.561071619428773
Energy: 0.8310562702823499
Energy: 1.5716494745770246
Energy: 1.1954087236080722
Energy: 1.189676497100286
Energy: 1.1232465110280117
Energy: 0.7875534249718434
Energy: 1.4819879403192997

minimum gb energy = 0.6583303444158771 eV
minimum distance =  0.879492361821404 Angstroms
sigma value = 365


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

Energy: 0.7232697841082745
Energy: 0.6947646145971672
Energy: 0.6932099701397597
Energy: 0.696711746589098
Energy: 0.695841329815809
Energy: 0.693060537694689
Energy: 0.7006428135486077
Energy: 0.7179892653063277
Energy: 2.066923758970065
Energy: 2.021328220726516
Energy: 2.037507035812
Energy: 2.0290363127987576
Energy: 2.0242400777771437
Energy: 2.0565252976365875
Energy: 2.049718726932329
Energy: 3.486287627771282
Energy: 0.703339746039803
Energy: 0.6941056990028883
Energy: 0.6955905846405555
Energy: 0.693802394873424
Energy: 0.6949059896401589
Energy: 0.6989943991558968
Energy: 3.5316824022824136
Energy: 0.6927243537890867
Energy: 0.6960357803069217
Energy: 0.6961397304351649
Energy: 0.694351307519249
Energy: 0.6991162583753493
Energy: 0.7164416211193437
Energy: 3.357974432013853
Energy: 0.7212197834931572
Energy: 3.388574400889515
Energy: 2.052142260737726
Energy: 0.7227297593612515
Energy: 3.360016847018065
Energy: 0.700105729617544
Energy: 3.4606940820919245
Energy: 0.6947102588436757
Energy: 0.6970462911378378
Energy: 0.6957739983282811
Energy: 0.6932011296566452
Energy: 0.6996270875499314
Energy: 2.0409157946241603
Energy: 2.087882292257905
Energy: 2.034053016944663
Energy: 2.042044413986376
Energy: 2.0307716346389
Energy: 2.072182963787923
Energy: 2.114368922068327
Energy: 2.0634399207326948
Energy: 2.1213253283518565
Energy: 2.029875967215117
Energy: 0.693197799966622
Energy: 0.69464409823092
Energy: 2.0298238170132237
Energy: 2.2014979848771925
Energy: 0.699396584774275
Energy: 3.447907437983384
Energy: 0.6949880947100965
Energy: 0.696879297356765
Energy: 0.6953310088571804
Energy: 0.6954711874114587
Energy: 0.6986329397596996
Energy: 0.7161355375730152
Energy: 3.4303438718135286
Energy: 0.7204064727738461
Energy: 3.36672472791802
Energy: 3.3421789003936824
Energy: 0.7220167197610575
Energy: 3.36097939364292
Energy: 0.6990883064777996
Energy: 3.52476654925049
Energy: 0.6956004267987577
Energy: 0.6969213223762964
Energy: 0.695155461670122
Energy: 0.695899784529996
Energy: 0.6995008835341168
Energy: 2.022442604668164
Energy: 2.0429465809306553
Energy: 2.0300518389068083
Energy: 0.6941379762152098
Energy: 0.6945601594071555
Energy: 2.0378035291837326
Energy: 2.0400538112763633
Energy: 2.0670439102363307
Energy: 2.068662596339662
Energy: 2.036727929109949
Energy: 2.0401543571829883
Energy: 2.0393683863346976
Energy: 2.0275523085622553
Energy: 2.058520119276012
Energy: 0.7009915832926551
Energy: 3.428589241558984
Energy: 0.6926761082472173
Energy: 0.6966947672330623
Energy: 0.6961308590947515
Energy: 0.6933008303066267
Energy: 0.6954524093519648
Energy: 0.7168057072541851
Energy: 2.0552144359713007
Energy: 0.7217172137467273
Energy: 2.0330031193705445
Energy: 2.0275405450733466
Energy: 2.030366970070165
Energy: 3.348801683180321
Energy: 0.6993272055879421
Energy: 3.442282358514965
Energy: 0.7039726279932403
Energy: 0.6972606498784879
Energy: 0.6947292928533804
Energy: 0.6936269456136426
Energy: 0.700758914365895
Energy: 0.6994694944870589
Energy: 3.4388929766565806
Energy: 0.7041690402633378
Energy: 0.6933148298440954
Energy: 0.6956535097447367
Energy: 0.6940258386316951
Energy: 0.6998108588540892
Energy: 0.7173500254714893
Energy: 2.095605584816515
Energy: 2.058441990344347
Energy: 2.0392009522727763
Energy: 2.0899439289309716
Energy: 2.0219912833846823
Energy: 3.361174411173897
Energy: 0.7021871340070961
Energy: 3.466477410300886
Energy: 0.6928012515976194
Energy: 0.6969431473130423
Energy: 0.6957325266514974
Energy: 0.6931413297771756
Energy: 0.6992382196063397
Energy: 2.017291832304058
Energy: 2.1283751818044743
Energy: 2.1400448827749754
Energy: 2.0357293397039133
Energy: 0.7038127612378802
Energy: 2.023188060292866
Energy: 2.118243698668162

minimum gb energy = 0.6926761082472173 eV
minimum distance =  0.948676971209032 Angstroms
sigma value = 23