Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.360254209517775
mass=26.981538
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: 0.0126989472601268
Energy: 0.35543456068811485
Energy: 0.6500420819395999
Energy: 0.35493674626004995
Energy: 0.012698947259537444
Energy: 0.35543456068829626
Energy: 0.2966512261266576
Energy: 0.478547695798429
Energy: 0.012953631349494512
Energy: 0.14577144573956768
Energy: 0.013004534175043846
Energy: 0.4785476957988144
Energy: 0.012953631349902527
Energy: 0.1457714457397717
Energy: 0.0126989472601268
Energy: 0.35543456068829626
Energy: 0.6500420819392145
Energy: 0.35493674626004995
Energy: 0.012698947259741451
Energy: 0.35543456068829626
Energy: 0.2966512261266576
Energy: 0.478547695798429
Energy: 0.01295363134969852
Energy: 0.1457714457397717
Energy: 0.013004534174839837
Energy: 0.4785476957986104
Energy: 0.012953631350287877
Energy: 0.14577144573997572
Energy: 0.0126989472601268
Energy: 0.35543456068811485
Energy: 0.2966512261264536
Energy: 0.35493674626004995
Energy: 0.012698947259741451
Energy: 0.35543456068829626
Energy: 0.2966512261264536
Energy: 0.4785476957986104
Energy: 0.01295363134969852
Energy: 0.1457714457397717
Energy: 0.013004534174839837
Energy: 0.4785476957986104
Energy: 0.012953631349902527
Energy: 0.14577144573997572

minimum gb energy = 0.012698947259537444 eV
minimum distance =  2.84040188831271 Angstroms
sigma value = 5


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

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Energy: 0.7380415193524118
Energy: 0.8190488981410463
Energy: 0.7700445900149202
Energy: 0.709471119577824
Energy: 0.7380415193524118
Energy: 0.808566491915614
Energy: 0.6599540876067146
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Energy: 0.6935298055817956
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Energy: 0.7649896593733336
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Energy: 0.8029125236249932
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Energy: 0.8029125236249932
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Energy: 0.6631439006151283
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Energy: 0.7986096313882811
Energy: 0.7283515955789087
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Energy: 0.7390120871688016
Energy: 0.6855789901439275
Energy: 0.7937415170242281
Energy: 0.7047884317895642
Energy: 0.7390120871712386
Energy: 0.6855789901390537
Energy: 0.7937415170266652
Energy: 0.6762719341597685
Energy: 0.6632170269407227
Energy: 0.7938783137641475
Energy: 0.6983793983331339
Energy: 0.6762719341646425
Energy: 0.6632170269431598
Energy: 0.7938783137665846
Energy: 0.6409226330456003
Energy: 0.655611359977849
Energy: 0.8134022546709203
Energy: 0.6674143245580902
Energy: 0.6409226330480373
Energy: 0.655611359975412
Energy: 0.8134022546684833
Energy: 0.6643798001513471
Energy: 0.6792497254341817
Energy: 0.8147851179300016
Energy: 0.7083555297073305
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Energy: 0.6851735478962879
Energy: 0.7326684589096666
Energy: 0.6407384780688886
Energy: 0.6374851833945859
Energy: 0.6851735478962879
Energy: 0.7326684589096666

minimum gb energy = 0.634869173638093 eV
minimum distance =  2.47881788561621 Angstroms
sigma value = 401


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

Energy: 0.716822989637086
Energy: 0.6538065608914522
Energy: 0.7926917452142273
Energy: 0.6706077926887628
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Energy: 0.6885951972022659
Energy: 0.6577110933318409
Energy: 0.7793168788556588
Energy: 0.6548353104584436
Energy: 0.6885951972014611
Energy: 0.6577110933320922
Energy: 0.7793168788548038
Energy: 0.6561937929615773
Energy: 0.684003467635283
Energy: 0.748961009325485
Energy: 0.6415410944549526
Energy: 0.6561937929629856
Energy: 0.6840034676355343
Energy: 0.7498696319637348
Energy: 0.6460044390229489
Energy: 0.752764252972067
Energy: 0.762837919675123
Energy: 0.6909074260350994
Energy: 0.6460044390223959
Energy: 0.7527642529718155
Energy: 0.7086248112222197
Energy: 0.646312567725257
Energy: 0.7256033791961617
Energy: 0.7088805442312789
Energy: 0.6939565555524783
Energy: 0.646312567725257
Energy: 0.7256033791956085
Energy: 0.6846468481547375
Energy: 0.6789313422520018
Energy: 0.6769008864544052
Energy: 0.804483316219964
Energy: 0.6794846837484617
Energy: 0.6789313422520018
Energy: 0.676900886452997
Energy: 0.7647031861013657
Energy: 0.663253260570291
Energy: 0.7012966203938065
Energy: 0.8255152140844803
Energy: 0.6628463458293239
Energy: 0.6632532605688828
Energy: 0.7012966203930018
Energy: 0.8358197819247632
Energy: 0.6967683719743168
Energy: 0.6538065608917539
Energy: 0.8169196867464413
Energy: 0.6706077926882095
Energy: 0.6967683719757252
Energy: 0.6538065608923072
Energy: 0.8218158377607707
Energy: 0.6792472541196238
Energy: 0.6934075429653574
Energy: 0.781768904439513
Energy: 0.6933105700330721
Energy: 0.6792472541204285
Energy: 0.6934075429653574
Energy: 0.7817689044384064

minimum gb energy = 0.6415410944543992 eV
minimum distance =  2.54632515805048 Angstroms
sigma value = 311


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

Energy: 0.7434734444332712
Energy: 0.6819586409565048
Energy: 0.795697859324646
Energy: 0.6837739056830429
Energy: 0.7434734444335906
Energy: 0.6819586409568242
Energy: 0.8529893528175113
Energy: 0.716715813994493
Energy: 0.7282486928737156
Energy: 0.73747110842767
Energy: 0.7199750316607494
Energy: 0.7167158139941736
Energy: 0.7282486928740352
Energy: 0.7374711084279896
Energy: 0.6934176949055936
Energy: 0.7030384271949086
Energy: 0.8013441121706011
Energy: 0.6820270686319179
Energy: 0.6934176949059131
Energy: 0.7030384271945891
Energy: 0.7747470956723679
Energy: 0.6799112148010309
Energy: 0.6819397357005456
Energy: 0.7530074835359074
Energy: 0.6756056370797316
Energy: 0.6799112148010309
Energy: 0.6819397357005456
Energy: 0.7530074835368656
Energy: 0.7047973937172578
Energy: 0.7024449695145188
Energy: 0.8060320041472057
Energy: 0.6861169870820529
Energy: 0.7047973937169383
Energy: 0.7024449695141994
Energy: 0.804140968384551
Energy: 0.6816672499061844
Energy: 0.6844563274570126
Energy: 0.755547414333569
Energy: 0.6741328575909925
Energy: 0.6816672499065038
Energy: 0.6844563274570126
Energy: 0.7555474143326107
Energy: 0.6898543688503824
Energy: 0.744636613387374
Energy: 0.7350820038279939
Energy: 0.7145358016623791
Energy: 0.6898543688503824
Energy: 0.7446366133876934
Energy: 0.7350820038276745
Energy: 0.6730526327895157
Energy: 0.6813175800097269
Energy: 0.8180174211117134
Energy: 0.6724921633016911
Energy: 0.673052632788238
Energy: 0.6813175800103658
Energy: 0.8180174211120327
Energy: 0.6790601333304046
Energy: 0.6691752996977085
Energy: 0.8342967267622928
Energy: 0.6851106702587964
Energy: 0.6790601333304046
Energy: 0.6691752996980279
Energy: 0.8342967267622928
Energy: 0.6929074129897322
Energy: 0.7103069935446885
Energy: 0.7906949628693133
Energy: 0.7554417392405547
Energy: 0.6929074129897322
Energy: 0.710306993545008
Energy: 0.7906949628693133
Energy: 0.6996484265508015
Energy: 0.7057249585794909
Energy: 0.7763666432979929
Energy: 0.6848361245180413
Energy: 0.6996484265511208
Energy: 0.7057249585801296
Energy: 0.7763666432979929
Energy: 0.7071133392823433
Energy: 0.7001108418026208
Energy: 0.7367111774379628
Energy: 0.6959262454624596
Energy: 0.7071133392810658
Energy: 0.7001108418023013
Energy: 0.7367111774376432
Energy: 0.6873237579203896
Energy: 0.6914378005756956
Energy: 0.7383455689042039
Energy: 0.7107197044808757
Energy: 0.687323757920709
Energy: 0.6914378005756956
Energy: 0.7383455689045232
Energy: 0.6687065565450856
Energy: 0.6840739396396031
Energy: 0.8309843724807283
Energy: 0.6739518866034044
Energy: 0.6687065565450856
Energy: 0.6840739396389642
Energy: 0.830984372480409
Energy: 0.6867854174684217
Energy: 0.7141072380704834
Energy: 0.7379478767053071
Energy: 0.6939060295118331
Energy: 0.6867854174684217
Energy: 0.7141072380708028
Energy: 0.7379478767053071
Energy: 0.7040716139742734
Energy: 0.6960619235811302
Energy: 0.7499055143106639
Energy: 0.7018323757361036
Energy: 0.7040716139733151
Energy: 0.6960619235814497
Energy: 0.749905514310025
Energy: 0.7161236141296313
Energy: 0.6803630992344313
Energy: 0.7564620200962918
Energy: 0.6902307130851011
Energy: 0.7161236141302701
Energy: 0.6803630992350411
Energy: 0.7564620200966112
Energy: 0.7080850200122036
Energy: 0.7559469013815799
Energy: 0.7786465277429444
Energy: 0.698490224214476
Energy: 0.708085020012523
Energy: 0.7559469013812604
Energy: 0.778646527742625
Energy: 0.6782469901871027
Energy: 0.7309783712976871
Energy: 0.7908514328247246
Energy: 0.6721436224754057
Energy: 0.6782469901871027
Energy: 0.7309783712976871
Energy: 0.7908514328237664
Energy: 0.6756356326042411
Energy: 0.685903443032279
Energy: 0.8307226856217506
Energy: 0.680363696785862
Energy: 0.6756356326048799
Energy: 0.685903443032279
Energy: 0.8307226856217506
Energy: 0.6856082815271837
Energy: 0.7263577960313352
Energy: 0.7400687374823979
Energy: 0.7448657681869952
Energy: 0.6856082815271837
Energy: 0.7263577960319741
Energy: 0.7400687374820786
Energy: 0.6836605091011064
Energy: 0.68336401927529
Energy: 0.7923838240389663
Energy: 0.6859243944182428
Energy: 0.6836605091004675
Energy: 0.68336401927529
Energy: 0.792383824038647
Energy: 0.7260077896301276
Energy: 0.6860961181120518
Energy: 0.7859893768020746
Energy: 0.7192608061596723
Energy: 0.7260077896298083
Energy: 0.6860961181123711
Energy: 0.7859893768020746
Energy: 0.6812148743280291
Energy: 0.6910263546180669
Energy: 0.7730868762360238
Energy: 0.6953199258651307
Energy: 0.6812148743280291
Energy: 0.6910263546183862
Energy: 0.7730868762350656
Energy: 0.701999743776693
Energy: 0.687569418716188
Energy: 0.8060655450899081
Energy: 0.6857987439260762
Energy: 0.7019997437763738
Energy: 0.6875694187158685
Energy: 0.8060655450895886
Energy: 0.7083618764343321
Energy: 0.7199105476743569
Energy: 0.775863389073144
Energy: 0.7296008686422737
Energy: 0.7083618764343321
Energy: 0.7199105476746763
Energy: 0.775863389073144
Energy: 0.7303259918989357
Energy: 0.6793380869452961
Energy: 0.8683438248125872
Energy: 0.6791865986982016
Energy: 0.7303259918989357
Energy: 0.6793380869449767
Energy: 0.8683438248135456
Energy: 0.7190901131915313
Energy: 0.7214803649818541
Energy: 0.7480023809867749
Energy: 0.7089950833643099
Energy: 0.7190901131912119
Energy: 0.7214803649818541
Energy: 0.7480023809864554
Energy: 0.7076009529961671
Energy: 0.7067386146318071
Energy: 0.8010275381011025
Energy: 0.6869180990549039
Energy: 0.7076009529964866
Energy: 0.7067386146318071
Energy: 0.8010275381007831
Energy: 0.6809522187728048
Energy: 0.6769200282802829
Energy: 0.7472825157822974
Energy: 0.6914177963009602
Energy: 0.6809522187728048
Energy: 0.6769200282799634
Energy: 0.7472825157822974
Energy: 0.7009755498540258
Energy: 0.7027838436574685
Energy: 0.8238475226992715
Energy: 0.6925027131869264
Energy: 0.7009755498543453
Energy: 0.7027838436574685
Energy: 0.8238475226989521
Energy: 0.6735668135987379
Energy: 0.6793596511787013
Energy: 0.7320438736523739
Energy: 0.6889635810746971
Energy: 0.673566813598099
Energy: 0.6793596511790208
Energy: 0.7320438736526933
Energy: 0.6980558059781564
Energy: 0.7353708742344338
Energy: 0.7850868479909474
Energy: 0.7152344998666419
Energy: 0.6980558059784758
Energy: 0.7353708742347533
Energy: 0.7850868479909474
Energy: 0.6746967212503917
Energy: 0.681254231454673
Energy: 0.8191511856761815
Energy: 0.6752201193431724
Energy: 0.6746967212510305
Energy: 0.6812542314537147
Energy: 0.8191511856765008
Energy: 0.6849341642049314
Energy: 0.6663042427442343
Energy: 0.8337225928395596
Energy: 0.6860343569065624
Energy: 0.6849341642052508
Energy: 0.666304242743915
Energy: 0.8337225928401985
Energy: 0.6937273815948002
Energy: 0.7097414223858635
Energy: 0.7810689463608045
Energy: 0.7552932885795409
Energy: 0.6937273815951197
Energy: 0.7097414223852248
Energy: 0.7810689463611239

minimum gb energy = 0.666304242743915 eV
minimum distance =  2.52943316369905 Angstroms
sigma value = 39


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

Energy: 0.7076101049744186
Energy: 0.7274729440554732
Energy: 0.7999998425927023
Energy: 0.7273421754710774
Energy: 0.7076101049732876
Energy: 0.7274729440550962
Energy: 0.7999998425930793
Energy: 0.6914267600255798
Energy: 0.7050659090615974
Energy: 0.7701053412734308
Energy: 0.7057051613099721
Energy: 0.6914267600236949
Energy: 0.7050659090634821
Energy: 0.7701053412741846
Energy: 0.7052016193222717
Energy: 0.6994140700491076
Energy: 0.7152247311294598
Energy: 0.7305546054426375
Energy: 0.7052016193222717
Energy: 0.6994140700479766
Energy: 0.7152247311309677
Energy: 0.6916073542833775
Energy: 0.7308892515104796
Energy: 0.7673052252593734
Energy: 0.7620008493100574
Energy: 0.6916073542841313
Energy: 0.7308892515074638
Energy: 0.7673052252567689
Energy: 0.7371855269856237
Energy: 0.7072635463566616
Energy: 0.7789791167722081
Energy: 0.7316013490474804
Energy: 0.7371855269856237
Energy: 0.7072635463566616
Energy: 0.7789791167703233
Energy: 0.6919540540143985
Energy: 0.7067416547329132
Energy: 0.8325589504119421
Energy: 0.7787294629731203
Energy: 0.6919540540143985
Energy: 0.706741654732536
Energy: 0.8325589504115652
Energy: 0.7656718105341277
Energy: 0.7459064510049762
Energy: 0.7094900137247117
Energy: 0.6874613668440757
Energy: 0.765671810531866
Energy: 0.7459064510072381
Energy: 0.6959082221755412
Energy: 0.6924855101547954
Energy: 0.7159046181310013
Energy: 0.7283019505384318
Energy: 0.7158337547725172
Energy: 0.6924855101525335
Energy: 0.7159046181317554
Energy: 0.728301950538055
Energy: 0.7657068739795792
Energy: 0.6871814884612822
Energy: 0.7774167533230047
Energy: 0.768871089025187
Energy: 0.7657068739769403
Energy: 0.6871814884601513
Energy: 0.7638614362670089
Energy: 0.6919481646059742
Energy: 0.7787158661353349
Energy: 0.8325630747658198
Energy: 0.7068173343484642
Energy: 0.691948164606728
Energy: 0.7787158661368427
Energy: 0.8325630747669508
Energy: 0.7370865872108261
Energy: 0.7317357849319711
Energy: 0.8531463896776222
Energy: 0.7089925780013596
Energy: 0.7370865872093182
Energy: 0.731735784933102
Energy: 0.8258961672224101
Energy: 0.691698403985684
Energy: 0.7620287521755447
Energy: 0.7750197523559058
Energy: 0.7308809798963989
Energy: 0.691698403986438
Energy: 0.7620287521774295
Energy: 0.7750197523562827
Energy: 0.7052449508262671
Energy: 0.7305386756419541
Energy: 0.8437312574132834
Energy: 0.6993902057434472
Energy: 0.7052449508255133
Energy: 0.7305386756393153
Energy: 0.7868147950162937
Energy: 0.6913936714002595
Energy: 0.7055663998930766
Energy: 0.7700690862641306
Energy: 0.7053996783487012
Energy: 0.6913936713983748
Energy: 0.7055663998911917
Energy: 0.7700690862645077
Energy: 0.7076101049747956
Energy: 0.7274729440547194
Energy: 0.7999998425923255
Energy: 0.7273421754710774
Energy: 0.7076101049732876
Energy: 0.7274729440550962
Energy: 0.7999998425927023
Energy: 0.6914267600252026
Energy: 0.7050659090623513
Energy: 0.7701053412730536
Energy: 0.705705161310349
Energy: 0.6914267600240719
Energy: 0.7050659090634821
Energy: 0.7701053412741846
Energy: 0.7052016193218945
Energy: 0.6994140700491076
Energy: 0.7152247311302138
Energy: 0.7305546054430146
Energy: 0.7052016193222717
Energy: 0.6994140700479766
Energy: 0.7152247311302138
Energy: 0.6916073542826234
Energy: 0.7308892515104796
Energy: 0.7673052252582426
Energy: 0.7620008493096805
Energy: 0.6916073542841313
Energy: 0.7308892515078408
Energy: 0.7673052252571458
Energy: 0.7371855269856237
Energy: 0.7072635463570384
Energy: 0.7789791167707002
Energy: 0.7316013490474804
Energy: 0.7371855269856237
Energy: 0.7072635463562844
Energy: 0.7789791167714541
Energy: 0.6919540540143985
Energy: 0.706741654733667
Energy: 0.8325589504123192
Energy: 0.7787294629731203
Energy: 0.6919540540147754
Energy: 0.706741654734421
Energy: 0.8325589504108113
Energy: 0.7656718105341277
Energy: 0.7459064510061071
Energy: 0.6959082221755412
Energy: 0.6874613668440757
Energy: 0.7656718105322429
Energy: 0.74590645100573
Energy: 0.6959082221747871
Energy: 0.6924855101540415
Energy: 0.7159046181310013
Energy: 0.728301950538809
Energy: 0.7158337547725172
Energy: 0.6924855101525335
Energy: 0.7159046181321322
Energy: 0.7283019505384318
Energy: 0.7657068739792021
Energy: 0.6871814884612822
Energy: 0.7638614362677627
Energy: 0.7688710890266949
Energy: 0.7657068739769403
Energy: 0.6871814884612822
Energy: 0.7638614362666317
Energy: 0.6919481646059742
Energy: 0.7787158661345809
Energy: 0.8325630747665738
Energy: 0.706817334349218
Energy: 0.6919481646063512
Energy: 0.7787158661364658
Energy: 0.8325630747665738
Energy: 0.7370865872104492
Energy: 0.7317357849315941
Energy: 0.7956377192477291
Energy: 0.7089925780013596
Energy: 0.7370865872089414
Energy: 0.7317357849327251
Energy: 0.7956377192492369
Energy: 0.691698403985684
Energy: 0.7620287521759217
Energy: 0.7750197523551517
Energy: 0.7308809798975298
Energy: 0.691698403986815
Energy: 0.7620287521766756
Energy: 0.7750197523559058
Energy: 0.7052449508266442
Energy: 0.7305386756419541
Energy: 0.7868147950170477
Energy: 0.699390205743824
Energy: 0.7052449508262671
Energy: 0.7305386756393153
Energy: 0.7868147950166707
Energy: 0.6913936713998826
Energy: 0.7055663998934535
Energy: 0.7700690862641306
Energy: 0.7053996783490782
Energy: 0.6913936713976206
Energy: 0.7055663998911917
Energy: 0.7700690862637538
Energy: 0.7076101049747956
Energy: 0.7274729440543424
Energy: 0.7999998425930793
Energy: 0.7273421754714543
Energy: 0.7076101049732876
Energy: 0.7274729440550962
Energy: 0.7999998425934565
Energy: 0.6914267600255798
Energy: 0.7050659090619742
Energy: 0.7701053412738076
Energy: 0.705705161310349
Energy: 0.6914267600240719
Energy: 0.7050659090631052
Energy: 0.7701053412741846

minimum gb energy = 0.6871814884601513 eV
minimum distance =  2.5373200467894 Angstroms
sigma value = 21


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

Energy: 0.7300177460043936
Energy: 0.7839641242651404
Energy: 0.7975205574623745
Energy: 0.7838421343637182
Energy: 0.7300177460048511
Energy: 0.7839641242651404
Energy: 0.7975205574619167
Energy: 0.7749010816560409
Energy: 0.7264151834084028
Energy: 0.7376737630547484
Energy: 0.7339058069653996
Energy: 0.7749010816560409
Energy: 0.7264151834084028
Energy: 0.7376737630547484
Energy: 0.7329715702425189
Energy: 0.7476405090392679
Energy: 0.7602646499327408
Energy: 0.7337552161652496
Energy: 0.7329715702429557
Energy: 0.7476405090406202
Energy: 0.7602646499331983
Energy: 0.7681491845940499
Energy: 0.7210261311640273
Energy: 0.7597642399318193
Energy: 0.6972757204695645
Energy: 0.7681491845940499
Energy: 0.721026131164485
Energy: 0.7597642399322768
Energy: 0.708728112355185
Energy: 0.7780090515578679
Energy: 0.7277421063610832
Energy: 0.7347045856780081
Energy: 0.7087281123556426
Energy: 0.7780090515587832
Energy: 0.7277421063615407
Energy: 0.7568201502874251
Energy: 0.7208625328438552
Energy: 0.7969048652059794
Energy: 0.7508205508727535
Energy: 0.7568201502878827
Energy: 0.7208625328438552
Energy: 0.7969048652055217
Energy: 0.7523150331318482
Energy: 0.7841171255155702
Energy: 0.7244926160085184
Energy: 0.7226651954311845
Energy: 0.7523150331318482
Energy: 0.7841171255164855
Energy: 0.7244926160094338
Energy: 0.7304960225500957
Energy: 0.7366034271961094
Energy: 0.7336445065029205
Energy: 0.7251684163263405
Energy: 0.7304960225500957
Energy: 0.7366034271970247
Energy: 0.7336445065029205
Energy: 0.7359618089541327
Energy: 0.7201863152065752
Energy: 0.7264385490914569
Energy: 0.7303844668544298
Energy: 0.7359618089541327
Energy: 0.7201863152070328
Energy: 0.7264385490909994
Energy: 0.7490688772434265
Energy: 0.7286665439937158
Energy: 0.7431890624353036
Energy: 0.7131926983869996
Energy: 0.7490688772438842
Energy: 0.7286665439941735
Energy: 0.7431890624353036
Energy: 0.7430207622034769
Energy: 0.7956849315884343
Energy: 0.7788141633037257
Energy: 0.728335728127284
Energy: 0.7430207622039345
Energy: 0.795684931588892
Energy: 0.778814163303268
Energy: 0.6961054821335306
Energy: 0.723138765796526
Energy: 0.7545960346721612
Energy: 0.7414273324213866
Energy: 0.6961054821344459
Energy: 0.7231387657974412
Energy: 0.7545960346721612
Energy: 0.7433941198043168
Energy: 0.7547876668571217
Energy: 0.7801091695644802
Energy: 0.7228524003807659
Energy: 0.743394119802944
Energy: 0.7547876668562064
Energy: 0.7801091695649378
Energy: 0.7504910979374053
Energy: 0.7237108735373403
Energy: 0.8006984720402344
Energy: 0.7413286387480059
Energy: 0.7504910979383207
Energy: 0.7237108735377981
Energy: 0.8006984720397768
Energy: 0.7686300712236237
Energy: 0.7244367113811226
Energy: 0.7864478454496121
Energy: 0.7245866235245639
Energy: 0.7686300712236237
Energy: 0.724436711380665
Energy: 0.7706242130771882
Energy: 0.7115063979145294
Energy: 0.7532332193338573
Energy: 0.7361195231544791
Energy: 0.7417157645615129
Energy: 0.7115063979035671
Energy: 0.753233219332942
Energy: 0.7361195231553944
Energy: 0.7736670899375636
Energy: 0.7418484210292716
Energy: 0.8333901090281318
Energy: 0.7246366946784354
Energy: 0.7736670899366483
Energy: 0.7418484210301869
Energy: 0.833390109027695
Energy: 0.7334998530110172
Energy: 0.7421101679945186
Energy: 0.7238125714743128
Energy: 0.745015097052853
Energy: 0.7334998530114747
Energy: 0.7421101679945186
Energy: 0.7238125714738551
Energy: 0.7372909221631377
Energy: 0.715445922172298
Energy: 0.7844719944139172
Energy: 0.7036840874765338
Energy: 0.7372909221631377
Energy: 0.7154459221741284
Energy: 0.7844719944139172
Energy: 0.7198412435848575
Energy: 0.7282324768032269
Energy: 0.7313388148436215
Energy: 0.7285558143760692
Energy: 0.7198412435843998
Energy: 0.7282324768032269
Energy: 0.7313388148436215
Energy: 0.7372782438100945
Energy: 0.7035624249654773
Energy: 0.7844407475656506
Energy: 0.7136680358667116
Energy: 0.7372782438091794
Energy: 0.703562424964562
Energy: 0.7844407475651931
Energy: 0.7322377793622811
Energy: 0.7449979558425959
Energy: 0.7237807619659842
Energy: 0.7421961269794154
Energy: 0.732237779360929
Energy: 0.7449979558421383
Energy: 0.7237807619659842
Energy: 0.7735135899626827
Energy: 0.7245882214223534
Energy: 0.7816308814523131
Energy: 0.7419096220465875
Energy: 0.773513589963598
Energy: 0.7245882214223534
Energy: 0.7816308814523131
Energy: 0.7330898591902333
Energy: 0.7417987305077502
Energy: 0.735523628961433
Energy: 0.7532121575573111
Energy: 0.7330898591943519
Energy: 0.741798730506835
Energy: 0.7355236289618907
Energy: 0.768607778375563
Energy: 0.7268612728702936
Energy: 0.822130890368354
Energy: 0.7338259492532876
Energy: 0.7686077783760207
Energy: 0.7268612728707512
Energy: 0.822130890368354

minimum gb energy = 0.6961054821335306 eV
minimum distance =  2.49125065849347 Angstroms
sigma value = 113


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

Energy: 0.7756407062705696
Energy: 0.7599607383445074
Energy: 0.7646085259107569
Energy: 0.758456950610998
Energy: 0.7756407062700588
Energy: 0.7599607383450182
Energy: 0.7646085259114999
Energy: 0.7679384628004025
Energy: 0.748133430161126
Energy: 0.747632081780137
Energy: 0.7837421456510166
Energy: 0.7679384627991023
Energy: 0.748133430161869
Energy: 0.7476320817811586
Energy: 0.7733209173372082
Energy: 0.7419186931069623
Energy: 0.7608917589062912
Energy: 0.739150584139759
Energy: 0.7733209173379512
Energy: 0.7419186931079841
Energy: 0.760891758906802
Energy: 0.7277359479996477
Energy: 0.7534944298883919
Energy: 0.7867197040461633
Energy: 0.7659313877699292
Energy: 0.7277359479973723
Energy: 0.7534944298889025
Energy: 0.7867197040471848
Energy: 0.7626276190265728
Energy: 0.6906309452647578
Energy: 0.717370099101678
Energy: 0.7307750647162484
Energy: 0.7626276190293592
Energy: 0.6906309452662903
Energy: 0.7173700991034427
Energy: 0.7118243723354037
Energy: 0.7443437469342999
Energy: 0.7860445272678758
Energy: 0.7303517930901993
Energy: 0.7118243723356825
Energy: 0.7443437469312351
Energy: 0.7860445272670864
Energy: 0.7523374486089509
Energy: 0.6961687710780092
Energy: 0.7498641928121106
Energy: 0.7236023026708407
Energy: 0.7523374486099725
Energy: 0.6961687710767092
Energy: 0.7498641928134108
Energy: 0.7156289299511979
Energy: 0.7348954252290367
Energy: 0.7608679557620651
Energy: 0.738404468883856
Energy: 0.7156289299498976
Energy: 0.734895425230337
Energy: 0.7608679557628546
Energy: 0.7352415928410676
Energy: 0.7115505036485025
Energy: 0.7724025422016382
Energy: 0.712562093612844
Energy: 0.7352415928407889
Energy: 0.7115505036479918
Energy: 0.772402542199595
Energy: 0.7236039344423769
Energy: 0.7216441337338884
Energy: 0.7575919104487803
Energy: 0.7428591275277188
Energy: 0.7236039344439094
Energy: 0.7216441337323558
Energy: 0.757591910446737
Energy: 0.7439719587273191
Energy: 0.729487615796057
Energy: 0.8086085650957806
Energy: 0.7255603862580637
Energy: 0.7439719587230005
Energy: 0.7294876157940139
Energy: 0.8086085650952699
Energy: 0.7337717920886228
Energy: 0.7296217130630025
Energy: 0.7954899353049776
Energy: 0.7438858548535996
Energy: 0.733771792087601
Energy: 0.7296217130612378
Energy: 0.79548993530651
Energy: 0.7509363083853172
Energy: 0.7327476127442109
Energy: 0.7978605687562095
Energy: 0.7309433168623782
Energy: 0.7509363083855494
Energy: 0.7327476127454646
Energy: 0.776081484960867
Energy: 0.7553659901903825
Energy: 0.7669081201536558
Energy: 0.8289135986576598
Energy: 0.7532784397813594
Energy: 0.755365990191172
Energy: 0.7669081201521234
Energy: 0.8289135986581707
Energy: 0.7421065692574166
Energy: 0.7423018919671
Energy: 0.7972253298301963
Energy: 0.7678586041552957
Energy: 0.7421065692566735
Energy: 0.7423018919668678
Energy: 0.8147843656292351
Energy: 0.7535815241489231
Energy: 0.7311698466238937
Energy: 0.7984228006925518
Energy: 0.753901114988674
Energy: 0.7535815241481801
Energy: 0.7311698466200859
Energy: 0.7984228006923195
Energy: 0.7509942820203667
Energy: 0.7279394061939933
Energy: 0.828771134729509
Energy: 0.7252442744429356
Energy: 0.7509942820231994
Energy: 0.7279394061932504
Energy: 0.8287711347289982
Energy: 0.7266768285462448
Energy: 0.7048082382311879
Energy: 0.796882502615424
Energy: 0.7250678667942675
Energy: 0.7266768285467556
Energy: 0.7048082382319308
Energy: 0.7968825026123592
Energy: 0.7531226796378683
Energy: 0.7350464579744281
Energy: 0.8069653795034609
Energy: 0.7472117577898884
Energy: 0.7531226796381468
Energy: 0.7350464579749388
Energy: 0.8165600577114943
Energy: 0.7251984396162731
Energy: 0.7218342229925935
Energy: 0.7854539413127078
Energy: 0.7237184380791353
Energy: 0.7251984396162731
Energy: 0.7218342229931043
Energy: 0.7854539413137296
Energy: 0.7376742100671886
Energy: 0.7073903352205517
Energy: 0.7635635148178954
Energy: 0.749596934619334
Energy: 0.7376742100676995
Energy: 0.7073903352223627
Energy: 0.7820485628756877
Energy: 0.7279524126414533
Energy: 0.7357897527261237
Energy: 0.7533803651134732
Energy: 0.7186473026202603
Energy: 0.7279524126399207
Energy: 0.7357897527271453
Energy: 0.753380365115795
Energy: 0.7332301091983756
Energy: 0.6992306134924966
Energy: 0.8039577343939651
Energy: 0.7562489091913428
Energy: 0.7332301091996758
Energy: 0.6992306134943076
Energy: 0.8039577343934542
Energy: 0.7384318362064712
Energy: 0.7266571810095307
Energy: 0.7749230553222711
Energy: 0.7328986646241132
Energy: 0.7384318362074929
Energy: 0.7266571810095307
Energy: 0.7749230553217603
Energy: 0.7418817463407301
Energy: 0.7392860168161661
Energy: 0.7638056257660351
Energy: 0.7787360141903226
Energy: 0.7418817463414731
Energy: 0.7392860168163984
Energy: 0.7638056257652921
Energy: 0.7249039731408335
Energy: 0.7684435069450696
Energy: 0.788787355484254
Energy: 0.7434084838149738
Energy: 0.7249039731418552
Energy: 0.7684435069453016
Energy: 0.7887873554873189
Energy: 0.7866653696501186
Energy: 0.737935934703977
Energy: 0.7739783700180157
Energy: 0.7918263357635371
Energy: 0.7866653696501186
Energy: 0.7379359347036984
Energy: 0.7739783700164835
Energy: 0.7357009814018577
Energy: 0.7718726584859652
Energy: 0.7801262799395646
Energy: 0.7739436126962292
Energy: 0.7357009814054334
Energy: 0.7718726584867083
Energy: 0.7801262799382644
Energy: 0.7798513936083581
Energy: 0.737581506896713
Energy: 0.7490885910854521
Energy: 0.7980561488510178
Energy: 0.7798513936091477
Energy: 0.7375815068949484
Energy: 0.7490885910861952
Energy: 0.7211643249690453
Energy: 0.7574967008878453
Energy: 0.7716093338829562
Energy: 0.736936047612576
Energy: 0.7211643249690453
Energy: 0.7574967008863129
Energy: 0.7716093338814236
Energy: 0.7399781456419238
Energy: 0.738606572306271
Energy: 0.7600894934559759
Energy: 0.766261352726745
Energy: 0.739978145643224
Energy: 0.7386065723075713
Energy: 0.7600894934559759
Energy: 0.7238208793978608
Energy: 0.7017381870079686
Energy: 0.7251535824118623
Energy: 0.7266212521096173
Energy: 0.7238208793953068
Energy: 0.701738187006715
Energy: 0.7251535824111194
Energy: 0.7180966516398716
Energy: 0.7220280941361122
Energy: 0.7712605445054317
Energy: 0.7419655826191203
Energy: 0.71809665163885
Energy: 0.7220280941386662
Energy: 0.7712605445069176
Energy: 0.725897399899323
Energy: 0.7022835530317679
Energy: 0.7357631414205591
Energy: 0.7160873134065607
Energy: 0.7258973999013663
Energy: 0.7022835530338111
Energy: 0.7357631414200482
Energy: 0.7090285739880078
Energy: 0.7013067476351902
Energy: 0.755808122971942
Energy: 0.7388889550156451
Energy: 0.7090285739859646
Energy: 0.7013067476359331
Energy: 0.7558081229729634
Energy: 0.7215758224542541
Energy: 0.7090268351586638
Energy: 0.7180325565172287
Energy: 0.7048692860799672
Energy: 0.7215758224542541
Energy: 0.7090268351589426
Energy: 0.7180325565133745
Energy: 0.712240312131417
Energy: 0.7136273529675148
Energy: 0.7501757573361109
Energy: 0.7343987181161429
Energy: 0.7122403121326707
Energy: 0.713627352966493
Energy: 0.750175757333789
Energy: 0.7245796923539767
Energy: 0.7312965105169326
Energy: 0.7565165863720366
Energy: 0.7160448634076759
Energy: 0.7245796923539767
Energy: 0.7312965105184651
Energy: 0.7565165863689717
Energy: 0.7249572225195492
Energy: 0.7243670606620977
Energy: 0.8382869131023073
Energy: 0.7274127691280551
Energy: 0.7249572225188062
Energy: 0.7243670606644195
Energy: 0.838286913101518
Energy: 0.7263675214543962
Energy: 0.7562404008359556
Energy: 0.7426709281134947
Energy: 0.725092122331563
Energy: 0.7263675214546749
Energy: 0.756240400834191
Energy: 0.7426709281112193
Energy: 0.7665001033264797
Energy: 0.7245416078243876
Energy: 0.8331061941246908
Energy: 0.7411622933299402
Energy: 0.7665001033256901
Energy: 0.7245416078241088
Energy: 0.8331061941224153
Energy: 0.7263785228831328
Energy: 0.7123593363419146
Energy: 0.8057448828311973
Energy: 0.7431019809835046
Energy: 0.726378522882622
Energy: 0.7123593363411254
Energy: 0.8057448828314295
Energy: 0.7669581391677474
Energy: 0.724708993826009
Energy: 0.7951688616022745
Energy: 0.7400598340121752
Energy: 0.7669581391675151
Energy: 0.7247089938237334
Energy: 0.7951688616022745
Energy: 0.7288389650455354
Energy: 0.7279797220648232
Energy: 0.8233858953187079
Energy: 0.7231683441210318
Energy: 0.7288389650470677
Energy: 0.7279797220614798
Energy: 0.8233858953184756
Energy: 0.7316494947318131
Energy: 0.7200857942488784
Energy: 0.7904640701933533
Energy: 0.7255222225505975
Energy: 0.7316494947323239
Energy: 0.7200857942499
Energy: 0.7904640701951643

minimum gb energy = 0.6906309452647578 eV
minimum distance =  2.49164196949968 Angstroms
sigma value = 365


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

Energy: 0.7214303878358039
Energy: 0.5895087816271191
Energy: 0.7305355456758977
Energy: 0.5895087816271191
Energy: 0.7214303878369556
Energy: 0.5895087816271191
Energy: 0.5564860014506985
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.541552198715843
Energy: 0.5895087816271191
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5796695092474788
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.6155659211042044
Energy: 0.5895087816265432
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564860512302535
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.6983692710636168
Energy: 0.5895087816265432
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5564851600082666
Energy: 0.7214303878363797
Energy: 0.5895087816259673
Energy: 0.6047194244888542
Energy: 0.5895087816276949
Energy: 0.7214303878358039
Energy: 0.5895087816271191
Energy: 0.5564850131808446
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5415521986911083
Energy: 0.5895087816276949
Energy: 0.7214303878369556
Energy: 0.5895087816265432
Energy: 0.5564860296690515
Energy: 0.7214303878363797
Energy: 0.5895087816259673
Energy: 0.5564858933764536
Energy: 0.5895087816259673
Energy: 0.7214303878358039
Energy: 0.5895087816265432
Energy: 0.5564860590558522
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5747982745504547
Energy: 0.5895087816276949
Energy: 0.7214303878358039
Energy: 0.5895087816259673
Energy: 0.5564842945094869
Energy: 0.7214303878358039
Energy: 0.5895087816271191
Energy: 0.5812553944652582
Energy: 0.5895087816276949
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5564835607942284
Energy: 0.7214303878352281
Energy: 0.5895087816265432
Energy: 0.5564859145278443
Energy: 0.5895087816276949
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564860194893605
Energy: 0.7214303878363797
Energy: 0.5895087816276949
Energy: 0.5796695104141992
Energy: 0.5895087816271191
Energy: 0.7214303878369556
Energy: 0.5895087816265432
Energy: 0.5564860453605048
Energy: 0.7214303878369556
Energy: 0.5895087816271191
Energy: 0.5564859521983729
Energy: 0.5895087816271191
Energy: 0.7214303878358039
Energy: 0.5895087816265432
Energy: 0.5564860600193552
Energy: 0.7214303878369556
Energy: 0.5895087816276949
Energy: 0.5564833782728317
Energy: 0.5895087816259673
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564850906428856
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564670207921066
Energy: 0.5895087816265432
Energy: 0.7214303878346523
Energy: 0.5895087816271191
Energy: 0.5564673327883972
Energy: 0.7214303878369556
Energy: 0.5895087816271191
Energy: 0.5564856905060138
Energy: 0.5895087816259673
Energy: 0.7214303878369556
Energy: 0.5895087816265432
Energy: 0.5564860360516598
Energy: 0.7214303878358039
Energy: 0.5895087816271191
Energy: 0.5564804277779017
Energy: 0.5895087816271191
Energy: 0.7214303878358039
Energy: 0.5895087816265432
Energy: 0.5564841321535205
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5564859624315904
Energy: 0.5895087816276949
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5564821890555393
Energy: 0.7214303878358039
Energy: 0.5895087816265432
Energy: 0.5564829124558379
Energy: 0.5895087816271191
Energy: 0.7214303878363797
Energy: 0.5895087816259673
Energy: 0.556484899408921
Energy: 0.7214303878363797
Energy: 0.5895087816265432
Energy: 0.5564652178764892
Energy: 0.5895087816265432
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564649256156896
Energy: 0.7214303878363797
Energy: 0.5895087816271191
Energy: 0.5564647328501084
Energy: 0.5895087816265432
Energy: 0.7214303878369556
Energy: 0.5895087816271191
Energy: 0.5564722334810668

minimum gb energy = 0.5415521986911083 eV
minimum distance =  2.6363129643217 Angstroms
sigma value = 23