host_material
string
host_element_a
string
host_element_b
string
impurity
string
removed_element
string
site_type
string
site
string
is_a_latt
int64
is_interstitial
int64
is_interstitial_a
int64
is_interstitial_b
int64
is_interstitial_n
int64
M_Al
int64
M_As
int64
M_Cd
int64
M_Ga
int64
M_In
int64
M_P
int64
M_S
int64
M_Sb
int64
M_Se
int64
M_Te
int64
M_i_Cd_site
int64
M_i_S_site
int64
M_i_Se_site
int64
M_i_Te_site
int64
M_i_neut_site
int64
charge_from
int64
charge_to
int64
host bandgap_[eV]
float64
host lattice constant_[Ang.]
float64
host_epsilon
float64
ba_shift
float64
mba_pbe
float64
mba_pbe_gapfrac
float64
pbe defect level (relative to VBM)_[eV]
float64
hse defect level (relative to VBM)_[eV]
float64
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.52
5.44
9.8
0.65834
-1.53506
-0.609151
-1.61456
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.52
5.44
9.8
0.65834
-1.16412
-0.461952
-1.28918
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.52
5.44
9.8
0.65834
-0.75936
-0.301333
-0.93412
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.52
5.44
9.8
0.65834
0.9069
0.359881
0.52751
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.52
5.44
9.8
0.65834
1.4365
0.57004
0.99207
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.52
5.44
9.8
0.65834
2.37522
0.942548
1.81551
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.52
5.44
9.8
0.65834
2.77845
1.10256
2.16922
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.52
5.44
9.8
0.65834
3.14925
1.249702
2.49447
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.52
5.44
9.8
0.65834
3.5145
1.394643
2.81492
null
AlP
Al
P
P
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.52
5.44
9.8
0.65834
3.8792
1.539365
3.1348
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.52
5.44
9.8
0.65834
-1.32112
-0.524254
-1.42689
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.52
5.44
9.8
0.65834
-0.9519
-0.377738
-1.10302
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.52
5.44
9.8
0.65834
-0.55196
-0.219032
-0.75219
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.52
5.44
9.8
0.65834
0.65013
0.257988
0.30227
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.52
5.44
9.8
0.65834
1.32151
0.524409
0.8912
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.52
5.44
9.8
0.65834
2.58194
1.024579
1.99684
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.52
5.44
9.8
0.65834
2.97264
1.179619
2.33956
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.52
5.44
9.8
0.65834
3.34574
1.327675
2.66683
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.52
5.44
9.8
0.65834
3.6862
1.462778
2.96549
null
AlP
Al
P
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.52
5.44
9.8
0.65834
4.0492
1.606825
3.2839
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
5
4
2.52
5.44
9.8
0.65834
-1.21468
-0.482016
-1.33353
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
4
3
2.52
5.44
9.8
0.65834
-0.69726
-0.27669
-0.87965
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
3
2
2.52
5.44
9.8
0.65834
-0.27299
-0.108329
-0.50748
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
2
1
2.52
5.44
9.8
0.65834
0.17128
0.067968
-0.11777
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
1
0
2.52
5.44
9.8
0.65834
0.63971
0.253853
0.29313
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
-1
2.52
5.44
9.8
0.65834
2.52953
1.003782
1.95087
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
-1
-2
2.52
5.44
9.8
0.65834
2.86056
1.135143
2.24124
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
-2
-3
2.52
5.44
9.8
0.65834
3.27055
1.297837
2.60091
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
-3
-4
2.52
5.44
9.8
0.65834
3.6998
1.468175
2.97742
null
AlP
Al
P
Bi
P
5
M_P
1
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
-4
-5
2.52
5.44
9.8
0.65834
4.1014
1.62754
3.3297
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.24
5.64
10.06
0.623364
-1.25288
-0.559321
-1.37074
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.24
5.64
10.06
0.623364
-0.72935
-0.325603
-0.91151
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.24
5.64
10.06
0.623364
-0.35063
-0.156531
-0.57929
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.24
5.64
10.06
0.623364
0.2549
0.113795
-0.04813
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.24
5.64
10.06
0.623364
0.6801
0.303616
0.32486
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.24
5.64
10.06
0.623364
1.13345
0.506004
0.72253
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.24
5.64
10.06
0.623364
1.67397
0.747308
1.19667
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.24
5.64
10.06
0.623364
2.95263
1.318138
2.31831
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.24
5.64
10.06
0.623364
3.3228
1.483393
2.64304
null
AlAs
Al
As
Al
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.24
5.64
10.06
0.623364
3.6411
1.625491
2.9222
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.24
5.64
10.06
0.623364
-1.47278
-0.657491
-1.56363
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.24
5.64
10.06
0.623364
-1.06231
-0.474246
-1.20358
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.24
5.64
10.06
0.623364
-0.64831
-0.289424
-0.84041
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.24
5.64
10.06
0.623364
0.2882
0.128661
-0.01892
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.24
5.64
10.06
0.623364
0.89709
0.400487
0.5152
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.24
5.64
10.06
0.623364
2.22759
0.99446
1.6823
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.24
5.64
10.06
0.623364
2.59988
1.160661
2.00888
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.24
5.64
10.06
0.623364
2.95054
1.317205
2.31646
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.24
5.64
10.06
0.623364
3.2794
1.464018
2.60497
null
AlAs
Al
As
As
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.24
5.64
10.06
0.623364
3.6129
1.612902
2.8975
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.24
5.64
10.06
0.623364
-1.36799
-0.61071
-1.47171
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.24
5.64
10.06
0.623364
-0.94923
-0.423763
-1.10438
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.24
5.64
10.06
0.623364
-0.53618
-0.239366
-0.74206
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.24
5.64
10.06
0.623364
0.36614
0.163455
0.04945
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.24
5.64
10.06
0.623364
1.00971
0.450763
0.61399
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.24
5.64
10.06
0.623364
2.32413
1.037558
1.76699
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.24
5.64
10.06
0.623364
2.69552
1.203357
2.09277
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.24
5.64
10.06
0.623364
3.04746
1.360473
2.40152
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.24
5.64
10.06
0.623364
3.3739
1.506205
2.68783
null
AlAs
Al
As
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.24
5.64
10.06
0.623364
3.7075
1.655134
2.9804
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
2.24
5.64
10.06
0.623364
-1.31169
-0.585576
-1.42233
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
2.24
5.64
10.06
0.623364
-0.9317
-0.415938
-1.089
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
2.24
5.64
10.06
0.623364
-0.53513
-0.238897
-0.74114
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
2.24
5.64
10.06
0.623364
-0.06738
-0.03008
-0.33083
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
2.24
5.64
10.06
0.623364
0.35528
0.158607
0.03993
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
2.24
5.64
10.06
0.623364
2.2865
1.020759
1.73398
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
2.24
5.64
10.06
0.623364
2.61263
1.166353
2.02006
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
2.24
5.64
10.06
0.623364
2.96607
1.324138
2.33009
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
2.24
5.64
10.06
0.623364
3.33454
1.488634
2.65327
null
AlAs
Al
As
Bi
As
5
M_As
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
2.24
5.64
10.06
0.623364
3.7295
1.664955
2.99984
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
5
4
1.7
6.12
12.04
0.413757
-1.53292
-0.901718
-1.49933
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
4
3
1.7
6.12
12.04
0.413757
-1.25606
-0.738859
-1.25647
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
3
2
1.7
6.12
12.04
0.413757
-0.93525
-0.550147
-0.97506
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
2
1
1.7
6.12
12.04
0.413757
-0.4731
-0.278294
-0.56967
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
1
0
1.7
6.12
12.04
0.413757
-0.08029
-0.047229
-0.22509
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
-1
1.7
6.12
12.04
0.413757
0.28686
0.168741
0.09697
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
-1
-2
1.7
6.12
12.04
0.413757
0.66211
0.389476
0.42613
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
-2
-3
1.7
6.12
12.04
0.413757
1.96423
1.155429
1.56835
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
-3
-4
1.7
6.12
12.04
0.413757
2.2631
1.331235
1.83051
null
AlSb
Al
Sb
Al
Sb
5
M_Sb
1
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
-4
-5
1.7
6.12
12.04
0.413757
2.48952
1.464424
2.02912
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
1.7
6.12
12.04
0.413757
-1.46689
-0.862876
-1.44141
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
1.7
6.12
12.04
0.413757
-0.92475
-0.543971
-0.96585
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
1.7
6.12
12.04
0.413757
-0.56081
-0.329888
-0.6466
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
1.7
6.12
12.04
0.413757
0.0782
0.046
-0.08607
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
1.7
6.12
12.04
0.413757
0.58358
0.343282
0.35725
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
1.7
6.12
12.04
0.413757
1.55476
0.914565
1.20916
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
1.7
6.12
12.04
0.413757
1.85895
1.0935
1.47599
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
1.7
6.12
12.04
0.413757
2.12658
1.250929
1.71076
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
1.7
6.12
12.04
0.413757
2.40005
1.411794
1.95065
null
AlSb
Al
Sb
Sb
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
1.7
6.12
12.04
0.413757
2.6658
1.568118
2.18378
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
5
4
1.7
6.12
12.04
0.413757
-1.43192
-0.842306
-1.41074
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
4
3
1.7
6.12
12.04
0.413757
-0.86463
-0.508606
-0.91311
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
3
2
1.7
6.12
12.04
0.413757
-0.51256
-0.301506
-0.60428
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2
1
1.7
6.12
12.04
0.413757
-0.13166
-0.077447
-0.27015
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
1.7
6.12
12.04
0.413757
0.39407
0.231806
0.19101
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
1.7
6.12
12.04
0.413757
1.58777
0.933982
1.23812
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-1
-2
1.7
6.12
12.04
0.413757
1.892
1.112941
1.50498
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-2
-3
1.7
6.12
12.04
0.413757
2.16891
1.275829
1.74789
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-3
-4
1.7
6.12
12.04
0.413757
2.43087
1.429924
1.97768
null
AlSb
Al
Sb
Bi
Al
3
M_Al
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
-4
-5
1.7
6.12
12.04
0.413757
2.7358
1.609294
2.24518
null