mp_ID
stringlengths
4
10
x
float64
-10.28
17.7
y
float64
-12.01
23.9
z
float64
-8.99
7.96
type
stringclasses
2 values
formula
stringlengths
2
26
n_atoms
int64
1
444
spacegroup
int64
1
230
volume
float64
5.61
20.1k
mp-961721
-6.516247
-4.363306
1.472147
other
Hf1Bi1Rh1
3
216
72.02
mp-1100391
-4.915322
-5.752509
0.598847
other
Na1Be1Sb1
3
216
60.71
mp-1008858
-6.56776
-5.015287
0.896292
other
Nd1Bi1Pd1
3
216
79.56
mp-631570
-4.79932
-6.623068
4.332285
other
Ba1Ta1B1
3
216
64.88
mp-1224188
-7.292962
-0.045683
5.159847
other
Hf1Zr1Fe4
6
216
87.83
mp-1224554
-6.719033
-3.797819
5.682957
other
Gd1U1Al4
6
216
120.26
mp-1009593
-6.404856
-1.892044
-0.77004
other
Cr1Co1Te1
3
216
50.88
mp-672679
-8.33788
-6.46912
6.458067
other
Y16In4Ir4
24
216
642.63
mp-1224416
-7.088538
-4.647226
6.491924
other
Gd1Y1Al4
6
216
121.72
mp-21272
-6.250641
-3.667488
0.867817
other
Er1Ni1Sb1
3
216
61.57
mp-1218968
-6.325561
-4.432443
1.112909
other
Sm1Sb1Pt1
3
216
84.04
mp-961709
-7.269845
-4.706679
3.241668
other
Zr1Pt1Pb1
3
216
74.84
mp-1100418
-7.195387
-7.16118
4.360213
other
Sc1Tl1Cd1
3
216
81.4
mp-1008807
8.48468
8.987573
-0.086562
other
Rb1Cu1O1
3
216
57.27
mp-961664
-8.146482
-4.680964
2.472148
other
V1Sn1Pd1
3
216
58.36
mp-1077347
-8.028139
-3.268751
2.603209
other
U1Pt4Au1
6
216
107.3
mp-631515
-5.737064
-6.892463
4.49902
other
Ca1Hf1Zn1
3
216
79.43
mp-12094
-6.291159
-6.665499
2.929891
other
Li2Sn1Ge1
4
216
81.78
mp-961660
-4.921739
-1.423165
-2.351392
other
Ti1Fe1Se1
3
216
44.36
mp-961720
-6.392919
-3.09749
1.99257
other
Zr1As1Rh1
3
216
62
mp-1203071
-7.716912
-2.579331
5.029521
other
Yb6Co8Ge26
40
223
685.14
mp-1214614
-5.840299
-5.565778
3.467671
other
Ba8Ga6Ge40
54
223
1,348.71
mp-1201940
-7.754477
-3.211412
4.74578
other
Tm6Ge26Rh8
40
223
723.38
mp-1202999
-4.886639
-3.501433
6.233732
other
Lu6Si26Os8
40
223
672.29
mp-1202962
-5.151288
-3.448776
6.040466
other
Lu6Si26Ir8
40
223
659.48
mp-1197955
-7.785219
-2.541517
5.195996
other
Gd6Ge26Ru8
40
223
734.82
mp-1214105
-6.725485
-6.053357
2.808981
other
Ce6Rh8Pb26
40
223
1,063.31
mp-1214812
-6.255352
-6.98879
2.745816
other
Cs6Na52In96
154
223
4,516.19
mp-1203111
-7.806527
-2.858599
4.920918
other
Dy6Ge26Ir8
40
223
744.69
mp-756374
7.898602
10.91664
-0.753391
other
Sr2Pt6O8
16
223
203.58
mp-7561
7.953213
10.70485
-0.703298
other
Sr2Pd6O8
16
223
200.17
mp-1201402
-5.172494
-3.445299
6.002562
other
Er6Si26Ir8
40
223
668.82
mp-1201411
-7.700955
-4.312845
3.073975
other
Sm8Sn24Ru8
40
223
916.98
mp-680553
-7.638361
-4.546656
3.023681
other
Sm6Sn26Rh8
40
223
919.48
mp-1201825
-7.682286
-4.31496
3.073523
other
Pr6Sn26Ir8
40
223
938.35
mp-4363
-7.594422
-4.467924
2.92545
other
Ca6Sn26Rh8
40
223
929.63
mp-1210342
-8.075501
-5.483065
4.451267
other
Th6In26Ni8
40
223
900.71
mp-672373
-7.545476
-4.772942
3.009872
other
La6Co8Sn26
40
223
896.48
mp-1200449
-7.660028
-4.414629
3.148014
other
Ce6Sn26Ir8
40
223
944.32
mp-1198863
-0.473356
1.316761
-5.128356
other
Hg96S64Cl64
224
223
6,306.97
mp-1196873
-7.647929
-2.805655
5.23267
other
Er6Co8Ge26
40
223
673.08
mp-1207598
-4.046288
-1.237207
-4.597177
other
Y2Pd6S8
16
223
297.04
mp-570662
-5.89754
-5.457491
3.575749
other
Ba8Ag6Ge40
54
223
1,338.27
mp-1209783
-8.084088
-5.090874
3.951445
other
Sm8In24Pt8
40
223
948.48
mp-1214141
-7.530375
-5.131452
2.664166
other
Ca6Sn26Pt8
40
223
982.36
mp-30516
-7.678651
-4.563097
3.092175
other
Th6Sn26Rh8
40
223
926.8
mp-1201052
-6.206701
-5.193991
3.690165
other
Ba8Ge40Pt6
54
223
1,293.53
mp-1196347
-7.85854
-2.467997
5.260211
other
Nd6Ge26Ru8
40
223
767.97
mp-1201653
-7.740594
-2.921166
4.836093
other
Sm6Ge26Ir8
40
223
755.49
mp-1198260
-7.676966
-3.078989
4.808917
other
Ce6Ge26Ir8
40
223
750.61
mp-1198511
-7.666629
-2.79719
5.20887
other
Tb6Co8Ge26
40
223
677.22
mp-558154
7.292126
9.431133
-1.7995
other
Ag6P2O8
16
223
219.55
mp-1201823
-7.719059
-2.935777
4.883568
other
Pr6Ge26Ir8
40
223
768.67
mp-18228
-4.116229
-4.917203
5.677916
other
Ba6Na2Si46
54
223
1,101.5
mp-1200470
-7.408183
-5.072693
2.837605
other
Ca6Co8Sn26
40
223
895.62
mp-1201179
-7.60776
-3.270612
4.57885
other
Ca6Ge26Rh8
40
223
743.22
mp-1202531
-6.030812
-5.555423
3.421332
other
Na8Ga16Ge30
54
223
1,279.9
mp-683897
-7.654227
-4.558907
3.057594
other
Pr6Sn26Rh8
40
223
935.45
mp-1197860
-7.683962
-4.308044
3.075978
other
Nd6Sn26Ir8
40
223
932.54
mp-1203006
-7.792691
-2.365186
5.232845
other
Lu6Ge26Ru8
40
223
724.14
mp-1203775
-7.792951
-2.91609
4.839258
other
Er6Ge26Ir8
40
223
737.05
mp-1202484
-7.726665
-3.259351
4.772857
other
Ho6Ge26Rh8
40
223
739.3
mp-1213850
7.854636
10.842711
-0.738926
other
Cd2Pt6O8
16
223
202.76
mp-1198476
-7.644407
-4.520854
3.292083
other
Ce8Sn24Ru8
40
223
947.06
mp-13675
7.952091
10.71662
-0.654535
other
Cd2Pd6O8
16
223
191.59
mp-1208301
-7.584416
-4.601457
3.166045
other
Th6Sn26Os8
40
223
947.76
mp-1204515
-7.738489
-3.226198
4.751464
other
Er6Ge26Rh8
40
223
735.41
mp-1202418
-5.088722
-3.436753
6.091297
other
Ho6Si26Os8
40
223
680.23
mp-30513
-7.676821
-4.555017
3.096933
other
La6Sn26Rh8
40
223
929.53
mp-1200412
-7.816813
-2.934682
4.921721
other
Y6Ge26Ir8
40
223
738.13
mp-1200211
-7.602691
-4.365622
2.96928
other
Ca6Sn26Ir8
40
223
933.45
mp-1202996
-7.728642
-3.343383
4.799887
other
Nd6Ge26Rh8
40
223
758.18
mp-1214552
-4.132586
-4.931062
5.673953
other
Ba8Cu6Si40
54
223
1,106.67
mp-1200023
-7.840488
-2.410329
5.195217
other
Sm6Ge26Ru8
40
223
753.39
mp-15227
-3.940176
-1.316098
-4.555501
other
Nd2Pd6S8
16
223
305.22
mp-21915
-7.530928
-4.89613
3.08687
other
Ce6Co8Sn26
40
223
887.02
mp-1209813
-7.639575
-4.295559
2.92126
other
Sm6Sn26Ru8
40
223
925.51
mp-1196900
-7.521625
-4.671972
2.953789
other
Sm6Co8Sn26
40
223
869.16
mp-1189243
-4.076736
-1.331807
-4.441509
other
Er2Pd6S8
16
223
294.35
mp-1197480
-7.705553
-4.369101
3.112782
other
La6Sn26Ir8
40
223
947.71
mp-1197897
-7.733806
-2.925524
4.804784
other
Gd6Ge26Ir8
40
223
747.78
mp-1203831
-7.754199
-3.07703
4.644165
other
Yb6Ge26Rh8
40
223
735.67
mp-1200060
-7.800346
-2.892825
4.853576
other
Tm6Ge26Ir8
40
223
735.72
mp-1204494
-7.700924
-3.341518
4.754787
other
Sm6Ge26Rh8
40
223
749.91
mp-1202780
-7.680381
-2.988144
4.62283
other
Ca6Ge26Ir8
40
223
741.29
mp-1196944
-7.762342
-2.992991
4.876381
other
Nd6Ge26Ir8
40
223
760.23
mp-1196992
-7.695524
-4.380687
3.030565
other
La6Sn26Ru8
40
223
951.75
mp-30169
-5.989172
-5.364896
3.761288
other
Ba8Ni6Ge40
54
223
1,243.42
mp-3046
-7.676396
-4.513423
2.995303
other
Yb6Sn26Rh8
40
223
939.5
mp-1197092
-7.652922
-2.734645
5.25429
other
Dy6Co8Ge26
40
223
676.2
mp-1211693
-7.583179
-4.629457
2.973534
other
Th6Sn26Ru8
40
223
1,038.07
mp-680552
-7.657127
-4.561451
3.049221
other
Nd6Sn26Rh8
40
223
929.08
mp-1200686
-7.558907
-2.659517
5.114118
other
Tb6Ge26Os8
40
223
736.25
mp-1203141
-7.480094
-2.508767
5.181994
other
Lu6Ge26Os8
40
223
733.01
mp-17815
-4.088871
-5.020496
5.639029
other
Ba8Si40Au6
54
223
1,161.69
mp-1147653
7.716965
10.533313
-0.516225
other
Ca2Cu6O8
16
223
170.2
mp-669542
-5.969737
-5.484705
3.604003
other
Ba8Cu6Ge40
54
223
1,266.5
mp-1197864
-7.759171
-2.849506
4.876583
other
Lu6Ge26Ir8
40
223
731.3
mp-1202465
-7.502088
-2.533358
5.219414
other
Gd6Ge26Os8
40
223
748.99
mp-1200080
-6.796279
-6.150892
2.750821
other
Pr6Rh8Pb26
40
223
1,027.89