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-1026513
-7.616789
-11.216481
6.273205
other
Ba1Mg14W1
16
187
383.08
mp-1218262
-4.030924
-5.387922
5.3186
other
Sr1Ga1Si1
3
187
71.65
mp-1226957
-8.532968
-5.892382
2.070846
other
Cd3In1Au12
16
187
290.59
mp-1027974
-7.472429
-10.527787
6.272739
other
La1Mg14Fe1
16
187
382.9
mp-1226629
-8.13703
-3.141119
2.803543
other
Ce1Pt4Rh1
6
187
110.78
mp-1220311
-7.740876
1.020949
5.046793
other
Nd1Er3Fe34
38
187
515.52
mp-1226721
-9.067085
-0.914218
3.296533
other
Ce1Fe1Ni4
6
187
86.2
mp-28614
-8.250547
-2.889423
2.384585
other
Na2B2Pt6
10
191
148.03
mp-10463
-8.631075
0.34835
4.369854
other
Y2Co8B2
12
191
148.87
mp-1223880
-8.986435
-0.309645
4.354629
other
Ho1Co3Ni2
6
191
81.23
mp-1104200
-7.533394
-1.226348
3.885029
other
Tb1Co6Ge6
13
191
177.39
mp-20780
-7.631224
-3.061331
2.694324
other
Tb1Mn6Sn6
13
191
257.41
mp-1077270
-9.178901
-1.434523
4.09904
other
Gd1B2Ir3
6
191
81.21
mp-1206515
-6.354189
-2.123435
5.638253
other
Sm1Si2Ru3
6
191
98.92
mp-1181434
-8.623857
0.454277
4.25289
other
Er3Co11B4
18
191
210.74
mp-1211221
13.878079
6.801994
-0.685187
other
K1Si4O9
14
191
184.28
mp-31163
-5.256365
-3.934183
5.655139
other
Ce4Si6Rh2
12
191
245.98
mp-20338
-7.699917
-3.184384
5.331472
other
Ce1Al3Ni2
6
191
95.88
mp-1104137
-6.138984
-3.530118
3.309031
other
Tb1Nb6Sn6
13
191
279.54
mp-1102597
-8.803851
0.381757
4.38638
other
Sm2Co8B2
12
191
150.91
mp-1216966
-4.552902
0.924326
3.075783
other
Ti1Cr1B4
6
191
48.31
mp-1216756
-9.597485
-1.155758
4.301665
other
Tm2B6Rh9
17
191
227.07
mp-1208395
-8.079126
-2.864267
2.586452
other
Tb3Ni9Sn6
18
191
319.8
mp-1217304
-8.040358
-0.50535
4.745781
other
Th1Mn2Co3
6
191
88.39
mp-1104027
-6.482527
-1.622279
4.888584
other
Y1Cr6Ge6
13
191
188.54
mp-16857
-7.533407
-1.070445
4.175457
other
La3Mn9Ni6
18
191
300.17
mp-1102265
-8.685637
0.35777
4.360013
other
Tb2Co8B2
12
191
147.98
mp-1024990
-9.105052
-1.523851
4.171353
other
Lu1B2Ir3
6
191
79.26
mp-1025136
-8.261686
-4.380604
5.071531
other
Eu1Al3Cu2
6
191
103.53
mp-542953
-9.29152
-3.39067
3.306706
other
Ca3Zn9Ni6
18
191
277.87
mp-4603
-8.785734
0.179181
4.558989
other
Nd3Co13B2
18
191
240.13
mp-530613
-3.555092
1.618384
3.006597
other
Li4Mg23B54
81
191
773.04
mp-1189515
-7.657429
-3.084762
5.161365
other
Lu3Al9Ni6
18
191
273.66
mp-1189717
-8.198198
-4.815051
4.014733
other
Eu3Al9Pd6
18
191
351.4
mp-10056
-8.085594
0.353059
4.09228
other
U1Co3B2
6
191
63.89
mp-1103652
-8.668758
0.325691
4.34952
other
Ho2Co8B2
12
191
147.84
mp-1225214
-7.61773
-5.948869
4.415367
other
Eu1Al3Ag2
6
191
117.74
mp-1217958
-4.903045
0.491068
3.214026
other
Ta1Cr1B4
6
191
50.63
mp-1188184
-9.247739
-1.061066
2.712779
other
Pr3Ni13B2
18
191
241.76
mp-1103130
-7.125191
-3.634657
5.895377
original
Sr1Al9Ni2
12
191
217.25
mp-10065
-6.900029
0.705319
4.027731
other
U1Fe3B2
6
191
62.41
mp-705830
11.252054
11.280317
-2.501827
other
Rb10W36O108
154
191
2,278.23
mp-1190704
-8.608961
0.499947
4.211324
other
Er4Co14B6
24
191
276.21
mp-21906
-5.368078
-3.343389
4.7089
other
U20Si16C3
39
191
727.14
mp-1225217
-7.959797
-6.678053
3.308937
other
Eu1Al2Ag3
6
191
126.76
mp-7099
-8.297355
-0.661658
5.097776
other
Nd1B2Ru3
6
191
81.94
mp-569415
-8.721387
0.448939
4.341215
other
Nd5Co19B6
30
191
376.06
mp-7247
-9.449802
-5.211588
4.209729
other
Ce1Zn3Cu2
6
191
97.24
mp-1196553
-6.48727
-1.029026
3.576816
other
Nb26Co80Si62
168
191
2,006.33
mp-976597
-8.605247
0.488129
4.221123
other
Ho4Co14B6
24
191
277.03
mp-1210782
-8.605144
0.317025
4.335423
other
Lu2Co8B2
12
191
142.96
mp-1103938
-7.377363
-1.699922
2.628644
original
Sc1Fe6Sn6
13
191
223.66
mp-1188278
-9.240572
-0.996488
2.77102
other
Tm3Ni13B2
18
191
229.22
mp-1208292
-8.298374
-4.129781
5.118016
other
Tb1Al3Cu2
6
191
98.48
mp-644529
-8.254922
-1.285838
4.97681
other
Tb3Ga6Co9
18
191
267.77
mp-1104975
-7.352988
-1.745463
2.641026
other
Lu1Fe6Sn6
13
191
226.75
mp-22335
-8.351622
-0.643653
5.120193
other
Gd1B2Ru3
6
191
79.2
mp-1189735
-8.28365
-1.346237
4.952117
other
Er3Ga6Co9
18
191
264.81
mp-1191138
-6.236289
-5.347082
1.286232
other
La6Ga6Bi12
24
191
726.62
mp-1102349
-7.601541
0.807658
5.04909
other
Gd2Fe8B2
12
191
158.48
mp-11593
-9.149956
-1.484835
4.098321
other
Ce1B2Ir3
6
191
81.9
mp-1024968
-8.960526
-1.178726
4.165165
other
Pu1B2Rh3
6
191
79.23
mp-4298
-7.596373
-2.967052
2.663728
other
Tm1Mn6Sn6
13
191
254.62
mp-10115
-9.169747
-1.457189
4.102931
other
Th1B2Ir3
6
191
84.03
mp-1217714
-9.543038
-1.161808
4.234581
other
Tb2B6Rh9
17
191
229.23
mp-1077776
-8.92514
-1.589761
4.110729
other
Sc1B2Ir3
6
191
77.72
mp-11539
-8.417239
-4.615775
4.06756
other
Sm1Al3Pd2
6
191
106.88
mp-1217368
-7.891691
0.301535
5.005877
other
Th1Fe3Co2
6
191
83.66
mp-1206289
-7.752834
-4.522265
3.776927
other
Pu1Al3Pd2
6
191
106.39
mp-1018746
-8.138763
-2.825579
4.410503
other
La1Ge2Ir3
6
191
108.27
mp-1104175
-7.533039
-1.235899
3.867898
other
Ho1Co6Ge6
13
191
176.17
mp-3071
-9.314094
-1.038755
2.733183
other
Nd3Ni13B2
18
191
238.64
mp-5641
-6.802391
-1.125482
4.642
other
Tm1Mn6Ge6
13
191
186.51
mp-1207921
-7.651617
0.522369
4.795134
other
U2Fe8B2
12
191
154.3
mp-1225558
-8.980902
-0.335517
4.34704
other
Er1Co3Ni2
6
191
80.81
mp-571263
-7.519919
-5.985262
3.204355
other
K1In9Co2
12
191
281.67
mp-21127
-9.566353
-1.121088
4.261442
other
Eu1B2Rh3
6
191
80.1
mp-582394
-8.660963
0.535496
4.274049
other
Nd4Co14B6
24
191
289.62
mp-3092
-8.282499
-0.682378
5.106312
other
Dy1B2Ru3
6
191
78.35
mp-605854
-8.606229
0.462486
4.271736
other
Gd3Co11B4
18
191
214.76
mp-16766
-8.274543
-6.704331
3.762382
other
La1Al2Ag3
6
191
124.61
mp-33436
10.990973
11.252806
-2.719341
other
Tl1W6O18
25
191
362.05
mp-1215951
-9.571977
-1.248777
4.344116
other
Yb2B6Rh9
17
191
233.7
mp-8307
-9.235571
-0.752431
2.68817
other
Ca2Ni8B2
12
191
146.36
mp-22505
-8.370099
-4.594022
4.069002
other
Gd1Al3Pd2
6
191
105.8
mp-9441
-6.461019
-1.5473
4.795442
other
Ho1Cr6Ge6
13
191
183.29
mp-5457
-8.64151
0.45118
4.338411
other
Pr3Co11B4
18
191
224.01
mp-10137
-8.092217
-0.807227
4.938888
other
U1B2Ru3
6
191
77.53
mp-20899
-8.156239
-4.410394
3.796211
other
U1Ga3Pd2
6
191
106.2
mp-1191177
-8.635027
0.515537
4.210652
other
Tb4Co14B6
24
191
279.75
mp-1210011
-8.612641
-0.579695
4.834946
other
Nd3Ga3Co12
18
191
265.25
mp-5578
-8.270875
-0.693816
5.139734
other
Lu1B2Ru3
6
191
77.12
mp-1189391
-8.31956
-1.374432
5.003876
other
Nd3Ga6Co9
18
191
275.41
mp-7149
1.955013
2.064436
0.95106
other
Na2Li1N1
4
191
67.49
mp-1222551
-6.903691
-5.870489
4.589479
other
Li3Nd1Ga8
12
191
224.81
mp-1219681
-8.946757
-0.447788
4.262078
other
Pr1Co3Ni2
6
191
86.08
mp-1105082
-6.479007
-1.618463
4.886055
other
Tb1Cr6Ge6
13
191
188.78
mp-29723
-8.323853
-0.672015
5.108025
other
La1B2Ru3
6
191
81.55
mp-13483
-8.226313
-3.150517
2.388271
other
Pr2B2Pt8
12
191
199.36
mp-1208988
-8.049186
-2.90384
2.575403
other
Sm3Ni9Sn6
18
191
326.23