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-1183827
-6.109188
-6.173704
6.041819
other
Ce3Hf1
4
139
103.34
mp-1186736
-7.366414
-6.834583
7.124977
other
Pr3Zn1
4
139
119.97
mp-1184016
-4.078833
-6.915201
1.520904
other
Cs1Rb3
4
139
406.47
mp-1183721
-8.157384
-6.490713
2.247356
other
Cr1Ag3
4
139
70.75
mp-1185795
-8.027696
-9.652626
5.905956
other
Mg3Ru1
4
139
70.2
mp-1094185
-7.813721
-9.632109
6.823873
other
Hf1Mg3
4
139
88.91
mp-1186488
-7.159272
-7.328594
6.977095
other
Pm3Ag1
4
139
117.36
mp-1186202
-6.932315
-6.874456
6.995333
other
Na1Y3
4
139
130.58
mp-1184671
-6.314353
-2.024266
3.902724
other
Ge3Mo1
4
139
67.54
mp-1186883
-3.875034
-7.078952
2.092768
other
Rb3Y1
4
139
265.2
mp-1184633
-5.758354
-3.814003
3.727875
other
Hf3Sn1
4
139
86.68
mp-1183335
-4.837485
-7.521371
3.490354
other
Ba1Sr3
4
139
237.59
mp-1205346
-3.789989
-4.98601
5.853209
other
Ca4Si12
16
139
298.88
mp-1186827
-5.59019
-4.680975
3.470292
other
Pu3Zr1
4
139
95.02
mp-974613
-3.677965
-4.239121
0.84467
other
Nd1P3
4
139
77.13
mp-1185087
-4.039665
-7.246638
2.155886
other
K3W1
4
139
186.87
mp-999394
-5.750064
-2.552177
3.597142
other
Nb3Ni1
4
139
66.46
mp-1184414
-5.398527
-7.100412
4.216351
other
Eu3Ta1
4
139
120.35
mp-1185116
-6.78903
-6.641395
6.843053
other
La3Cl1
4
139
126.04
mp-1184784
-8.371693
-3.653816
2.545573
other
Ir1Pd3
4
139
60.4
mp-1187223
-5.498231
-2.620991
3.546676
other
Ta3Pd1
4
139
70.41
mp-1186413
-5.751801
-1.143193
4.18454
other
Pa1Re3
4
139
69.75
mp-1188028
-3.990437
-3.956504
0.950103
other
Zr1P3
4
139
64.36
mp-1186049
-5.503163
-7.099606
2.994776
other
Na3Ir1
4
139
85.72
mp-556048
11.004814
11.935523
2.744643
other
Nb16O40
56
139
817.03
mp-30501
-5.470881
-3.101692
3.835097
other
Ti2Cd1
3
139
54.64
mp-973174
-7.848204
-6.923655
2.285402
other
Na1Ag3
4
139
77.33
mp-1187882
-5.087301
-4.107121
3.620252
other
Y1U3
4
139
92.49
mp-982205
-4.213701
-6.962471
1.645248
other
Rb3Cd1
4
139
253.58
mp-979268
-6.257353
-6.736745
1.520883
other
Tl3Br1
4
139
132.62
mp-984779
-7.028637
-6.771164
7.136985
other
Ce1Dy3
4
139
124.55
mp-1185110
-3.894043
-6.962307
1.998037
other
K3Rh1
4
139
139.39
mp-1187829
-6.597775
-6.643242
6.914119
other
Y3Th1
4
139
132.06
mp-1186393
-6.608855
-5.653187
5.247542
other
Np1Sc3
4
139
97.04
mp-30009
8.356142
2.322729
-1.244406
other
Kr1F2
3
139
54.72
mp-1184326
-5.552339
-7.330148
4.36273
other
Eu3Hf1
4
139
137.13
mp-1186182
-5.215338
-4.721635
4.056042
other
Np3Cd1
4
139
96.52
mp-1187903
-7.241505
-6.861238
7.331126
other
Tm3Np1
4
139
116.31
mp-568912
-5.122008
-1.309833
4.736067
other
Be12Nb1
13
139
113.15
mp-568718
-6.47498
-3.181917
5.708515
other
Hf2Al6
8
139
134.66
mp-1184265
-8.072158
-2.164963
3.562125
other
Ga1Rh3
4
139
55.18
mp-335
-6.188725
-6.186916
3.85987
other
Ba1Ga4
5
139
112.74
mp-865856
-6.515724
-5.178951
1.162394
other
Pa1Bi3
4
139
116.2
mp-975812
-7.119487
-6.924313
7.407372
other
Pr1Sm3
4
139
138.03
mp-1183511
-7.825427
-6.96557
2.59744
other
Ca1Ag3
4
139
81.4
mp-1187278
-7.048655
-6.683195
7.04271
other
Tb3Dy1
4
139
127.67
mp-1187294
-7.082481
-6.679057
7.018184
other
Tb3Ho1
4
139
127.15
mp-1185188
-4.043375
-7.146316
2.763418
other
K3Zr1
4
139
207.56
mp-1187652
-7.657921
-1.62556
4.535365
other
Tm1Ru3
4
139
64.85
mp-1183094
-6.392595
-7.853661
5.420064
other
Ac3V1
4
139
146.28
mp-1186564
-6.880451
-7.235015
7.168839
other
Pm3Gd1
4
139
136.65
mp-980188
-5.196908
-7.438467
3.878199
other
Rb1Yb3
4
139
197.53
mp-600003
15.706872
5.62493
0.411141
other
Si16O32
48
139
891.58
mp-865558
-5.952363
-3.5192
-1.767079
other
Ac1Te3
4
139
129.93
mp-979951
-5.692189
-7.015061
4.244507
other
Yb3U1
4
139
142.36
mp-981200
-8.983106
-6.036669
3.012866
other
Zn3Cd1
4
139
65.18
mp-1186315
-7.173897
-6.890161
7.270574
other
Nd1Ho3
4
139
128.54
mp-1202367
-7.493505
-6.238648
4.674636
other
Nd22Sn20
42
139
1,249.2
mp-1184929
-7.406001
-5.927761
2.864945
other
In3Ni1
4
139
84.21
mp-1183941
-6.444808
-6.052032
5.530688
other
Ce2Mg1
3
139
85.65
mp-1187966
-5.753803
-7.372745
4.769804
other
Yb3Hf1
4
139
127.16
mp-1061979
-8.612844
-5.102513
3.323276
other
Tb1Pd2
3
139
66.69
mp-11513
-7.741076
-1.629737
2.818349
other
Nb1Ni3
4
139
48.67
mp-1187528
-5.942982
-4.36835
1.316728
other
Ti1Sb3
4
139
95.81
mp-981385
-5.04841
-4.545646
1.763435
other
Sc3P1
4
139
78.36
mp-985286
-6.586582
-7.806637
5.430797
other
Ac2Mg1
3
139
116.94
mp-862848
-5.955778
-5.359773
5.168837
other
Pa3Al1
4
139
91.06
mp-1903
-5.859442
-5.494878
5.111337
other
Ba1Al4
5
139
118.23
mp-1206428
-6.889616
-10.986318
5.485323
other
Li3Mg5
8
139
168.84
mp-978535
-7.133588
-6.917224
7.366056
other
Sm1Dy3
4
139
128.37
mp-973992
-7.548
-6.505505
6.140674
other
Ho3Pb1
4
139
115.58
mp-975298
-4.63833
-7.327707
2.673221
other
Rb1Na3
4
139
197.6
mp-1183090
-6.63031
-7.961122
5.280759
other
Ac3Cd1
4
139
154.75
mp-1018154
-5.908922
-4.145331
3.922462
other
Hf2Hg1
3
139
64.34
mp-1186867
-3.842964
-6.80829
2.131613
other
Rb3Si1
4
139
181.52
mp-1187816
-8.436631
-6.998706
3.150406
other
Y1Ag3
4
139
80.58
mp-1071453
-6.586116
-5.749156
3.798306
other
Nd4Bi2
6
139
193.59
mp-1186299
-5.025
-4.379888
0.435707
other
Nd1As3
4
139
88.41
mp-1183337
-4.701948
-7.42749
3.627849
other
Ba3Ac1
4
139
228.48
mp-1186250
-7.468054
-6.848759
6.939015
other
Nd2Mg1
3
139
95.29
mp-1184903
-3.914269
-7.146608
2.371637
other
K3Nd1
4
139
227.32
mp-21187
-6.141551
-6.987911
3.86676
other
Ca4In4
8
139
227.5
mp-1184439
-6.894311
-6.977519
7.00558
other
Eu1Y3
4
139
136.75
mp-571558
-0.437156
1.334986
-4.243686
other
Hg3Br6
9
143
305.12
mp-557546
8.866486
12.862359
-1.371525
other
Fe12O18
30
143
384.8
mp-1187792
-3.647341
-2.055698
-5.338128
other
Tl18S9
27
143
827.38
mp-1189328
-7.300618
-2.263004
3.26901
other
Ti9Ni9
18
143
245.52
mp-776922
7.989169
8.333405
-0.297076
other
Rb6O3
9
143
312.96
mp-776952
9.320742
9.365287
0.218936
other
Na6O3
9
143
123.22
mp-1228882
-6.661936
-2.132501
1.503174
other
As7Rh12
19
143
285.63
mp-849083
-5.586289
-0.119108
-5.439291
other
Cr8S12
20
143
335.92
mp-716814
8.461098
13.021295
-1.439296
other
Fe12O18
30
143
372.28
mp-998929
9.173036
8.617863
0.260552
other
K6O3
9
143
175.63
mp-773884
9.449544
8.64641
-0.59038
other
Bi38O60
98
143
1,690.66
mp-571406
-8.077467
-4.077482
3.443384
other
Ga32Pt16
48
142
777.67
mp-1573
-7.865644
-5.05845
2.351288
other
Sn16Pd8
24
142
526.45
mp-1267
-0.18697
0.554398
-0.0671
other
Na8C8
16
142
290.88
mp-866501
-4.2234
-6.158583
1.697383
other
Cs16Ge16
32
142
1,251.12
mp-1214946
6.708812
6.14647
-3.59781
other
Ag4O8
12
142
172.27
mp-1201758
-4.509383
-6.379296
2.166027
other
K16Ge16
32
142
996.21