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-1187408
-6.035882
-6.385372
6.24799
other
Th3Cl1
4
139
117.82
mp-1184783
-7.634441
-1.908306
4.030638
other
Ir3Se1
4
139
61.49
mp-715262
12.626943
11.329488
0.131091
other
Fe2O2
4
139
42.78
mp-979010
-5.714416
-4.628326
3.371256
other
Tm1Pu3
4
139
110.63
mp-1186493
-7.248789
-7.307465
6.852942
other
Pm3Cd1
4
139
121.13
mp-1105296
-5.759697
-5.599179
3.692407
other
Sr4Ge12
16
139
371.98
mp-1976
-6.345995
-6.002468
4.228214
other
Ca1Ga4
5
139
99.52
mp-978939
-6.765072
-6.738858
7.179968
other
Sm3Th1
4
139
133.49
mp-10106
-4.688525
-5.75156
1.02951
other
Ca4As2
6
139
164.51
mp-1187547
-6.965859
-6.958201
7.014105
other
Yb1Y3
4
139
132.95
mp-1186666
-5.648645
-4.610898
3.383965
other
Pm1Pu3
4
139
116.12
mp-30883
-7.038517
-1.857608
4.006172
other
V4Zn5
9
139
122.66
mp-1183858
-3.465169
-1.884152
-5.078473
other
Ce1S3
4
139
76.36
mp-1185172
-3.853425
-7.170902
2.440184
other
K3Th1
4
139
210.63
mp-1186520
-7.158282
-6.911863
7.387027
other
Pr1Dy3
4
139
130.99
mp-706
8.071667
2.293786
-0.2713
other
Hg2F2
4
139
73.94
mp-9925
-4.93802
-6.041227
0.846677
other
Ca4Sb2
6
139
189.9
mp-1978391
-6.097148
-2.853541
-2.292951
other
Cu1Te1
2
139
41.48
mp-976765
-5.568258
-7.24247
2.885345
other
Na3Au1
4
139
94.6
mp-1186863
-3.898907
-7.01715
2.042717
other
Rb3Nd1
4
139
264.56
mp-1184013
-7.422702
-7.497682
1.77425
other
Ga1Hg3
4
139
102.41
mp-1185077
-4.084181
-7.044026
1.924366
other
K3Tc1
4
139
180.77
mp-972472
-4.922989
-4.755893
0.219601
other
Sn1As3
4
139
88.91
mp-1187512
-8.720141
-5.954723
2.505939
other
Ti1Au3
4
139
68.14
mp-974982
-4.126815
-6.950891
1.656078
other
Rb3In1
4
139
234.74
mp-1184315
-3.490847
-1.742324
-5.210191
other
Eu1S3
4
139
77.71
mp-1184882
-3.95163
-7.049357
2.208658
other
K3Al1
4
139
187.18
mp-1147756
1.714869
2.426284
-5.077353
other
Cu1Cl2
3
139
139.51
mp-999391
-7.192199
0.221139
4.251955
other
Nb1Fe3
4
139
52.87
mp-1187451
-6.302332
-1.436026
4.274909
other
Th1Tc3
4
139
71.53
mp-862901
8.558768
1.452435
1.791153
other
Pm1F3
4
139
44.9
mp-974970
-3.958551
-7.147469
1.818683
other
Rb3Mn1
4
139
245.4
mp-1184121
-7.402505
-1.421961
4.184864
other
Cu1Ru3
4
139
54.28
mp-973022
-7.55948
-1.534582
4.461405
other
Sc1Ru3
4
139
61.13
mp-542915
-6.129895
-2.754204
5.572053
other
Ti1Al3
4
139
62.54
mp-1184010
-5.98506
-5.936466
3.385113
other
Ga3Te1
4
139
95.12
mp-980204
-3.780805
-3.883685
0.895405
other
Ti1P3
4
139
58.25
mp-1184782
-6.184069
-6.782852
2.375923
other
Ge1Pb3
4
139
117.26
mp-1185180
-5.910923
-4.919812
4.428776
other
Li3B1
4
139
45.29
mp-863709
-7.725805
-1.570968
3.641961
other
Ir3Rh1
4
139
56.61
mp-1187742
-6.593995
-6.66001
2.274168
other
Tl1In3
4
139
109.5
mp-1186725
-7.560882
-6.771467
7.02111
other
Pr3Pd1
4
139
115.72
mp-979982
-5.992858
-4.759332
3.256046
other
Yb1Pu3
4
139
116.19
mp-1184397
-5.728758
-7.257598
4.214562
other
Eu3Tc1
4
139
114.41
mp-1017511
-6.811985
-0.442903
3.917509
other
Cr3Fe1
4
139
46.28
mp-30064
12.660402
9.82313
0.867804
other
V32O6
38
139
641.3
mp-1094266
-7.762637
-9.767946
6.664758
other
Mg3Ti1
4
139
84.82
mp-979115
-5.640864
-3.111367
3.812994
other
Ti2Ag1
3
139
51.29
mp-1063522
-8.369084
-4.903884
3.138544
other
Ce1Pd2
3
139
67.67
mp-1039293
-7.302686
-10.774289
4.932068
other
Mg3Cd1
4
139
86.49
mp-23177
-0.463447
1.396681
-4.454682
other
Hg2Br2
4
139
126.95
mp-1184650
-5.915378
-3.721928
4.01563
other
Hf3Ga1
4
139
81.21
mp-977145
-7.29388
-6.384828
6.480704
other
Ho3P1
4
139
97.6
mp-1188013
-5.673271
-7.276319
4.123471
other
Yb3Eu1
4
139
166.3
mp-971859
-7.737202
-5.788666
3.312529
other
Zn3B1
4
139
51.25
mp-972084
-7.304368
-0.757014
4.438475
other
Tb1Mn12
13
139
161.52
mp-976870
-9.014864
-1.25116
2.715821
other
Na1Ni3
4
139
50.99
mp-1186526
-6.902566
-7.23647
7.283422
other
Pm3Pr1
4
139
140.28
mp-979941
-5.923975
-7.236941
4.340784
other
Yb3V1
4
139
123.81
mp-1185469
-5.640416
-7.3252
4.12825
other
Li1Yb3
4
139
146.22
mp-979273
-6.855237
-3.623726
0.21006
other
Te1Pd3
4
139
67.45
mp-1186889
-3.936657
-7.087182
2.402968
other
Rb3Zr1
4
139
239.11
mp-982510
-3.065002
-4.600593
0.808135
other
P3Au1
4
139
85.78
mp-1184018
-8.667507
-5.490773
2.251386
other
Cu1Au3
4
139
64.7
mp-15697
-4.695556
-5.942043
1.071121
other
Sr4As2
6
139
200.41
mp-27668
-6.288657
-5.940888
3.799718
other
Mg4Ga10
14
139
259.55
mp-1183657
-6.343688
-5.773295
0.625119
other
Cd1Bi3
4
139
121.64
mp-1186540
-6.859601
-7.211432
7.191885
other
Pm3Sm1
4
139
137.56
mp-1185111
-3.946765
-7.16927
2.303071
other
K3Pr1
4
139
229.67
mp-1184266
-6.56456
-6.081174
2.040647
other
Ga1Sn3
4
139
101.43
mp-10201
-6.006463
-1.128895
3.650992
other
Ge2Mo1
3
139
45.12
mp-756395
10.152946
12.808975
-3.97303
other
V9O21
30
139
348.92
mp-972479
-7.179313
-6.875031
7.234365
other
Sm3Sc1
4
139
125.45
mp-1018177
-1.028859
0.51191
1.073102
other
Eu1C2
3
139
50.81
mp-1185148
2.015441
2.971277
-4.553971
other
K1Cl3
4
139
118.82
mp-979938
-6.143681
-7.081837
4.299069
other
Yb3Tc1
4
139
98.74
mp-1187114
-4.854841
-7.488904
3.784281
other
Sr3Cr1
4
139
169.33
mp-1079938
-8.266894
-4.65684
1.848633
other
Tl2Pd6
8
139
132.88
mp-984796
-5.958739
-6.177541
5.836322
other
Ba1Th3
4
139
141.05
mp-1183200
-5.702065
-4.897745
5.290797
other
Al3Sn1
4
139
78.21
mp-972848
6.533221
3.495714
-2.617455
other
Si1C3
4
139
46.22
mp-974068
-6.676511
-6.695131
7.100946
other
Nd3Th1
4
139
137.76
mp-2839
-2.230844
0.413492
2.342417
other
Ce1C2
3
139
44.67
mp-1184179
-7.231835
-6.034899
6.081426
other
Er3P1
4
139
96.67
mp-1183473
-7.457553
-1.348809
4.413665
other
Be1Ru3
4
139
51.56
mp-1186083
-4.975173
-7.389482
3.566965
other
Na3Sm1
4
139
137.88
mp-1186272
-7.418759
-6.909661
7.112539
other
Nd3Cu1
4
139
109.8
mp-1184375
-8.579465
-6.437699
2.449944
other
Eu1Au3
4
139
88.38
mp-1009238
-5.811289
-4.449896
3.902513
other
Hf2Tl1
3
139
66.18
mp-30488
-7.501551
-7.502949
1.768362
other
Cd1Hg2
3
139
75.73
mp-2352325
2.001413
2.22225
-3.767408
other
H1Br1
2
139
64.1
mp-990
-9.179462
-6.189177
2.753461
other
Ho1Au2
3
139
61.52
mp-1184336
-7.494668
-1.389953
3.552662
other
Fe1Ir3
4
139
55.4
mp-1183658
-6.97794
-6.682787
1.549642
other
Cd3Bi1
4
139
100.12
mp-982664
-4.157568
-7.085291
1.993526
other
K3In1
4
139
197.1
mp-1186803
-3.84141
-2.047909
-4.042658
other
Pu1S3
4
139
72.08
mp-1018124
-6.453415
-2.712265
4.017753
other
Ti2Rh1
3
139
45.72
mp-972170
-6.886444
-6.754388
7.08253
other
Tb1Y3
4
139
131.7
mp-973064
2.919773
-0.372691
-1.831215
other
La1H3
4
139
43.07
mp-1186132
-5.019101
-7.408673
3.625763
other
Na1Ca3
4
139
168.9