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-984876
7.679665
10.248297
0.09077
other
Ba2Pd2O5
9
123
141.92
mp-1206980
-2.932965
-8.329422
1.387356
other
La2Sb3Au1
6
123
4,574.8
mp-1216550
8.342334
1.543821
1.085061
other
Tl1Bi1F4
6
123
104.59
mp-1190078
-7.89091
-4.699722
4.895974
other
Ce1Ga6Ni1
8
123
139.29
mp-1245584
1.011818
2.397554
1.266206
other
Li1Pd1N1
3
123
36
mp-1208855
1.027884
1.678132
-3.692901
other
Sr2H1Cl2
5
123
455.86
mp-1206395
0.110663
1.357679
-4.320467
other
Tl2S1Cl2
5
123
531.03
mp-1215329
-6.424169
-3.449373
5.116622
other
Zr1Al2Zn1
4
123
66.77
mp-1207058
0.505562
1.588961
-3.322821
other
Er2I2O1
5
123
246.47
mp-1225512
-2.169126
0.449226
2.416406
other
Dy1Ho1C4
6
123
82.6
mp-1222301
12.742181
11.36379
1.463018
other
Li1Ti1O2
4
123
35.24
mp-1222260
-3.346087
1.290741
2.838307
other
Lu1Co1C1
3
123
43.16
mp-1222965
-7.9629
-6.072477
4.91304
other
La1Y1In6
8
123
207.42
mp-1207299
-3.28919
-2.464099
-3.631599
other
Sm2S2F1
5
123
158.11
mp-1247674
6.762511
12.22675
1.311994
other
Ca8Mn8O23
39
123
445.22
mp-1101871
-7.972305
-4.553419
5.515059
other
Sm2Ga8Co1
11
123
208.01
mp-1206578
-1.14008
2.733072
-3.223554
other
In1Ag1I2
4
123
131.1
mp-1188501
-8.003919
-1.544581
2.659042
other
Mn3Ga4Ni9
16
123
189.71
mp-1225374
-8.4876
-4.92683
2.540679
other
Eu4B1Pd12
17
123
305.65
mp-1278738
8.060226
11.489792
2.19715
other
La2Mn2O6
10
123
122.4
mp-1207046
-5.049694
-3.797775
1.939333
other
U2Sb1Se2
5
123
138.03
mp-1184114
9.332635
10.357965
0.492805
other
Er2Pt2O5
9
123
127.15
mp-1222309
-4.323021
-4.176804
-3.872899
other
Li1Dy1Se2
4
123
93.16
mp-1211109
-4.332531
-4.954708
-1.034776
other
Na2Cu1Te2
5
123
2,330.66
mp-1224523
-8.321066
-3.98983
2.513054
other
Gd1Pd2Pt1
4
123
71.53
mp-1228041
-8.029916
-1.562823
2.51087
other
Al1Si1Ni6
8
123
85.36
mp-1212437
-4.965958
-4.505192
4.17107
other
Hf2Si1Te2
5
123
136.61
mp-1217078
-6.966705
-1.802836
3.654894
other
Ti2Co1Ni1
4
123
53.45
mp-1025191
-7.989889
-3.945771
5.139031
other
Sc1Ga5Ni1
7
123
111.92
mp-1101093
-3.383155
-4.08478
0.607598
other
Cs1Zn4P3
8
123
171.49
mp-1217262
-3.290098
-3.840865
-2.724744
other
Th1U1Se2
4
123
103.35
mp-1180477
3.048241
-0.396622
-2.351206
other
Li1H1Pd1
3
123
37.19
mp-1221642
-7.17669
-1.434367
4.585619
other
Mn1Al2Co1
4
123
49.24
mp-1187283
10.705854
8.807066
2.928205
other
Tb2Th2O5
9
123
193.66
mp-1219262
-8.558071
-4.904703
3.194819
other
Sc1In1Pd2
4
123
72.56
mp-1207309
-2.278922
-8.313692
1.952577
other
La2Si3Ir3
8
123
748.13
mp-1223795
-4.273059
-3.965368
-3.906557
other
Ho1Ag1Se2
4
123
93.13
mp-1103036
-7.904603
-4.352458
5.570546
other
Y2Ga8Co1
11
123
194.98
mp-1217265
-3.139091
-3.858445
-2.878989
other
Th1U1S2
4
123
91.37
mp-1186090
12.395397
10.40912
-0.331038
other
Mo2W2O5
9
123
110.92
mp-1025306
-7.868322
-3.120841
2.621152
other
Al1As1Pt5
7
123
109.61
mp-1208704
-2.630539
-8.426382
1.680851
other
Tb2Zn1Sn3
6
123
4,842.19
mp-1207849
-4.86578
-4.819794
6.229923
other
Y2Mn1Si2
5
123
115.08
mp-1206696
-2.867625
-8.193953
1.396428
other
Er2Ag1Sb3
6
123
3,205.79
mp-1206465
-7.973816
-5.487197
4.539524
other
Ce2In8Rh1
11
123
270.63
mp-1206255
-8.156838
-5.344808
4.258024
other
Er1In5Rh1
7
123
158.14
mp-1224681
-7.352398
-5.939948
3.498478
other
Gd1Ag1Sn2
4
123
95.08
mp-1183855
10.927927
10.848109
0.422399
other
Cs2Tc2O5
9
123
146.54
mp-723835
2.763779
3.046506
-4.178456
other
Pd1N2Cl4
7
123
171.31
mp-1025198
-7.819071
-4.293082
5.088746
other
Np1Ga5Ni1
7
123
121.12
mp-1025271
-7.82563
-3.143729
2.460277
other
Al1P1Pt5
7
123
104.8
mp-29929
1.905185
1.952801
1.396519
other
Na1Li5N2
8
123
71.77
mp-1078343
-7.936399
-3.476957
4.947032
other
U1Ga5Ru1
7
123
126.86
mp-1102174
-7.977309
-3.111646
2.56777
other
In2As1Pt8
11
123
180.22
mp-1216001
-4.335038
-3.853698
-3.963313
other
Y1Ag1Se2
4
123
96.91
mp-1207151
-1.1112
1.11237
-3.342967
other
Bi2I2O1
5
123
186.57
mp-1212502
-4.7353
-5.131515
4.36097
other
Hf2Si1S2
5
123
119.45
mp-1206232
-2.965935
-8.270881
1.368476
other
Nd2Cd1Sb3
6
123
3,402.85
mp-1228832
-8.114228
-1.591787
2.525004
other
Al1Ni6Ge1
8
123
87.83
mp-1220875
-2.616691
-2.655453
-5.708424
other
Na1Pr1S2
4
123
97.16
mp-1215166
-9.021276
-4.513978
4.220377
other
Zr1Zn1Cu2
4
123
62.16
mp-1025283
-8.174517
-5.359675
4.299952
other
Pr1In5Rh1
7
123
166.42
mp-20975
-8.069988
-5.264874
4.352262
other
Ce1In5Ir1
7
123
166.33
mp-1215180
0.811492
1.41976
2.808069
other
Zr1Ti1N2
4
123
44.5
mp-1217047
-8.802121
-4.424579
4.045905
other
Ti1Al1Cu2
4
123
55.21
mp-1207354
-2.883852
-7.844977
1.208463
other
La2Ag1As3
6
123
4,944.76
mp-1206473
-2.928901
-8.275229
1.349827
other
Pr2Zn1Sb3
6
123
3,702.87
mp-1206388
-0.21095
0.655695
-0.318545
other
Na1Ag1C2
4
123
76.51
mp-1222902
-3.537585
1.842537
2.990974
other
La1Eu1B12
14
123
143.32
mp-1221720
-7.984975
-1.978068
3.800602
other
Mn1Al1Ir2
4
123
54.64
mp-1225498
-3.410239
1.241172
2.7728
other
Er1Co1C1
3
123
44.59
mp-1147646
1.687704
2.023563
1.426909
other
Li1Cu1N1
3
123
32.5
mp-1223296
-6.956455
-6.394024
6.254386
other
La6Zn1Cu1
8
123
242.02
mp-1224620
-7.517021
-0.080368
3.267542
other
In4Co12C3
19
123
222.49
mp-1229005
-3.920058
-1.383078
-5.86923
other
Ag1Sn1S2
4
123
84.22
mp-1207288
0.897584
1.657178
-3.451318
other
Pr2Br2O1
5
123
254.61
mp-1223826
-6.841483
-4.154615
6.412555
other
Ho4Hf1Al15
20
123
375.16
mp-1191222
-8.036876
-4.141796
5.449621
other
Dy4Ga16Co3
23
123
390.63
mp-1217040
-8.364797
-4.509088
2.709348
other
Ti1Al1Pd2
4
123
60.96
mp-1215681
-5.152245
-3.773141
0.588706
other
Y1U1As2
4
123
99.41
mp-1077585
9.291166
8.92695
0.582955
other
Na4N1O1
6
123
94.69
mp-22934
1.528357
2.627535
-5.65453
other
K2Pt1Cl4
7
123
204.03
mp-1217758
-3.522352
1.777523
2.996719
other
Sr1Sm1B12
14
123
142.53
mp-1217009
-6.14866
-2.986014
5.380215
other
Ti1Al2Zn1
4
123
60.14
mp-19796
12.926375
10.374434
2.327548
other
Ba2Nb5O9
16
123
218.82
mp-1105864
1.490016
2.141383
1.027954
other
Cu11Pd1N4
16
123
227.03
mp-1238777
8.382655
12.550321
-0.935322
other
Co1Ni1O2
4
123
38.36
mp-1228908
-7.450929
-1.54991
4.512112
other
Al2Co1Ru1
4
123
49.34
mp-1017173
-7.002362
-10.713251
6.648296
other
Rb1Mg6Nb1
8
123
206.59
mp-1147543
6.452716
11.360223
-1.390687
other
Na1Ni1O2
4
123
46.86
mp-1224981
-7.982408
-2.022289
3.021885
other
Fe1Cu1Pt2
4
123
54.84
mp-1209782
-2.827735
-8.322612
1.380437
other
Pr2Sb3Pd1
6
123
3,299.22
mp-1187076
11.385708
8.951317
0.820002
other
Sr2Ge2O5
9
123
118.77
mp-1223863
-6.138746
-3.263023
-2.255288
other
In1Cu1Te2
4
123
103.52
mp-1222806
-3.544442
1.816345
2.971401
other
La1Gd1B12
14
123
140.6
mp-975106
6.636777
9.158092
-0.919489
other
Rb2Bi2O5
9
123
165.69
mp-1207360
-2.824679
-8.323981
1.381905
other
Pr2Sb3Pd1
6
123
4,710.63
mp-1206246
-5.853694
-4.796067
0.952961
other
La2Sb3Pd3
8
123
211.18
mp-1218294
-5.757416
-3.968292
-1.76659
other
Sr1Eu1Te2
4
123
132.27
mp-1185149
11.836275
8.861968
2.031534
other
Li2U2O5
9
123
140.98