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-1244867
6.693208
10.964175
-1.934564
other
Co30O60
90
1
1,216.43
mp-1245181
2.647329
2.591825
1.18433
other
Ga50N50
100
1
1,489.98
mp-1075566
-2.122022
-6.031802
7.535618
other
Mg10Si12
22
1
406.17
mp-1245183
12.720028
7.407154
0.723827
other
Al40O60
100
1
1,119.32
mp-1245157
16.918953
9.38319
7.708103
other
Mg40O40
80
1
981
mp-1244956
12.383551
9.099972
2.483679
other
Ti75O25
100
1
1,455.16
mp-1245133
10.947931
9.119637
0.282514
other
Sn40O40
80
1
1,764.94
mp-1075720
-2.876079
-5.248962
6.926753
other
Mg10Si18
28
1
484.74
mp-1245122
-4.7135
-1.796568
-6.747231
other
Zn50S50
100
1
2,350.57
mp-1245300
-4.692541
-1.777071
-6.734635
other
Zn50S50
100
1
2,435.75
mp-1245047
12.099774
12.891947
-2.530526
other
V34O68
102
1
1,345.25
mp-1074916
-3.311651
-7.93541
7.463835
other
Mg14Si8
22
1
431.49
mp-1245066
12.551509
9.31316
2.303605
other
Ti68O34
102
1
1,373.46
mp-1245278
9.172446
9.143124
0.085118
other
Na68O34
102
1
1,742.31
mp-1074587
-2.92696
-7.457112
7.581754
other
Mg8Si6
14
1
273.13
mp-684990
12.700344
7.273831
0.812423
other
Al12O18
30
1
498.4
mp-1245061
10.052113
12.149364
-4.23257
other
V30O75
105
1
1,827.69
mp-1222233
-6.1991
-1.859632
1.295673
other
Mn23As16
39
1
570.72
mp-826025
9.758915
10.804975
-3.318665
other
W3O10
13
1
188.02
mp-1359489
6.364148
8.933466
-1.256881
other
Bi12O24
36
1
719.82
mp-1073166
-2.159432
-5.80958
7.397017
other
Mg8Si12
20
1
381.32
mp-1074122
-2.435249
-5.519024
7.100441
other
Mg8Si14
22
1
416.92
mp-1343930
8.007531
4.998888
-1.228874
other
Ta22O4
26
1
442.39
mp-1245302
2.698463
2.681219
0.977825
other
Ga50N50
100
1
1,625.96
mp-1075267
-2.217214
-5.795143
7.391345
other
Mg6Si8
14
1
254.31
mp-1075310
-2.32606
-5.781991
7.318971
other
Mg6Si8
14
1
247.95
mp-1245321
10.616879
12.255577
2.169404
other
Ti30O60
90
1
1,148.15
mp-1073557
-2.56482
-5.422784
7.038984
other
Mg4Si8
12
1
221.11
mp-1245024
12.70901
7.400337
0.702035
other
Al40O60
100
1
1,105.07
mp-1244954
12.715502
7.399371
0.71148
other
Al40O60
100
1
1,120.51
mp-1372329
7.704312
5.107556
-1.837107
other
Ta6O15
21
1
275.03
mp-1096900
0.685699
3.107651
1.521151
other
Cr4N8
12
1
199.12
mp-1074519
-2.830264
-7.423944
7.513129
other
Mg16Si12
28
1
554.88
mp-1074292
-2.873468
-7.401803
7.416013
other
Mg8Si6
14
1
284.36
mp-1075139
-2.082142
-5.885132
7.446149
other
Mg6Si8
14
1
264.01
mp-1245040
10.083414
12.111524
-4.220971
other
V30O75
105
1
1,838.4
mp-733790
15.433471
5.74635
0.336167
other
Si24O48
72
1
1,061.88
mp-1245262
12.677988
7.421745
0.712218
other
Al40O60
100
1
1,113.18
mp-1074066
-3.453418
-8.113377
7.299347
other
Mg18Si10
28
1
575.95
mp-1075191
-2.179975
-5.82919
7.43419
other
Mg6Si8
14
1
261.15
mp-1244969
-4.686071
-1.793298
-6.72649
other
Zn50S50
100
1
2,327.16
mp-1245137
10.000401
12.148132
-4.312129
other
V30O75
105
1
1,895.4
mp-1245200
9.430887
8.787109
1.785931
other
Ca50O50
100
1
1,670.95
mp-1247874
-2.226059
-8.340561
1.27557
other
Ag6Se3
9
1
2,316.67
mp-1178822
5.825815
2.546392
-3.18749
other
V8C24
32
1
280.64
mp-1244962
17.079008
9.434257
7.76689
other
Mg40O40
80
1
943.68
mp-1245162
9.929909
12.130222
-4.294093
other
V30O75
105
1
1,670.21
mp-632442
-1.97344
0.43146
2.257851
other
Al4C3
7
1
79.72
mp-1215724
-8.593637
-6.422596
2.469041
other
Zn9Ag9
18
1
294.7
mp-1080324
-4.260532
-4.914869
-3.397993
other
Ce4Se8
12
1
683.33
mp-1075036
-2.247939
-5.7546
7.390031
other
Mg6Si8
14
1
253.87
mp-1245271
12.834491
10.518433
-0.422945
other
W34O68
102
1
1,564.84
mp-684081
-2.801155
-0.911407
-4.922579
other
As24S24
48
1
1,613.18
mp-1074007
-2.603988
-7.019001
7.550176
other
Mg12Si10
22
1
438.17
mp-705588
11.521055
12.174262
-0.173627
other
Fe16O18
34
1
370.38
mp-995393
-2.418071
-0.315193
-5.092261
other
Li2S8
10
1
2,115.08
mp-1247838
-3.693234
-2.404305
-3.189678
other
Al4Se6
10
1
2,844.19
mp-1073861
-2.301867
-6.870865
7.707022
other
Mg6Si6
12
1
227.79
mp-1244893
12.653124
7.922348
0.653725
other
Al32O12
44
1
1,406.81
mp-1244935
9.53635
9.762665
-0.394782
other
Sn30O60
90
1
1,314.18
mp-1075674
-2.488221
-5.497012
7.07244
other
Mg10Si18
28
1
533.92
mp-1247846
12.687539
7.447142
0.58383
other
Al16O24
40
1
397.85
mp-1228811
-9.118357
-0.958019
3.932227
other
B11Rh18
29
1
319.35
mp-1073702
-2.346936
-6.750083
7.665952
other
Mg12Si12
24
1
454.54
mp-1075499
-2.064641
-5.983067
7.4834
other
Mg10Si12
22
1
430.03
mp-1074147
-2.529546
-5.440886
7.089977
other
Mg8Si14
22
1
409.77
mp-1100472
-2.129325
-5.901669
7.44818
other
Mg10Si12
22
1
405.81
mp-1074500
-2.934582
-7.453455
7.587193
other
Mg8Si6
14
1
265.44
mp-1074093
-3.406106
-8.0866
7.390299
other
Mg18Si10
28
1
550.26
mp-1074788
-3.240532
-7.905536
7.468034
other
Mg14Si8
22
1
444.95
mp-1075510
-1.954387
-6.098612
7.478491
other
Mg10Si12
22
1
433.53
mp-1075578
-2.462455
-6.007122
7.445525
other
Mg10Si12
22
1
396.31
mp-1245232
16.912449
9.389394
7.716729
other
Mg40O40
80
1
975.54
mp-726118
8.128115
2.925873
-1.62045
other
N4F8
12
1
217.94
mp-1073465
-2.651231
-5.377781
6.986281
other
Mg4Si8
12
1
213.53
mp-673645
-5.652985
1.241855
-4.633451
other
Mo14S16
30
1
541.74
mp-1073592
-2.542919
-5.41436
7.05343
other
Mg4Si8
12
1
221.49
mp-1074960
-2.15625
-5.840462
7.426301
other
Mg6Si8
14
1
251.33
mp-1244887
12.712754
7.417717
0.687368
other
Al40O60
100
1
1,077.82
mp-1245305
9.427548
8.725844
1.81335
other
Ca50O50
100
1
1,653.61
mp-1075622
-2.507821
-5.45727
7.136895
other
Mg10Si18
28
1
503.52
mp-1245101
10.020234
12.193707
-4.264182
other
V30O75
105
1
1,815.66
mp-1075475
-2.29475
-6.067755
7.512999
other
Mg10Si12
22
1
392.62
mp-1075157
-2.055612
-5.927183
7.427817
other
Mg6Si8
14
1
272.4
mp-1245297
3.32804
2.637184
0.50838
other
B50N50
100
1
1,126.07
mp-1075368
-2.285389
-5.977196
7.483384
other
Mg10Si12
22
1
394.64
mp-1245036
12.755005
7.365689
0.723554
other
Al40O60
100
1
1,125.14
mp-1244997
12.784591
7.343883
0.700495
other
Al40O60
100
1
1,123.23
mp-1399879
-2.893509
-5.725316
6.487934
other
Mg6Si8
14
1
250.85
mp-1074863
-3.220142
-7.879618
7.527646
other
Mg14Si8
22
1
434.46
mp-1074264
-2.880117
-7.435156
7.519803
other
Mg8Si6
14
1
272.83
mp-1216020
-9.790496
-4.650825
3.553046
other
Zn35Cu17
52
1
703.9
mp-1250755
11.224023
6.806315
-1.989913
other
Si6O14
20
1
352.8
mp-684594
10.883262
8.610203
2.599683
other
Ce32O54
86
1
1,362.03
mp-1075035
-1.974864
-5.986115
7.486233
other
Mg6Si8
14
1
267.27
mp-685187
-2.965277
-2.579072
-4.979615
other
Yb58S60
118
1
2,921.3
mp-1245015
10.281087
9.004953
0.085095
other
Zn40O40
80
1
1,118.34
mp-1245286
2.649592
2.596541
1.193049
other
Ga50N50
100
1
1,500.2
mp-1074413
-2.904121
-7.427387
7.619812
other
Mg8Si6
14
1
264.01
mp-850874
7.727183
10.246369
-3.844626
other
Cr19O48
67
1
895.85