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-684943
12.752769
9.767315
2.133212
other
Ta22O21
43
1
654.6
mp-705563
6.978641
13.206014
-1.963326
other
Co29O40
69
1
727.98
mp-1075335
-2.033557
-5.920814
7.486177
other
Mg12Si16
28
1
530.52
mp-1074057
-3.477058
-8.092874
7.303638
other
Mg18Si10
28
1
559.83
mp-1075263
-1.982027
-5.98371
7.466924
other
Mg6Si8
14
1
273.85
mp-1074194
-2.548642
-5.406994
7.136626
other
Mg8Si14
22
1
398.85
mp-1262335
-2.451473
-5.585059
7.221102
other
Mg8Si12
20
1
371.45
mp-1075030
-2.257648
-5.753663
7.39704
other
Mg6Si8
14
1
250.85
mp-1075132
-2.456658
-5.686421
7.258597
other
Mg6Si8
14
1
247.56
mp-1074957
-2.068267
-5.878367
7.45185
other
Mg6Si8
14
1
265.22
mp-1244930
12.683352
7.43023
0.68859
other
Al40O60
100
1
1,085.32
mp-1044869
10.216533
9.797463
-0.815852
other
Sb12O24
36
1
670.81
mp-685099
-5.141506
-1.570571
-2.854039
other
Ir7Se21
28
1
653.95
mp-684876
-6.18938
-2.402675
-0.819234
other
Te40Rh31
71
1
1,674.47
mp-1101121
-4.656395
-1.606669
-2.801709
other
Ti20Se19
39
1
695.05
mp-714932
12.679422
13.322841
-1.500233
other
V10O18
28
1
299.98
mp-1073089
-2.412019
-5.613466
7.283426
other
Mg8Si12
20
1
366.9
mp-1245030
2.555235
2.509943
1.241734
other
Ga50N50
100
1
1,399.09
mp-1245294
12.774579
9.966145
2.010316
other
Ti50O50
100
1
1,180.46
mp-1073996
-2.812186
-7.178685
7.699539
other
Mg12Si10
22
1
405.56
mp-1075047
-2.202378
-5.82152
7.415752
other
Mg6Si8
14
1
259.18
mp-1074636
-3.650456
-8.342221
7.35043
other
Mg8Si4
12
1
244.68
mp-1073519
-2.529788
-5.410419
7.094607
other
Mg4Si8
12
1
216.84
mp-1075163
-2.511455
-5.640162
7.259325
other
Mg6Si8
14
1
247.71
mp-759920
12.82066
11.19684
1.801172
other
Ti15O24
39
1
410.35
mp-1244889
9.992199
12.142366
-4.294188
other
V30O75
105
1
1,820.45
mp-1245303
9.549868
11.748453
0.071481
other
Li68O34
102
1
979.11
mp-1075031
-2.207052
-5.77634
7.420435
other
Mg6Si8
14
1
256.69
mp-1239183
-3.620058
-0.516977
-4.387082
other
Mo1S3
4
1
277.65
mp-1075569
-1.98694
-6.032846
7.49119
other
Mg10Si12
22
1
428.28
mp-1074041
-3.404053
-8.078945
7.422132
other
Mg18Si10
28
1
556.99
mp-1245205
9.142088
9.301903
0.03289
other
Na68O34
102
1
1,843.19
mp-1245212
13.533868
4.357594
-2.492531
other
B40O60
100
1
1,451.24
mp-1074061
-3.459991
-8.131686
7.33825
other
Mg18Si10
28
1
554.53
mp-1376661
-3.71924
-1.429776
-5.730196
other
Al12S18
30
1
906.92
mp-2214725
9.987479
12.786926
-4.115386
other
V5O12
17
1
205.73
mp-1245277
8.67659
12.803346
-1.465867
other
Fe32O48
80
1
1,088.47
mp-1074062
-3.412013
-8.074133
7.383258
other
Mg18Si10
28
1
560.1
mp-1244869
8.620784
13.145162
-1.3611
other
Fe32O48
80
1
982.25
mp-620471
-5.848906
-3.198105
-1.776557
other
Cs3Te22
25
1
976.24
mp-1245014
3.574813
2.71679
-2.793096
other
Sb50N50
100
1
3,983.97
mp-715598
12.49091
13.41585
-1.835355
other
V14O26
40
1
426.89
mp-1245119
6.636976
11.15364
-1.820397
other
Co30O60
90
1
1,196.18
mp-1245276
9.064424
8.948483
1.644932
other
Ba50O50
100
1
2,606.42
mp-695743
3.689922
3.288372
-3.716833
other
N8Cl4
12
1
346.12
mp-1341154
-2.595723
-5.547334
6.895823
other
Mg10Si18
28
1
517.23
mp-1245080
12.702517
7.413611
0.719737
other
Al40O60
100
1
1,128.92
mp-1244879
10.603792
9.27035
0.244892
other
In40O60
100
1
1,530.42
mp-1073721
-2.281056
-6.79973
7.647462
other
Mg12Si12
24
1
455.32
mp-1075098
-2.148978
-5.870992
7.428432
other
Mg6Si8
14
1
256.45
mp-685023
1.579488
1.711301
1.323213
other
Sr4N3
7
1
153.1
mp-758800
-2.684487
1.821104
2.628092
other
B84O11
95
1
706.18
mp-1245203
9.332268
9.692472
-0.447687
other
Sn30O60
90
1
1,315.24
mp-684965
-3.911849
-2.380847
-2.766792
other
Zr16Se16
32
1
789.31
mp-1074433
-2.951641
-7.479862
7.5926
other
Mg8Si6
14
1
263.74
mp-38238
8.669368
8.985394
-1.311451
other
Ag6O3
9
1
168.06
mp-1245142
10.092525
12.173539
-4.25931
other
V30O75
105
1
1,948.47
mp-1245257
11.333368
12.901403
-0.594176
other
Cr32O48
80
1
947.29
mp-1074465
-2.858096
-7.379274
7.445408
other
Mg8Si6
14
1
281.25
mp-1245058
10.126823
12.162507
-4.210425
other
V30O75
105
1
1,911.42
mp-1245227
12.860227
10.57214
-0.432552
other
W34O68
102
1
1,658.69
mp-1245150
2.743433
2.713947
0.929675
other
Ga50N50
100
1
1,621.08
mp-983357
9.537506
2.738353
-2.614753
other
H6F4
10
1
96.78
mp-1245280
-4.662465
-1.809038
-6.713511
other
Zn50S50
100
1
2,342.78
mp-1073655
-2.553937
-5.397322
7.043263
other
Mg8Si16
24
1
421.45
mp-1075040
-2.373376
-5.680225
7.35199
other
Mg6Si8
14
1
249.77
mp-1074344
-2.798558
-7.400781
7.474133
other
Mg16Si12
28
1
560.47
mp-1073061
-2.674572
-5.378556
7.159152
other
Mg8Si12
20
1
347.63
mp-1075232
-2.126038
-5.896732
7.428501
other
Mg6Si8
14
1
260.33
mp-1404518
-2.367057
-6.08286
6.355315
other
Mg8Si6
14
1
278.31
mp-1347342
-2.636694
-5.479968
6.964255
other
Mg10Si18
28
1
493.53
mp-1245138
2.692375
2.650043
1.10784
other
Ga50N50
100
1
1,541.11
mp-1075483
-2.493935
-5.980714
7.447055
other
Mg10Si12
22
1
392.47
mp-1075371
-2.211032
-5.818173
7.412958
other
Mg6Si8
14
1
260.95
mp-1075011
-2.140822
-5.84711
7.456475
other
Mg6Si8
14
1
257.08
mp-1245070
-4.696754
-1.793318
-6.741309
other
Zn50S50
100
1
2,434.98
mp-1245149
0.828072
1.537002
2.824453
other
Ta50N50
100
1
1,277.1
mp-1096928
0.673299
3.105803
1.524489
other
Cr3N6
9
1
154.92
mp-673671
12.164292
8.573388
2.311381
other
U11O5
16
1
300.76
mp-1244940
12.664271
7.43477
0.660912
other
Al40O60
100
1
1,078.77
mp-32983
-4.017636
-0.106803
-3.529031
other
Nb12S20
32
1
595.55
mp-689684
11.937496
7.231166
-5.900014
other
P8O20
28
1
569.72
mp-1074489
-2.896827
-7.383
7.496118
other
Mg8Si6
14
1
277.7
mp-1074131
-2.523508
-5.442868
7.129742
other
Mg8Si14
22
1
405.37
mp-1245118
10.041681
12.125316
-4.272815
other
V30O75
105
1
1,865.69
mp-1350563
12.959103
10.821125
-0.310422
other
W16O32
48
1
623.82
mp-1074925
-3.319985
-7.982951
7.494551
other
Mg14Si8
22
1
432.86
mp-1074356
-2.887742
-7.446398
7.486945
other
Mg8Si6
14
1
271.96
mp-1245022
10.17287
9.200031
0.189216
other
In40O60
100
1
1,524.06
mp-1100471
-2.04414
-6.046703
7.540171
other
Mg10Si12
22
1
406.95
mp-1075600
-2.473452
-5.520031
7.041242
other
Mg10Si18
28
1
541.83
mp-1245171
10.070822
12.131744
-4.238922
other
V30O75
105
1
1,821.63
mp-673681
-5.300097
-2.103364
3.054942
other
Ta22O4
26
1
442.39
mp-1100448
-2.110149
-5.816793
7.467279
other
Mg6Si8
14
1
260.88
mp-1074703
-3.62786
-8.25377
7.409873
other
Mg8Si4
12
1
246.99
mp-1075644
-2.614064
-5.385895
7.109572
other
Mg10Si18
28
1
499.91
mp-936302
-2.987908
1.50445
2.717654
other
B56C14
70
1
528.94
mp-1075198
-2.193114
-5.830613
7.41902
other
Mg6Si8
14
1
266.18
mp-684617
9.5566
8.719294
-0.448051
other
Bi6O9
15
1
271.81
mp-1074458
-2.88023
-7.473186
7.553505
other
Mg16Si12
28
1
543.39