mp_ID
stringlengths
8
14
x
float64
-9.59
15.2
y
float64
-10.97
15.1
z
float64
-7.56
7.54
type
stringclasses
1 value
generated_from
stringlengths
4
10
formula
stringlengths
2
24
n_atoms
int64
2
20
spacegroup
int64
1
229
volume
float64
28.2
1.03k
gen-mp-51
-6.052322
-6.89369
3.356263
generated
mp-51
Li5
5
156
98.49
gen-mp-390
10.515253
11.543884
2.825311
generated
mp-390
Ti3O8Th1
12
1
175.32
gen-mp-648
-3.545357
-1.900718
-5.34344
generated
mp-648
Na5S3
8
8
203.1
gen-mp-936
-7.190967
-7.415613
1.904783
generated
mp-936
Hg4Pt1
5
8
134.6
gen-mp-123
-7.107475
-6.889364
7.29872
generated
mp-123
Nd18
18
6
656.91
gen-mp-372
-8.029392
-2.813179
2.620934
generated
mp-372
Pt6V1
7
38
117.24
gen-mp-402
-3.46971
-3.974339
0.579898
generated
mp-402
P15Th1Cd2
18
1
370.51
gen-mp-582
-8.508615
-2.852828
4.229145
generated
mp-582
Ce1Ir6Th1
8
6
155.29
gen-mp-261
-5.776211
-5.897607
4.42975
generated
mp-261
Ba2Al4
6
1
156.04
gen-mp-72
-5.414316
-3.108
3.789735
generated
mp-72
Ti10
10
99
174.6
gen-mp-291
-6.937433
-1.797892
4.384644
generated
mp-291
Ti4Os5
9
8
136.09
gen-mp-279
-7.937757
-2.108106
3.884584
generated
mp-279
Li5Ir11Tc4
20
25
281.43
gen-mp-374
-5.466802
0.412965
3.164016
generated
mp-374
B2Cr2
4
194
35.85
gen-mp-430
12.860942
10.555639
1.919595
generated
mp-430
Ti2O3
5
160
56.76
gen-mp-481
-8.097544
-4.118508
2.92198
generated
mp-481
Ne1Pt2Pa1
4
38
69.93
gen-mp-215
-6.383294
-5.211034
2.29568
generated
mp-215
Y5Sb5
10
1
301.11
gen-mp-971
8.173491
8.502459
-0.386977
generated
mp-971
K9O6Th1
16
8
524.49
gen-mp-828
-7.69702
-1.489345
2.625522
generated
mp-828
Si3Ni9
12
123
130.86
gen-mp-743
3.75677
3.02116
-2.87858
generated
mp-743
Rb3N12Ac1
16
1
305.16
gen-mp-284
-7.729271
-1.563135
4.458254
generated
mp-284
U1Al3Co4
8
99
112.48
gen-mp-635
-5.254419
-4.996818
2.059653
generated
mp-635
Tc1U1Rh7Sc1
10
8
229.95
gen-mp-763
-3.484635
1.64264
2.920741
generated
mp-763
Mg3B6Pa1
10
6
111.91
gen-mp-342
-5.687298
-4.199242
-0.920517
generated
mp-342
Sm4Te3P1
8
8
239.5
gen-mp-45
-6.631521
-7.227634
6.901767
generated
mp-45
Ac1Pm2Th1
4
8
174.35
gen-mp-58
-3.938324
-7.134478
2.257708
generated
mp-58
K9Th1
10
8
508.06
gen-mp-922
-7.587292
-2.160968
3.124141
generated
mp-922
Tc2Pt4
6
8
88.91
gen-mp-162
-5.929411
-7.256362
4.353876
generated
mp-162
Yb4
4
164
158.41
gen-mp-50
-5.623033
-3.31601
3.941053
generated
mp-50
Th3Ta12Re1Mn1Tc1
18
1
389.02
gen-mp-449
-6.451586
-0.661991
3.999627
generated
mp-449
Fe7Lu1Si6Os2
16
156
193.58
gen-mp-447
-9.133469
-6.39155
3.981759
generated
mp-447
Tm2Au2
4
8
90.42
gen-mp-358
-5.918235
-3.471307
-2.091466
generated
mp-358
Te7Hg4
11
8
397.6
gen-mp-306
13.250185
4.530843
-2.618888
generated
mp-306
B7Cu1O12
20
1
202.28
gen-mp-830
2.505734
2.24787
1.858184
generated
mp-830
Ga4N5Si1
10
1
129.48
gen-mp-870
4.218866
2.72211
-3.091264
generated
mp-870
Tl3N6In1
10
1
240
gen-mp-578
-7.78722
-6.421779
2.469449
generated
mp-578
Ga2Ag2
4
8
71.45
gen-mp-1105368
-0.633379
1.201211
-4.106704
generated
mp-1105368
Br8Al1Nb1
10
1
518.51
gen-mp-11572
-6.132696
-2.080609
4.092388
generated
mp-11572
Ta2Tc1
3
5
50.47
gen-mp-976843
-5.661421
-7.210824
3.554587
generated
mp-976843
Li5Mg3
8
8
164.05
gen-mp-1184137
-7.995743
-6.584803
5.746322
generated
mp-1184137
In2Tm1Dy1
4
8
108.85
gen-mp-1112570
8.475316
1.499996
1.75085
generated
mp-1112570
Cs1Ga1F2
4
6
93.71
gen-mp-22394
2.435339
2.404101
1.699242
generated
mp-22394
Ru1F1Th4N2C1
9
1
175.2
gen-mp-560071
8.949034
2.0774
1.234562
generated
mp-560071
Tc2Rb2F8
12
1
226.97
gen-mp-1112502
1.585287
2.668253
-5.849377
generated
mp-1112502
Cl5Cs2As1
8
1
305.3
gen-mp-1206862
-7.629568
-4.759194
5.066485
generated
mp-1206862
Ce2Np1Ga4Ni3
10
6
185.77
gen-mp-1105690
5.473641
10.567924
-2.394312
generated
mp-1105690
Cu1Fe1O4
6
6
66.49
gen-mp-1077378
-3.836782
-3.878505
0.856983
generated
mp-1077378
Cs2Mn2P2
6
1
165.94
gen-mp-1178360
8.901283
8.57553
1.192759
generated
mp-1178360
O11Dy3In4
18
8
252.11
gen-mp-989633
1.068887
2.48685
1.619999
generated
mp-989633
N9La3W2
14
1
268.27
gen-mp-30938
-2.517591
-0.238461
-4.642208
generated
mp-30938
S4
4
1
124.12
gen-mp-1220149
-8.54215
-0.420535
4.278517
generated
mp-1220149
Nd1Co7
8
8
99.48
gen-mp-1078192
-6.09154
-6.925086
3.083886
generated
mp-1078192
Eu3Sb1
4
44
125.07
gen-mp-1080785
-6.646364
-5.413711
5.923836
generated
mp-1080785
Th6Al4Rh2
12
6
286.61
gen-mp-28591
-3.465936
-4.753712
0.85958
generated
mp-28591
Na4P2
6
8
153.88
gen-mp-1025200
12.451432
8.928829
2.13032
generated
mp-1025200
U1O5Ti1Th1Eu1Pa1
10
8
139.08
gen-mp-15781
-3.004847
-2.063853
-5.537519
generated
mp-15781
S3K1La1
5
1
137.21
gen-mp-14289
-3.457965
-4.298056
0.739657
generated
mp-14289
Ba1P2
3
44
89.7
gen-mp-677242
10.077332
4.839368
-5.877036
generated
mp-677242
K4O8S4
16
1
295.02
gen-mp-978547
-7.149242
-5.897002
5.378463
generated
mp-978547
In7Sm1Pa7Y1Pm2Ru1Th1
20
6
529.7
gen-mp-1226425
-7.031432
-0.594946
2.538596
generated
mp-1226425
Fe3As1
4
8
46.55
gen-mp-30630
-6.354272
-7.340302
2.578955
generated
mp-30630
Eu1Tl4
5
156
169.04
gen-mp-1210651
-7.912067
-6.134758
6.284339
generated
mp-1210651
Lu5Ni2U1
8
1
196.96
gen-mp-1018687
-3.011885
-3.855537
-3.198586
generated
mp-1018687
Pm1Er1S2
4
8
83.38
gen-mp-13240
-9.268627
-4.926771
4.283325
generated
mp-13240
Pa1Cu6In1Th1
9
6
171.24
gen-mp-779599
12.188974
8.857251
2.597172
generated
mp-779599
Dy2Ti5O4Pu6U1
18
1
365.95
gen-mp-1223393
12.273598
9.815395
0.216781
generated
mp-1223393
Rb1W1O1F1
4
99
76.33
gen-mp-1841
-7.58201
-2.311092
4.368064
generated
mp-1841
Ir4Si2
6
6
89.35
gen-mp-1039019
-6.762166
-3.585181
5.323801
generated
mp-1039019
Al3U1
4
8
83.25
gen-mp-1217924
-3.860728
-0.308672
2.900631
generated
mp-1217924
Nb3Ta3C5
11
8
132.93
gen-mp-18942
14.315999
8.167492
-4.134011
generated
mp-18942
O8U1P2V1
12
8
162.71
gen-mp-989591
1.882007
2.776619
-4.331795
generated
mp-989591
Cl8Br2Np1
11
1
292.78
gen-mp-865078
-7.31976
-7.377497
6.436523
generated
mp-865078
Gd5Mg4
9
1
257.2
gen-mp-5808
-5.915706
-3.803181
-1.689072
generated
mp-5808
Nd2Rb3Te5
10
1
410.9
gen-mp-673682
-3.256205
-3.532383
-3.458128
generated
mp-673682
S5Yb2U2Tb1
10
8
215.16
gen-mp-22512
11.731664
9.438793
0.665384
generated
mp-22512
O4In4
8
156
135.89
gen-mp-1247026
-3.866229
-1.382258
-4.913939
generated
mp-1247026
Cr2S9U2Mg1
14
1
296.53
gen-mp-1189895
-5.578361
-2.064098
3.91054
generated
mp-1189895
Ta2Ge2
4
6
66.48
gen-mp-1216748
-5.695332
1.238026
-4.623503
generated
mp-1216748
Mo2S2Se1
5
164
93.48
gen-mp-1077443
-6.376083
-6.47466
6.372313
generated
mp-1077443
Th6Nd3Os1
10
8
383.88
gen-mp-28405
7.150808
5.612478
-2.961502
generated
mp-28405
O3U2Cl5S3Ga1N1
15
1
342.36
gen-mp-1227737
11.371254
8.738045
2.296476
generated
mp-1227737
Ca1Ge1Nd1O5U1
9
8
151.63
gen-mp-6145
7.220471
8.38434
-0.623422
generated
mp-6145
Ba1O3Lu1
5
1
80.4
gen-mp-642795
8.189483
2.569577
-1.086699
generated
mp-642795
S2P4F4
10
1
205.5
gen-mp-11184
-8.196862
-3.479883
2.588198
generated
mp-11184
Nd3Pt8Sb1
12
8
246.93
gen-mp-1205683
1.509587
2.637271
-5.930918
generated
mp-1205683
Cl12Cs4Cr2K2
20
1
687.54
gen-mp-758560
13.125722
0.385664
0.916098
generated
mp-758560
Fe6O6F6
18
1
220.69
gen-mp-1186262
-6.920912
-6.949892
7.337688
generated
mp-1186262
Nd2Y2Pm1
5
8
169.06
gen-mp-1078712
-4.223298
-1.650143
3.46029
generated
mp-1078712
Hf3C1
4
8
71.7
gen-mp-19138
5.868566
11.220068
-0.472913
generated
mp-19138
Ba1O3Ni1
5
1
59.16
gen-mp-18063
-6.663142
-6.385983
2.652842
generated
mp-18063
Sn3Sr1
4
8
118.92
gen-mp-1184060
-7.488978
-6.602515
6.965781
generated
mp-1184060
Dy5Al1
6
1
167.88
gen-mp-1101819
-7.749022
0.935508
5.219149
generated
mp-1101819
Fe6Dy1
7
5
94.27
gen-mp-2796
-8.488068
-7.019212
3.866072
generated
mp-2796
Ag7Tm4
11
1
253.1
gen-mp-41191
12.473894
6.781274
-6.492982
generated
mp-41191
P2O8Na1U1
12
1
155.87
gen-mp-1111936
8.339718
1.328311
0.603891
generated
mp-1111936
K2F4Ir1
7
44
139.45
gen-mp-630866
11.475152
10.412963
0.537859
generated
mp-630866
Fe3O8Pb3Zn1Sm1
16
1
226.42
gen-mp-1027483
-6.568894
1.48092
-4.0298
generated
mp-1027483
Mo4Se7S1
12
8
260.08
gen-mp-1213079
8.664828
5.68154
-2.834179
generated
mp-1213079
O2Rb1S1
4
8
94.59
gen-mp-1078876
-8.280779
-5.721015
6.030178
generated
mp-1078876
Th1Ir1Er1
3
44
79.36
gen-mp-30027
1.427216
2.517632
-5.62897
generated
mp-30027
Rb2Cl6Cr2
10
1
286.98
gen-mp-22400
-5.373451
-2.783468
-4.224577
generated
mp-22400
Se4Cu3Mn1Sn1
9
1
197.38