mp_ID
stringlengths
4
10
x
float64
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17.7
y
float64
-12.01
23.9
z
float64
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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-1072474
-4.164985
-4.05262
-3.739209
other
Tm2Se4
6
129
132.69
mp-2707
-5.786333
-3.995713
1.124663
other
U2Sb4
6
129
167.35
mp-19921
9.672185
8.096579
-1.338149
other
Pb2O2
4
129
84.14
mp-1232271
-2.658278
-2.672083
-5.635058
other
Pm2S4
6
129
127.15
mp-569679
-5.061506
-2.90148
-4.208546
other
Zn2Se2
4
129
102.43
mp-1018954
-4.618711
-2.355146
-2.406843
other
Pu2Se4
6
129
142.85
mp-1825
-6.086154
-4.425533
0.922803
other
Cu4Sb2
6
129
96.87
mp-1019091
-4.141417
-3.993738
-3.647917
other
La2Se4
6
129
155.21
mp-21149
6.924291
8.607418
-1.14515
other
Gd2O4
6
129
73.57
mp-1018675
-2.746545
-2.529916
-5.715792
other
Dy2S4
6
129
117.67
mp-20560
-3.006247
-3.436427
-3.617158
other
Ce2S2
4
129
163.89
mp-20552
-6.12988
-1.339065
2.28771
other
Cr4As2
6
129
80.2
mp-1019324
-5.855474
-3.7105
-1.434971
other
Tb2Te4
6
129
176.44
mp-1018793
-4.157759
-4.06047
-3.726035
other
Lu2Se4
6
129
130.35
mp-20215
-2.816892
-3.061699
-4.631926
other
La2S2
4
129
176.07
mp-11239
-5.854013
-3.929545
3.755309
other
Zr2Ag2
4
129
80.06
mp-557835
8.365149
1.502055
0.896042
other
Tl2F2
4
129
84.69
mp-2097
11.146376
9.168095
0.416352
other
Sn2O2
4
129
71.08
mp-1232897
0.310837
2.140404
2.195273
other
Cr4N4
8
129
71.1
mp-1018707
-4.173
-4.030871
-3.685294
other
Gd2Se4
6
129
140.49
mp-7859
-3.791312
-2.720443
-2.97846
other
Zr2S2
4
129
72.07
mp-1067475
-7.200257
-2.204492
3.311795
other
Ti2Ni2
4
129
53.12
mp-19867
-5.03053
-3.888242
0.263475
other
Np2As4
6
129
131.12
mp-1076964
-5.791777
-3.658945
-1.504386
other
Gd2Te4
6
129
178.63
mp-604915
-5.800736
-1.851701
0.135993
other
Cr2Se2
4
129
78.78
mp-13152
-4.73804
-1.515458
-2.593858
other
Ti2Se2
4
129
104.48
mp-999295
2.175858
1.748876
1.830235
other
Pr2N2
4
129
73.79
mp-7487
9.18971
8.911296
1.682205
other
Ba2O2
4
129
89.5
mp-571033
-5.633622
-1.718355
-3.365098
other
Ni2Se2
4
129
72.63
mp-2394167
0.026791
2.064669
2.409128
other
V2N2
4
129
35.15
mp-725294
-0.976177
2.197483
-3.183025
other
Te2I14
16
129
964.99
mp-1018940
-4.044466
-4.202326
-3.801333
other
Pr2Se4
6
129
151.43
mp-9978
-4.132088
-4.104421
-3.683222
other
Er2Se4
6
129
133.76
mp-973750
-5.834696
-3.638898
-1.529079
other
Lu2Te4
6
129
169.95
mp-1323
9.096713
0.962262
1.121856
other
Al16F48
64
129
775.88
mp-569765
-6.142956
-5.826043
0.791808
other
In2Bi2
4
129
122.18
mp-2078
-7.668456
-3.978921
3.716147
other
Ti2Cu2
4
129
56.46
mp-1007755
-8.20579
-5.730859
3.348836
other
Hf2Au2
4
129
76.71
mp-1232273
-2.848017
-2.523196
-5.590817
other
Sm2S4
6
129
125.5
mp-413
-4.655657
-3.779902
0.953677
original
U2P4
6
129
113.28
mp-849092
-3.318953
-0.387827
-4.608725
other
Ni2S4
6
129
105.42
mp-7698
-2.821333
-2.595424
-5.706387
other
Nd2S4
6
129
129.97
mp-1147643
6.782591
4.075018
-3.397862
other
C2S2
4
129
52.44
mp-7097
-5.171319
-4.113931
0.601786
other
Th2As4
6
129
145.1
mp-1064119
1.708777
2.36838
0.251547
other
K2N2
4
129
97.68
mp-1072274
-0.375074
0.566417
-0.088743
other
K2C4
6
129
143.07
mp-1078595
2.952871
-0.292557
-1.902997
other
H8W2
10
129
66.15
mp-21273
-6.275199
-2.02669
-1.164746
other
Fe2Te2
4
129
87.08
mp-23313
-6.124467
-5.867693
0.723328
other
In2Bi2
4
129
125.94
mp-1017985
-5.657921
-3.388376
3.850491
other
Ti2Ag2
4
129
68.58
mp-1019253
-4.171818
-4.106833
-3.672359
other
Sm2Se4
6
129
143.8
mp-1273331
13.075891
10.974428
0.406246
other
V4O4
8
129
86.11
mp-1077459
-5.960611
-3.579763
-1.68434
other
Yb2Te4
6
129
182.06
mp-27757
-4.956149
-1.001768
4.190494
other
Be8B2
10
129
78.96
mp-1077033
-4.49955
-3.71994
-3.673301
other
Yb2Se4
6
129
140.68
mp-1023130
8.033007
10.871424
-0.694467
other
Cu8O6
14
129
153.84
mp-13156
-6.006585
-4.106321
3.964378
other
Hf2Ag2
4
129
76.95
mp-1076966
-3.155321
-2.12582
-5.025823
other
Yb2S4
6
129
119.03
mp-19443
10.671283
11.139967
-3.058821
other
W2O6
8
129
111.85
mp-1232036
-4.65424
-2.575555
-3.811297
other
In2Se4
6
129
146.03
mp-1018049
2.170574
1.795909
1.803425
other
La2N2
4
129
74.66
mp-580226
-5.468704
-2.996051
-4.192797
other
Cu2Se2
4
129
77.48
mp-2550
-5.828633
-3.759697
-1.409472
other
Nd2Te4
6
129
186.9
mp-8936
-4.495697
-3.016968
-4.122701
other
Sn2Se2
4
129
201.83
mp-1017540
-5.985466
-4.224188
3.768634
other
Zr2Cd2
4
129
87.35
mp-571335
-6.181861
-5.099803
1.125106
other
Th2Bi4
6
129
193.95
mp-1025077
-4.125717
-4.17215
-3.697932
other
Tb2Se4
6
129
138.04
mp-1019093
-4.222395
-4.017023
0.780474
other
Pa2P4
6
129
117.25
mp-1018792
-2.828969
-2.571087
-5.818953
other
Lu2S4
6
129
111.19
mp-1019107
-5.522364
-3.244476
-0.630988
other
Pu2Te4
6
129
181.17
mp-639690
-4.12348
-2.131349
-3.348101
other
Pu2S4
6
129
122.67
mp-22917
-0.491572
1.59915
-4.501836
other
Cu2Br2
4
129
89.78
mp-1329
-5.887156
-3.715799
-1.337463
other
La8Te16
24
129
775.58
mp-505536
-5.56586
-3.730931
-1.252167
other
Ce2Te4
6
129
184.01
mp-1018683
-4.176701
-4.1306
-3.698814
other
Dy2Se4
6
129
136.65
mp-1071777
-5.636084
-5.811144
4.811728
other
Sr2Al4
6
129
157.56
mp-1212113
3.025385
2.787981
-3.557306
other
I8N12
20
129
935.91
mp-1232214
-4.101193
-4.07047
-3.71305
other
Y2Se4
6
129
137.76
mp-1232117
-3.418597
-1.784961
-5.319672
other
Eu2S4
6
129
130.57
mp-726332
6.209699
3.712111
-3.523521
other
S2N2
4
129
48.21
mp-1018663
-2.959074
-2.506259
-4.998009
other
Ce2S4
6
129
127.72
mp-1018727
-2.806498
-2.492456
-5.741854
other
Ho2S4
6
129
116.34
mp-7135
-2.683157
-2.597339
-5.728973
other
Tb2S4
6
129
119.18
mp-30500
-5.653783
-3.33457
3.838386
other
Ti2Cd2
4
129
75.19
mp-1077482
2.766513
-0.399507
-1.724236
other
Ti2H4
6
129
41.25
mp-7568
-5.858881
-4.435709
1.000563
other
Th2Sb4
6
129
178.81
mp-20311
-5.385696
-2.157999
-3.425612
other
Fe2Se2
4
129
90.61
mp-1232230
-4.648644
-3.266167
-3.646439
other
Eu2Se4
6
129
148.85
mp-1147746
-5.455004
-0.88975
-4.059114
other
Co2S2
4
129
65.81
mp-22863
-1.262887
2.56705
-3.235973
other
Cu2I2
4
129
109.6
mp-21335
-5.459738
-3.681828
0.020784
other
U2Te4
6
129
183.32
mp-558947
15.631722
5.638496
0.361316
other
Si48O96
144
129
2,882.12
mp-1018880
-5.849453
-4.410117
1.193249
other
Pa2Sb4
6
129
164.54
mp-11106
-4.947964
-4.001588
0.369385
other
Pa2As4
6
129
131.18
mp-975652
-5.79153
-3.725209
-1.468589
other
Pr2Te4
6
129
189.77
mp-1071948
-2.720622
-2.6398
-5.738625
other
Tm2S4
6
129
113.52
mp-1657
-5.142687
-3.618052
0.573041
other
U2As4
6
129
131.15
mp-1018687
-2.802002
-2.632829
-5.671264
original
Er2S4
6
129
114.78
mp-20426
-6.696567
-0.596597
2.300516
other
Fe4As2
6
129
77.97
mp-1077365
-5.841552
-3.697488
-1.447518
other
Y2Te4
6
129
176.34