mp_id
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38
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200
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|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
mp-1181265
|
[
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| 62
|
H2
|
general_inorganic
| false
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| null | null |
mp-1190171
|
[
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| 62
|
C
|
general_inorganic
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mp-1196857
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| 62
|
C
|
general_inorganic
| false
| null | 0.5989
| 1.60108
| 1.60108
| false
| null | null |
mp-1001113
|
[
"Si"
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[
14,
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| 63
|
Si
|
hard_negative
| false
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| true
|
[
"metallic"
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mp-1009757
|
[
"Se"
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[
34,
34,
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| 1
|
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| 63
|
Se
|
hard_negative
| false
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| true
|
[
"metallic"
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mp-1056957
|
[
"C"
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[
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| 1
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| 63
|
C
|
hard_negative
| false
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| true
|
[
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mp-1058623
|
[
"O"
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[
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|
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| 63
|
O2
|
hard_negative
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[
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mp-1095269
|
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| 63
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Si
|
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mp-1204627
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| 63
|
Si
|
general_inorganic
| false
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mp-1008394
|
[
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[
17,
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17
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[
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| 64
|
Cl2
|
general_inorganic
| false
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[
"halide"
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mp-1079020
|
[
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| 64
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Ge
|
hard_negative
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[
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mp-1079649
|
[
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14,
14,
14,
14,
14,
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| 64
|
Si
|
hard_negative
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| true
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[
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mp-1120743
|
[
"P"
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[
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| 1
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[
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| 64
|
P
|
general_inorganic
| false
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| false
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mp-1525121
|
[
"Br"
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[
35,
35,
35,
35,
35,
35,
35,
35
] | 8
| 1
|
[
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{
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| 64
|
Br
|
general_inorganic
| false
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| 0
| 0
| false
|
[
"halide"
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mp-1525632
|
[
"F"
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[
9,
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| 1
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[
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{
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| 64
|
F2
|
general_inorganic
| false
| null | 2.8979
| 0
| 0
| false
|
[
"halide"
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mp-1525634
|
[
"I"
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[
53,
53,
53,
53,
53,
53,
53,
53
] | 8
| 1
|
[
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{
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| 64
|
I
|
general_inorganic
| false
| null | 1.2444
| 0
| 0
| false
|
[
"halide"
] | null |
mp-158
|
[
"As"
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[
33,
33,
33,
33,
33,
33,
33,
33
] | 8
| 1
|
[
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{
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| 64
|
As
|
hard_negative
| false
| null | 0
| 0
| 0
| true
|
[
"metallic"
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mp-1008374
|
[
"C"
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[
6,
6,
6,
6,
6,
6,
6,
6
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| 1
|
[
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{
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| 65
|
C
|
hard_negative
| false
| null | 0
| 0.438412
| 0.438412
| true
|
[
"metallic"
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mp-1066989
|
[
"H"
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[
1,
1,
1,
1
] | 4
| 1
|
[
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{
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| 65
|
H2
|
general_inorganic
| false
| null | 6.2332
| 0.052466
| 0.052466
| false
| null | null |
mp-1078845
|
[
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[
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6,
6,
6,
6,
6,
6,
6,
6,
6,
6,
6,
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[
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Te
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| 1
|
C4O3
|
hard_negative
| false
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| 1.886345
| 0.749309
| false
|
[
"oxide"
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mp-1016063
|
[
"N",
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[
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| 2
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[
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| 1
|
CrN2
|
general_inorganic
| false
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| 0.445424
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mp-1040910
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[
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| 1
|
VO2
|
general_inorganic
| false
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| 0.205258
| -2.31721
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|
[
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mp-1044869
|
[
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| 1
|
SbO2
|
general_inorganic
| false
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| 0.170707
| -1.6683
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[
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mp-1072984
|
[
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| 1
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Mg2Si3
|
hard_negative
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mp-1073316
|
[
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[
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| 1
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MgSi2
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hard_negative
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[
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mp-1073363
|
[
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MgSi2
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mp-1073686
|
[
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| 1
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MgSi
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hard_negative
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[
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mp-1073695
|
[
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| 1
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MgSi
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hard_negative
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[
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mp-1073877
|
[
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| 1
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Mg6Si5
|
hard_negative
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[
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mp-1074003
|
[
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| 1
|
Mg9Si5
|
hard_negative
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[
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mp-1074088
|
[
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{
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| 1
|
Mg4Si7
|
hard_negative
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|
[
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mp-1074259
|
[
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Mg4Si3
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hard_negative
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mp-1074263
|
[
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Mg4Si3
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hard_negative
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mp-1074613
|
[
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Mg2Si
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mp-1074788
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Mg7Si4
|
hard_negative
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mp-1074932
|
[
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| 1
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Mg3Si4
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hard_negative
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[
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mp-1075001
|
[
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| 1
|
Mg3Si4
|
hard_negative
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[
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mp-1075360
|
[
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| 1
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Mg5Si6
|
hard_negative
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[
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mp-1075592
|
[
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Mg5Si9
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mp-1080350
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CeSe2
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mp-1096920
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[
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Cr3O5
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mp-1096928
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CrN2
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mp-1096951
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CrN2
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mp-1100929
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V11S16
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hard_negative
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[
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mp-1101121
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[
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Ti20Se19
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hard_negative
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mp-1103007
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UO11
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general_inorganic
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mp-1103897
|
[
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| 1
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ZnN6
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general_inorganic
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mp-1120811
|
[
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| 1
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Ca2O3
|
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mp-1143546
|
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LiS4
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mp-1173348
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Si5O8
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mp-1182249
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Fe3O4
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mp-1182503
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| 1
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Fe8O17
|
hard_negative
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mp-1184796
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| 1
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H3F2
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mp-1195198
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| 1
|
H3S
|
general_inorganic
| false
| null | 4.3472
| 0.010304
| -0.117762
| false
|
[
"sulfide"
] | null |
mp-1203554
|
[
"Al",
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{
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| 1
|
Al4Si19
|
hard_negative
| false
| null | 0
| 0.232257
| 0.232257
| true
|
[
"metallic"
] | null |
mp-1212508
|
[
"Mg",
"Mn"
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[
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| 2
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{
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| 1
|
Mg5Mn3
|
hard_negative
| false
| null | 0
| 0.287666
| 0.287666
| true
|
[
"metallic"
] | null |
mp-1214306
|
[
"Ca",
"In"
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[
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20,
20,
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20,
20,
20,
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49,
49,
49,
49,
49,
49
] | 22
| 2
|
[
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{
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| 1
|
Ca8In3
|
hard_negative
| false
| null | 0
| 0.000185
| -0.417406
| true
|
[
"metallic"
] | null |
mp-1214795
|
[
"I",
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[
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53,
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] | 24
| 2
|
[
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{
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}
| 1
|
BiI5
|
hard_negative
| false
| null | 0.0682
| 0.013227
| -0.497697
| false
|
[
"halide"
] | null |
mp-1215724
|
[
"Zn",
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[
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30,
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47,
47,
47,
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] | 18
| 2
|
[
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{
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| 1
|
ZnAg
|
hard_negative
| false
| null | 0
| 0.01084
| -0.024743
| true
|
[
"metallic"
] | null |
mp-1216020
|
[
"Cu",
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| 2
|
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{
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| 1
|
Zn35Cu17
|
hard_negative
| false
| null | 0
| 0
| -0.101228
| true
|
[
"metallic"
] | null |
mp-1216446
|
[
"V",
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[
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23,
23,
23,
23,
23,
23,
23,
23,
52,
52,
52,
52,
52,
52,
52,
52
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| 2
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[
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| 1
|
V9Te8
|
hard_negative
| false
| null | 0
| 0.01025
| -0.49964
| true
|
[
"metallic"
] | null |
mp-1217322
|
[
"Se",
"Te"
] |
[
52,
52,
52,
34,
34,
34
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| 2
|
[
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0.8281880021095276
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[
0.9863346815109253,
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0.49644923210144043
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{
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"gamma": 61.79864501953125
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| 1
|
TeSe
|
general_inorganic
| false
| null | 0.7062
| 0
| -0.010931
| false
| null | null |
mp-1218141
|
[
"O",
"Ta"
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[
73,
73,
8,
8,
8,
8,
8
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| 2
|
[
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0.5802890062332153,
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| 1
|
Ta2O5
|
general_inorganic
| false
| null | 2.5913
| 0.155211
| -3.191352
| false
|
[
"oxide"
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mp-1219328
|
[
"S",
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[
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16,
16,
16,
16,
16,
16,
16,
16,
16,
16,
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| 2
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[
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| 1
|
SeS7
|
general_inorganic
| false
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| 0.018885
| 0.018885
| false
|
[
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mp-1219820
|
[
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Sr21Hg109
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mp-1220657
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Nb3S5
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mp-1221884
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Mo13O33
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mp-1222233
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Mn23As16
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mp-1224298
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0.9967707395553589,
0.9980398416519165
],
[
0.001744439941830933,
0.49828386306762695,
0.0021328600123524666
],
[
0.2530975937843323,
0.23640015721321106,
0.4980541467666626
],
[
0.7378129959106445,
0.7421171069145203,
0.4968034029006958
],
[
0.9970919489860535,
0.49382200837135315,
0.494897723197937
],
[
0.5433394908905029,
0.2861047685146332,
0.32933303713798523
],
[
0.9442315697669983,
0.19316156208515167,
0.6572069525718689
],
[
0.4488016963005066,
0.7300726175308228,
0.6575972437858582
]
] |
{
"a": 7.154867172241211,
"b": 7.1635422706604,
"c": 8.865346908569336,
"alpha": 108.14617156982422,
"beta": 107.83982849121094,
"gamma": 103.24992370605469
}
| 1
|
In3Pt4
|
hard_negative
| false
| null | 0
| 0.041299
| -0.544772
| true
|
[
"metallic"
] | null |
mp-1224870
|
[
"Ga",
"Ag"
] |
[
31,
31,
31,
31,
31,
47,
47,
47,
47,
47,
47,
47,
47,
47,
47,
47,
47,
47
] | 18
| 2
|
[
[
0.7516384124755859,
0.0006242200033739209,
0.33313262462615967
],
[
0.24951398372650146,
0.9991247057914734,
0.6680634617805481
],
[
0.24677683413028717,
0.5001274943351746,
0.16496196389198303
],
[
0.9942170977592468,
0.0005361799849197268,
0.9988645911216736
],
[
0.9947461485862732,
0.4989716410636902,
0.5015639066696167
],
[
0.2548777163028717,
0.6710725426673889,
0.9886959791183472
],
[
0.25138795375823975,
0.16470938920974731,
0.4836236238479614
],
[
0.2564971446990967,
0.6487218737602234,
0.6705523729324341
],
[
0.2529149055480957,
0.14305073022842407,
0.1755675971508026
],
[
0.2563527822494507,
0.1849685162305832,
0.841026246547699
],
[
0.25434041023254395,
0.6888712644577026,
0.3404654264450073
],
[
0.749552309513092,
0.836201548576355,
0.5131205916404724
],
[
0.7456371188163757,
0.3321399390697479,
0.018086940050125122
],
[
0.7463022470474243,
0.8574436902999878,
0.824817955493927
],
[
0.7485014200210571,
0.35616159439086914,
0.3250097334384918
],
[
0.7446131706237793,
0.30595722794532776,
0.6574655771255493
],
[
0.7480357885360718,
0.8112916350364685,
0.1615440845489502
],
[
0.7540945410728455,
0.5000259280204773,
0.8334383368492126
]
] |
{
"a": 2.8888230323791504,
"b": 7.757181644439697,
"c": 13.365811347961426,
"alpha": 89.99647521972656,
"beta": 89.93986511230469,
"gamma": 89.93214416503906
}
| 1
|
Ga5Ag13
|
hard_negative
| false
| null | 0
| 0.014018
| -0.002919
| true
|
[
"metallic"
] | null |
mp-1225980
|
[
"Cu",
"Sn"
] |
[
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50,
50
] | 35
| 2
|
[
[
0.7577400207519531,
0.3122130036354065,
0.19176100194454193
],
[
0.255838006734848,
0.18789400160312653,
0.8102329969406128
],
[
0.24680200219154358,
0.6872940063476562,
0.8120800256729126
],
[
0.7462639808654785,
0.8136469721794128,
0.1899780035018921
],
[
0.26995599269866943,
0.44485899806022644,
0.059602998197078705
],
[
0.7766090035438538,
0.057739000767469406,
0.9422370195388794
],
[
0.7232850193977356,
0.5569859743118286,
0.9436410069465637
],
[
0.22669699788093567,
0.9407449960708618,
0.05853300169110298
],
[
0.22804300487041473,
0.1872429996728897,
0.3158639967441559
],
[
0.7236890196800232,
0.31751200556755066,
0.6865450143814087
],
[
0.7754499912261963,
0.8146759867668152,
0.681518018245697
],
[
0.2687470018863678,
0.6824949979782104,
0.31441399455070496
],
[
0.7436800003051758,
0.0673149973154068,
0.43018901348114014
],
[
0.24840900301933289,
0.43108999729156494,
0.5664950013160706
],
[
0.2559269964694977,
0.9308620095252991,
0.5686089992523193
],
[
0.7548649907112122,
0.5679410099983215,
0.43053001165390015
],
[
0.0918319970369339,
0.9377319812774658,
0.8092330098152161
],
[
0.4093939960002899,
0.43758800625801086,
0.8121690154075623
],
[
0.9083369970321655,
0.06298699975013733,
0.19059500098228455
],
[
0.09570199996232986,
0.2149209976196289,
0.06927700340747833
],
[
0.5934489965438843,
0.2932240068912506,
0.9417960047721863
],
[
0.9058129787445068,
0.7847729921340942,
0.9299589991569519
],
[
0.41335898637771606,
0.7104030251502991,
0.07662399858236313
],
[
0.5515949726104736,
0.06259000301361084,
0.182437002658844
],
[
0.05336900055408478,
0.43667998909950256,
0.8165199756622314
],
[
0.44892799854278564,
0.9385010004043579,
0.8157820105552673
],
[
0.9281129837036133,
0.5624420046806335,
0.18322299420833588
],
[
0.5883470177650452,
0.8188740015029907,
0.44289499521255493
],
[
0.0915440022945404,
0.6678540110588074,
0.5440679788589478
],
[
0.41245898604393005,
0.16901500523090363,
0.545091986656189
],
[
0.9102299809455872,
0.331838995218277,
0.45694899559020996
],
[
0.08525899797677994,
0.9221550226211548,
0.3223089873790741
],
[
0.5837090015411377,
0.5771880149841309,
0.676967978477478
],
[
0.9117680191993713,
0.07817699760198593,
0.6781960129737854
],
[
0.42469099164009094,
0.43064799904823303,
0.31377899646759033
]
] |
{
"a": 7.548664093017578,
"b": 9.776530265808105,
"c": 9.792879104614258,
"alpha": 116.54956817626953,
"beta": 90.17546844482422,
"gamma": 90.32568359375
}
| 1
|
Cu19Sn16
|
hard_negative
| false
| null | 0
| 0.016393
| 0.016393
| true
|
[
"metallic"
] | null |
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