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external_cif_tar
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tar:OQMD_550631
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tar:NOMAD_92ggHsK5gGHsHTF9-Ax4TcLGmAnx
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Gd2CuAg
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tar:OQMD_550745
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Gd2LuTa
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external_cif_tar
|
tar:NOMAD_Wdd_JAVRnzs3uz5xLDzH_BhVDJyT
|
[
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|
Gd2PuTl
|
general_inorganic
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external_cif_tar
|
tar:OQMD_550772
|
[
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Gd2SiRh
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general_inorganic
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external_cif_tar
|
tar:OQMD_550787
|
[
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SrTc2Pb
|
general_inorganic
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external_cif_tar
|
tar:OQMD_550804
|
[
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BaGaTc2
|
general_inorganic
| false
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external_cif_tar
|
tar:OQMD_550836
|
[
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| 225
|
AlTc2Ni
|
general_inorganic
| false
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external_cif_tar
|
tar:OQMD_550852
|
[
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43,
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KGaTc2
|
general_inorganic
| false
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external_cif_tar
|
tar:OQMD_550864
|
[
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| 225
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ThTc2Ge
|
general_inorganic
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external_cif_tar
|
tar:OQMD_550878
|
[
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| 225
|
BeTc2Au
|
general_inorganic
| false
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external_cif_tar
|
tar:NOMAD_qBxU7dTQSrKV3xc-2dzc2I5QeOYK
|
[
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| 225
|
NpVTc2
|
general_inorganic
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external_cif_tar
|
tar:NOMAD_UyOHXEhgnQi09RU5u1fTw6LGkzGF
|
[
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| 225
|
PmMgTc2
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:OQMD_550914
|
[
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| 225
|
PuTc2Au
|
general_inorganic
| false
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external_cif_tar
|
tar:OQMD_550931
|
[
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| 225
|
PaCuTc2
|
general_inorganic
| false
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external_cif_tar
|
tar:NOMAD_-USynaWuj0eIlKlanXTm0DrpbKLz
|
[
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| 225
|
AcYbTc2
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:OQMD_550959
|
[
"Tc",
"Te",
"W"
] |
[
43,
43,
43,
43,
43,
43,
43,
43,
52,
52,
52,
52,
74,
74,
74,
74
] | 16
| 3
|
[
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
[
0.75,
0.75,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.75,
0.25,
0.25
],
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
]
] |
{
"a": 6.405223846435547,
"b": 6.405223846435547,
"c": 6.405223846435547,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
Tc2TeW
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:NOMAD_h9jxdRSyKh-muXO4MkamZRcmLZgJ
|
[
"As",
"Tc",
"Ac"
] |
[
89,
89,
89,
89,
43,
43,
43,
43,
43,
43,
43,
43,
33,
33,
33,
33
] | 16
| 3
|
[
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
[
0.75,
0.75,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.75,
0.25,
0.25
],
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
]
] |
{
"a": 6.691799640655518,
"b": 6.691799640655518,
"c": 6.691799640655518,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
AcTc2As
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:OQMD_551002
|
[
"V",
"Mo",
"Tc"
] |
[
23,
23,
23,
23,
43,
43,
43,
43,
43,
43,
43,
43,
42,
42,
42,
42
] | 16
| 3
|
[
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
0,
0.5
],
[
0,
0.5,
0
],
[
0.5,
0,
0
],
[
0.5,
0.5,
0.5
]
] |
{
"a": 6.1294941902160645,
"b": 6.1294941902160645,
"c": 6.1294941902160645,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
VTc2Mo
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:NOMAD_kRFjJb1CN-E0MUBhz5G9lq5Oa1wN
|
[
"Li",
"Tc",
"Pr"
] |
[
3,
3,
3,
3,
59,
59,
59,
59,
43,
43,
43,
43,
43,
43,
43,
43
] | 16
| 3
|
[
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
[
0.75,
0.75,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.75,
0.25,
0.25
]
] |
{
"a": 6.576905250549316,
"b": 6.576905250549316,
"c": 6.576905250549316,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
LiPrTc2
|
general_inorganic
| true
| 4
| null | null | null | null |
[
"li"
] |
external_cif_tar
|
tar:OQMD_551027
|
[
"B",
"Tc",
"Re"
] |
[
75,
75,
75,
75,
43,
43,
43,
43,
43,
43,
43,
43,
5,
5,
5,
5
] | 16
| 3
|
[
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
0,
0.5
],
[
0,
0.5,
0
],
[
0.5,
0,
0
],
[
0.5,
0.5,
0.5
]
] |
{
"a": 5.926258087158203,
"b": 5.926258087158203,
"c": 5.926258087158203,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
ReTc2B
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
tar:NOMAD_67Qc9jLb-aPPS6jcgRI1nJOgCpab
|
[
"Tc",
"Gd",
"Au"
] |
[
64,
64,
64,
64,
43,
43,
43,
43,
43,
43,
43,
43,
79,
79,
79,
79
] | 16
| 3
|
[
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
0,
0.5
],
[
0,
0.5,
0
],
[
0.5,
0,
0
],
[
0.5,
0.5,
0.5
]
] |
{
"a": 6.561141490936279,
"b": 6.561141490936279,
"c": 6.561141490936279,
"alpha": 90,
"beta": 90,
"gamma": 90
}
| 225
|
GdTc2Au
|
general_inorganic
| false
| null | null | null | null | null | null |
external_cif_tar
|
pad-1
|
[
"H"
] |
[
1
] | 1
| 1
|
[
[
0.47476160526275635,
0.18412825465202332,
0.2761788070201874
]
] |
{
"a": 1.9360198974609375,
"b": 1.294816255569458,
"c": 1.0858712196350098,
"alpha": 90.59869384765625,
"beta": 90.56759643554688,
"gamma": 90.02159881591797
}
| 1
|
H
|
hard_negative
| false
| 0
| null | null | null | null | null |
padding
|
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