mp_id stringlengths 4 38 | elements listlengths 1 10 | atomic_numbers listlengths 1 200 | num_atoms int32 1 200 | num_elements int32 1 10 | fractional_coords listlengths 1 200 | lattice dict | spacegroup_number int32 0 230 | reduced_formula stringlengths 1 24 | tier stringclasses 3 values | is_li_containing bool 2 classes | num_li_atoms int32 0 104 ⌀ | band_gap float32 0 17.9 ⌀ | energy_above_hull float32 0 9.71 ⌀ | formation_energy_per_atom float32 -5.15 8.99 ⌀ | is_metal bool 2 classes | source_tags listlengths 1 5 ⌀ | source stringclasses 4 values |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
tar:NOMAD_QIQc01E-cHhBEiSW1arJku_FQAib | [
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tar:OQMD_435874 | [
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} | 225 | PrTm2Pt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_au63yvsLcozdRMLhSal75ZluXuaC | [
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} | 225 | Tm2TcRh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_dsKGIXw6NuJCh_oaMT-KEQNMQJNx | [
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} | 225 | RbTm2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_435923 | [
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} | 225 | DyTm2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_K9L-MFa5aJ7dhzONkO_3ruP6XlBI | [
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} | 225 | LiSmTm2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:NOMAD_Ts-9gLoOsxRxPjVYY6eNmw6gTEBh | [
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} | 225 | YTm2Cd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_435972 | [
"Li",
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} | 225 | LiTm2Ge | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_436010 | [
"Y",
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} | 225 | YTm2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_jyoQ-mRvgnFyNPvU_kVL-AGqRIbR | [
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} | 225 | Tm2CrPt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_tZnnxzl8BtFvnvbWkO35RaIZ2XWD | [
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} | 225 | Tm2ReNi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436056 | [
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"alpha": 90,
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} | 225 | YbTm2Mn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_wxNna9WKTUViP9iKc7U2TKpDr9NN | [
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} | 225 | Tm2TaB | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_FLDKzFNmwzVzxejCMDLK8yNi5PsO | [
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} | 225 | Tm2ThPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436096 | [
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tar:OQMD_436110 | [
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tar:OQMD_436135 | [
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tar:OQMD_436146 | [
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tar:NOMAD_9DsSK8p3O7ywlMeoZyqa-rgCg9iu | [
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tar:OQMD_436178 | [
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tar:NOMAD_yg_f2qV_zn70hxqG330rbKmJfgkk | [
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tar:OQMD_436221 | [
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tar:OQMD_436233 | [
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tar:OQMD_436249 | [
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tar:NOMAD_uWd0CdncXHra8SRKEBXqZm-nYFHu | [
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tar:OQMD_436278 | [
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tar:OQMD_436298 | [
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tar:NOMAD_3cb95nllpwdaIaYf9xcZShqmQus4 | [
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tar:OQMD_436351 | [
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tar:NOMAD_Nl0wifrfKr0-aWLhTJ29f7uElGso | [
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tar:NOMAD_OcB3mfmw05xDdMwwtydPwgcmRp1j | [
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tar:OQMD_436399 | [
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tar:OQMD_436415 | [
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tar:OQMD_436428 | [
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tar:OQMD_436443 | [
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tar:OQMD_436458 | [
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tar:OQMD_436475 | [
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tar:OQMD_436488 | [
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tar:OQMD_436528 | [
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tar:NOMAD_vMV2RNufaiiXHy6JcVntpw7hRFqN | [
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tar:NOMAD_mN5FZqsWadRlODlMIkXBjt6ZhjGg | [
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tar:NOMAD_zArYZJVcpranHBTW8IGsFKY4vVD4 | [
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tar:NOMAD_Nwv6a6KneN5KtKkMiFMLiLpsnbzZ | [
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tar:NOMAD_74yglx2q3DSDJZ6tpN75GSS34xzx | [
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tar:OQMD_436754 | [
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tar:OQMD_436769 | [
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tar:NOMAD_inVMldTN2ASKuyp9vwlm_tf4nW-f | [
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tar:NOMAD_g-x7sd11wQuiEdreZB5Qj2y9ihH_ | [
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} | 225 | Tm2TaRe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_EAF8jec97H1SSmWTwqlS7Dtad5dq | [
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} | 225 | Tm2UFe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436843 | [
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} | 225 | Tm2RePb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_oby0gcPcy-rD2GA1AIt6wz2Tj4dy | [
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} | 225 | KTm2Al | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD__RFl18ccMQUW_5MEISGwAsXxkooE | [
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} | 225 | ErTm2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_MLdJUDr-xjaQp9S1camhUGI7GocN | [
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} | 225 | TbPrTm2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436906 | [
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28,
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"alpha": 90,
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} | 225 | Tm2NiMo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436920 | [
"Nb",
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69,
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} | 225 | Tm2NbSb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Z3QgbAyiI2TRvNfgOpSbyQTvan_T | [
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"alpha": 90,
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} | 225 | NdEuTm2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436956 | [
"Pd",
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"Ac"
] | [
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69,
69,
69,
69,
69,
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"alpha": 90,
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} | 225 | AcTm2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_436971 | [
"Al",
"Zr",
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] | [
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69,
69,
69,
69,
40,
40,
40,
40,
13,
13,
13,
13
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"alpha": 90,
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} | 225 | Tm2ZrAl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_6mUzRpaNBQcrF6EMttg-9WGrkyRG | [
"Ru",
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] | [
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62,
69,
69,
69,
69,
69,
69,
69,
69,
44,
44,
44,
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"alpha": 90,
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} | 225 | SmTm2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437004 | [
"Zn",
"Tm",
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] | [
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89,
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89,
69,
69,
69,
69,
69,
69,
69,
69,
30,
30,
30,
30
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | AcTm2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_MJgHgaLJFVIG_EpOaNHaciwETeXL | [
"Sb",
"Ho",
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] | [
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67,
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67,
69,
69,
69,
69,
69,
69,
69,
69,
51,
51,
51,
51
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | HoTm2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437029 | [
"Na",
"Tm",
"Hf"
] | [
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11,
11,
11,
69,
69,
69,
69,
69,
69,
69,
69,
72,
72,
72,
72
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] | {
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"alpha": 90,
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} | 225 | NaTm2Hf | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437046 | [
"Rb",
"Tm",
"Os"
] | [
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tar:OQMD_437095 | [
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tar:NOMAD_CaJKUIPwrFksHX4rqjd2-SuJDsYZ | [
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tar:NOMAD_yufgVDv3m0ALQGCAteS_CqxQojhJ | [
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tar:OQMD_437153 | [
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tar:NOMAD__v-JlWEMQjWHo13ae8B1jbQOpEmU | [
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tar:NOMAD_zHTeBmFOKWq8_eA_U3gtZUmzSQMP | [
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tar:OQMD_437202 | [
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tar:OQMD_437215 | [
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tar:OQMD_437226 | [
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tar:OQMD_437258 | [
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tar:NOMAD_GD7XlgHUnRMgN0w4pnt0-pB0ONuk | [
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tar:OQMD_437290 | [
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"alpha": 90,
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} | 225 | Tm2PuNp | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437307 | [
"Tm",
"Hg",
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69,
69,
69,
69,
69,
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92,
92,
92,
80,
80,
80,
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} | 225 | Tm2UHg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_B_XFA0ZiWW-CpWcnSN8A4n0LZDeh | [
"Ce",
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58,
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62,
62,
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69,
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69,
69,
69,
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} | 225 | CeSmTm2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437341 | [
"B",
"Na",
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11,
11,
11,
69,
69,
69,
69,
69,
69,
69,
69,
5,
5,
5,
5
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"alpha": 90,
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} | 225 | NaTm2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Sr4Fi9H43BLtIwJGCnGPiCqw8WhC | [
"B",
"Tm",
"U"
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69,
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69,
69,
69,
69,
69,
92,
92,
92,
92,
5,
5,
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"alpha": 90,
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} | 225 | Tm2UB | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_y5I8GIVS6ZK4scdjx7ceyMK5UcKV | [
"Ce",
"Nd",
"Tm"
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58,
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60,
60,
60,
60,
69,
69,
69,
69,
69,
69,
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"alpha": 90,
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} | 225 | CeNdTm2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_3L6PE6NbnoKxYFzN2Eme6lgcC1rU | [
"Sc",
"Nb",
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68,
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68,
68,
68,
68,
68,
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21,
21,
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41,
41,
41,
41
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | Er2ScNb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437409 | [
"K",
"Pd",
"Er"
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19,
19,
19,
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68,
68,
68,
68,
68,
68,
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46,
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"alpha": 90,
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} | 225 | KEr2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_yDsrIsOypK8h0H64ye8mUMzvmhQg | [
"Si",
"Ba",
"Er"
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56,
56,
56,
68,
68,
68,
68,
68,
68,
68,
68,
14,
14,
14,
14
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | BaEr2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_7wFgLn3Q8CoCE4XfnM4tBNBvp0su | [
"Er",
"Ta",
"Au"
] | [
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68,
68,
68,
68,
68,
68,
68,
73,
73,
73,
73,
79,
79,
79,
79
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | Er2TaAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_-J2Ed--T0-X7zvV0lWbPiJtqQwG_ | [
"Tb",
"Er",
"Pu"
] | [
65,
65,
65,
65,
68,
68,
68,
68,
68,
68,
68,
68,
94,
94,
94,
94
] | 16 | 3 | [
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[
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] | {
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"c": 7.6088175773620605,
"alpha": 90,
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} | 225 | TbEr2Pu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_YutfF1HBv3iYDj2N7-bqPOMl4x8s | [
"Tc",
"Er",
"Yb"
] | [
70,
70,
70,
70,
68,
68,
68,
68,
68,
68,
68,
68,
43,
43,
43,
43
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[
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] | {
"a": 7.1944899559021,
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"alpha": 90,
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"gamma": 90
} | 225 | YbEr2Tc | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_n6PnfHOahKinDYv8X5XnOEm7_043 | [
"Pd",
"Er",
"Yb"
] | [
70,
70,
70,
70,
68,
68,
68,
68,
68,
68,
68,
68,
46,
46,
46,
46
] | 16 | 3 | [
[
0,
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0
],
[
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[
0.5,
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[
0.5,
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0.5
]
] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbEr2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_437516 | [
"Ni",
"Er",
"Th"
] | [
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68,
68,
68,
68,
68,
68,
68,
90,
90,
90,
90,
28,
28,
28,
28
] | 16 | 3 | [
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[
0.5,
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[
0.5,
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]
] | {
"a": 7.286622047424316,
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"alpha": 90,
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"gamma": 90
} | 225 | Er2ThNi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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