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{
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"results": [
{
"id": "mp-972985",
"created_at": "2022-09-04T14:48:13.041618Z",
"structure_string": "K1 Pd1 O3\n1.0\n4.070076 0.000000 0.000000\n0.000000 4.070076 0.000000\n0.000000 0.000000 4.070076\nK Pd O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
"id": "mp-1208029",
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"nsites": 24,
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"formula_full": "Tm16 Mg4 Ni4",
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"updated_at": "2021-11-28T01:38:29.487000Z",
"spacegroup": 216
},
{
"id": "mp-13396",
"created_at": "2022-09-04T14:48:13.047239Z",
"structure_string": "Li1 In2 Rh1\n1.0\n0.000000 3.267368 3.267368\n3.267368 0.000000 3.267368\n3.267368 3.267368 0.000000\nLi In Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750000 In\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 4,
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"elements": [
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],
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"density": 8.08057637686047,
"density_atomic": 0.05733711561591685,
"volume": 69.76283960279291,
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"formula_full": "Li1 In2 Rh1",
"formula_reduced": "LiIn2Rh",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:38:41.601000Z",
"spacegroup": 225
},
{
"id": "mp-1096757",
"created_at": "2022-09-04T14:48:13.056931Z",
"structure_string": "Nb1 Cr2 Re1\n1.0\n-4.750416 5.276229 7.346045\n4.750416 -5.276229 7.346045\n4.750416 5.276229 -7.346045\nNb Cr Re\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.254656 0.254656 Cr\n0.000000 0.745344 0.745344 Cr\n0.000000 0.500000 0.500000 Re\n",
"nsites": 4,
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"elements": [
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"Cr",
"Re"
],
"chemical_system": "Cr-Nb-Re",
"density": 0.8637712001476487,
"density_atomic": 0.005431141727062172,
"volume": 736.4933932894605,
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"formula_full": "Nb1 Cr2 Re1",
"formula_reduced": "NbCr2Re",
"formula_anonymous": "ABC2",
"energy": -25.6261835,
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"updated_at": "2021-11-28T01:38:39.229000Z",
"spacegroup": 71
},
{
"id": "mp-753247",
"created_at": "2022-09-04T14:48:13.697356Z",
"structure_string": "Li2 Mn2 F10\n1.0\n5.287044 -0.163075 -0.177237\n2.483087 5.035767 -0.183910\n-0.318954 2.712299 6.591819\nLi Mn F\n2 2 10\ndirect\n0.322632 0.292869 0.760590 Li\n0.677368 0.707131 0.239410 Li\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.132429 0.008266 0.255986 F\n0.213994 0.163866 0.554859 F\n0.009555 0.665548 0.127010 F\n0.300590 0.653862 0.629631 F\n0.625758 0.167979 0.006770 F\n0.867571 0.991734 0.744014 F\n0.374242 0.832021 0.993230 F\n0.699410 0.346138 0.370369 F\n0.990445 0.334452 0.872990 F\n0.786006 0.836134 0.445141 F\n",
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"elements": [
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"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 2.9052937455957557,
"density_atomic": 0.07807215330697663,
"volume": 179.3212996822638,
"volume_molar": 7.7135579139481125,
"formula_full": "Li2 Mn2 F10",
"formula_reduced": "LiMnF5",
"formula_anonymous": "ABC5",
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"updated_at": "2021-11-28T01:38:41.496000Z",
"spacegroup": 2
},
{
"id": "mp-26539",
"created_at": "2022-09-04T14:48:13.074118Z",
"structure_string": "Li6 V2 P4 O16\n1.0\n8.865731 0.000000 0.000000\n0.000000 4.932362 0.000000\n0.000000 4.445713 6.484609\nLi V P O\n6 2 4 16\ndirect\n0.138771 0.323755 0.690133 Li\n0.500000 0.000000 0.000000 Li\n0.638771 0.676245 0.809867 Li\n0.000000 0.000000 0.500000 Li\n0.361229 0.323755 0.190133 Li\n0.861229 0.676245 0.309867 Li\n0.500000 0.500000 0.500000 V\n0.000000 0.500000 0.000000 V\n0.181463 0.808211 0.220279 P\n0.681463 0.191789 0.279721 P\n0.318537 0.808211 0.720279 P\n0.818537 0.191789 0.779721 P\n0.856419 0.474450 0.808332 O\n0.097972 0.744910 0.408369 O\n0.356419 0.525550 0.691668 O\n0.133575 0.146627 0.021966 O\n0.355838 0.826085 0.245299 O\n0.633575 0.853373 0.478034 O\n0.597972 0.255090 0.091631 O\n0.855838 0.173915 0.254701 O\n0.644162 0.173915 0.754701 O\n0.402028 0.744910 0.908369 O\n0.366425 0.146627 0.521966 O\n0.143581 0.525550 0.191668 O\n0.866425 0.853373 0.978034 O\n0.643581 0.474450 0.308332 O\n0.902028 0.255090 0.591631 O\n0.144162 0.826085 0.745299 O\n",
"nsites": 28,
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"elements": [
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"V",
"P",
"O"
],
"chemical_system": "Li-O-P-V",
"density": 3.065077894884214,
"density_atomic": 0.09874264205114351,
"volume": 283.5654325058212,
"volume_molar": 6.098824818644053,
"formula_full": "Li6 V2 P4 O16",
"formula_reduced": "Li3V(PO4)2",
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"energy": -206.19134169,
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"updated_at": "2021-11-28T01:38:30.390000Z",
"spacegroup": 14
},
{
"id": "mp-680293",
"created_at": "2022-09-04T14:48:13.515669Z",
"structure_string": "Gd6 Co58 Si8 B20\n1.0\n7.816726 0.000000 0.000000\n0.000000 11.152074 0.000000\n0.000000 0.000000 11.152074\nGd Co Si B\n6 58 8 20\ndirect\n0.000000 0.500000 0.000000 Gd\n0.500000 0.750000 0.250000 Gd\n0.500000 0.250000 0.750000 Gd\n0.000000 0.500000 0.500000 Gd\n0.000000 0.000000 0.500000 Gd\n0.000000 0.000000 0.000000 Gd\n0.697507 0.140035 0.140035 Co\n0.888258 0.860022 0.250000 Co\n0.663900 0.575479 0.088652 Co\n0.249735 0.364264 0.135736 Co\n0.697507 0.359965 0.140035 Co\n0.111742 0.750000 0.139978 Co\n0.888258 0.250000 0.860022 Co\n0.030212 0.750000 0.914892 Co\n0.249735 0.364264 0.364264 Co\n0.336100 0.075479 0.588652 Co\n0.527157 0.750000 0.522558 Co\n0.302493 0.640035 0.859965 Co\n0.336100 0.911348 0.424521 Co\n0.302493 0.640035 0.640035 Co\n0.527157 0.750000 0.977442 Co\n0.336100 0.075479 0.911348 Co\n0.472843 0.250000 0.022558 Co\n0.532251 0.750000 0.750000 Co\n0.030212 0.750000 0.585108 Co\n0.888258 0.250000 0.639978 Co\n0.472843 0.250000 0.477442 Co\n0.336100 0.588652 0.075479 Co\n0.111742 0.139978 0.750000 Co\n0.663900 0.088652 0.924521 Co\n0.663900 0.088652 0.575479 Co\n0.249735 0.135736 0.135736 Co\n0.663900 0.924521 0.411348 Co\n0.697507 0.140035 0.359965 Co\n0.336100 0.424521 0.588652 Co\n0.249735 0.135736 0.364264 Co\n0.663900 0.924521 0.088652 Co\n0.302493 0.859965 0.640035 Co\n0.888258 0.639978 0.250000 Co\n0.969788 0.250000 0.085108 Co\n0.472843 0.022558 0.250000 Co\n0.527157 0.977442 0.750000 Co\n0.663900 0.411348 0.924521 Co\n0.969788 0.414892 0.250000 Co\n0.750265 0.635736 0.864264 Co\n0.750265 0.864264 0.864264 Co\n0.750265 0.864264 0.635736 Co\n0.111742 0.750000 0.360022 Co\n0.750265 0.635736 0.635736 Co\n0.111742 0.360022 0.750000 Co\n0.663900 0.575479 0.411348 Co\n0.030212 0.914892 0.750000 Co\n0.030212 0.585108 0.750000 Co\n0.663900 0.411348 0.575479 Co\n0.969788 0.250000 0.414892 Co\n0.697507 0.359965 0.359965 Co\n0.472843 0.477442 0.250000 Co\n0.302493 0.859965 0.859965 Co\n0.467749 0.250000 0.250000 Co\n0.336100 0.588652 0.424521 Co\n0.336100 0.911348 0.075479 Co\n0.336100 0.424521 0.911348 Co\n0.969788 0.085108 0.250000 Co\n0.527157 0.522558 0.750000 Co\n0.825088 0.750000 0.431399 Si\n0.825088 0.750000 0.068601 Si\n0.825088 0.431399 0.750000 Si\n0.174912 0.250000 0.568601 Si\n0.174912 0.931399 0.250000 Si\n0.825088 0.068601 0.750000 Si\n0.174912 0.568601 0.250000 Si\n0.174912 0.250000 0.931399 Si\n0.481217 0.436318 0.063682 B\n0.101067 0.250000 0.250000 B\n0.736471 0.505779 0.250000 B\n0.481217 0.063682 0.436318 B\n0.848714 0.250000 0.250000 B\n0.518783 0.563682 0.936318 B\n0.518783 0.563682 0.563682 B\n0.518783 0.936318 0.936318 B\n0.263529 0.750000 0.494221 B\n0.898933 0.750000 0.750000 B\n0.736471 0.250000 0.994221 B\n0.151286 0.750000 0.750000 B\n0.481217 0.436318 0.436318 B\n0.736471 0.250000 0.505779 B\n0.263529 0.005779 0.750000 B\n0.481217 0.063682 0.063682 B\n0.263529 0.494221 0.750000 B\n0.263529 0.750000 0.005779 B\n0.736471 0.994221 0.250000 B\n0.518783 0.936318 0.563682 B\n",
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"elements": [
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"density": 8.20319334103718,
"density_atomic": 0.09463497100120571,
"volume": 972.1564768993046,
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"formula_full": "Gd6 Co58 Si8 B20",
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"energy": -711.27330328,
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"updated_at": "2021-11-28T01:38:37.782000Z",
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}
]
}