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{
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"results": [
{
"id": "mp-1205761",
"created_at": "2022-09-04T14:42:29.585149Z",
"structure_string": "K2 Pd1 Br6\n1.0\n0.000000 5.292235 5.292235\n5.292235 0.000000 5.292235\n5.292235 5.292235 0.000000\nK Pd Br\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Pd\n0.763057 0.236943 0.236943 Br\n0.236943 0.763057 0.763057 Br\n0.236943 0.763057 0.236943 Br\n0.763057 0.236943 0.763057 Br\n0.236943 0.236943 0.763057 Br\n0.763057 0.763057 0.236943 Br\n",
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{
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{
"id": "mp-979258",
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"structure_string": "Tm2 Cd1 Hg1\n1.0\n0.000000 3.692220 3.692220\n3.692220 0.000000 3.692220\n3.692220 3.692220 0.000000\nTm Cd Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tm\n0.750000 0.750000 0.750000 Tm\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Hg\n",
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"volume": 100.66829358865807,
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"formula_full": "Tm2 Cd1 Hg1",
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"updated_at": "2021-11-28T01:36:09.522000Z",
"spacegroup": 225
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{
"id": "mp-1185305",
"created_at": "2022-09-04T14:42:38.196629Z",
"structure_string": "Li1 Ge1 Pt2\n1.0\n0.000000 3.048606 3.048606\n3.048606 0.000000 3.048606\n3.048606 3.048606 0.000000\nLi Ge Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Ge\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Pt\n",
"nsites": 4,
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"elements": [
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"volume": 56.66747944580106,
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"formula_full": "Li1 Ge1 Pt2",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:52.043000Z",
"spacegroup": 225
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{
"id": "mp-867111",
"created_at": "2022-09-04T14:42:37.919138Z",
"structure_string": "Li1 Dy2 Ru1\n1.0\n0.000000 3.472603 3.472603\n3.472603 0.000000 3.472603\n3.472603 3.472603 0.000000\nLi Dy Ru\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.750000 0.750000 0.750000 Dy\n0.250000 0.250000 0.250000 Dy\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
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"elements": [
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"density": 8.585243602785699,
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"volume": 83.75204187965319,
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"formula_full": "Li1 Dy2 Ru1",
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"updated_at": "2021-11-28T01:36:03.702000Z",
"spacegroup": 225
},
{
"id": "mp-1188021",
"created_at": "2022-09-04T14:42:38.240011Z",
"structure_string": "Zr1 Ga1 Rh2\n1.0\n0.000000 3.178910 3.178910\n3.178910 0.000000 3.178910\n3.178910 3.178910 0.000000\nZr Ga Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500000 Ga\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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"chemical_system": "Ga-Rh-Zr",
"density": 9.479032231796092,
"density_atomic": 0.062258019062357235,
"volume": 64.24875157035795,
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"formula_full": "Zr1 Ga1 Rh2",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:51.761000Z",
"spacegroup": 225
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{
"id": "mp-20988",
"created_at": "2022-09-04T14:42:38.943206Z",
"structure_string": "Cs2 Li1 Cr1 C6 N6\n1.0\n0.000000 5.437481 5.437481\n5.437481 0.000000 5.437481\n5.437481 5.437481 0.000000\nCs Li Cr C N\n2 1 1 6 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Cr\n0.812664 0.812664 0.187336 C\n0.187336 0.187336 0.812664 C\n0.812664 0.187336 0.812664 C\n0.187336 0.812664 0.187336 C\n0.187336 0.812664 0.812664 C\n0.812664 0.187336 0.187336 C\n0.704541 0.704541 0.295459 N\n0.704541 0.295459 0.704541 N\n0.295459 0.295459 0.704541 N\n0.295459 0.704541 0.295459 N\n0.295459 0.704541 0.704541 N\n0.704541 0.295459 0.295459 N\n",
"nsites": 16,
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"elements": [
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"C",
"N"
],
"chemical_system": "C-Cr-Cs-Li-N",
"density": 2.4833483029793872,
"density_atomic": 0.04976187428369353,
"volume": 321.53129741021513,
"volume_molar": 12.10191707343587,
"formula_full": "Cs2 Li1 Cr1 C6 N6",
"formula_reduced": "Cs2LiCr(CN)6",
"formula_anonymous": "ABC2D6E6",
"energy": -123.15181885,
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"updated_at": "2021-11-28T01:35:48.276000Z",
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{
"id": "mp-973893",
"created_at": "2022-09-04T14:42:38.404415Z",
"structure_string": "Lu2 Tl1 Hg1\n1.0\n0.000000 3.697003 3.697003\n3.697003 0.000000 3.697003\n3.697003 3.697003 0.000000\nLu Tl Hg\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Lu\n0.250000 0.250000 0.250000 Lu\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
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"density": 12.404044564609801,
"density_atomic": 0.03958043716742836,
"volume": 101.06002576676164,
"volume_molar": 15.214942509416638,
"formula_full": "Lu2 Tl1 Hg1",
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"updated_at": "2021-11-28T01:35:53.275000Z",
"spacegroup": 225
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{
"id": "mp-865761",
"created_at": "2022-09-04T14:42:38.866148Z",
"structure_string": "Th1 Zn1 Rh2\n1.0\n0.000000 3.341245 3.341245\n3.341245 0.000000 3.341245\n3.341245 3.341245 0.000000\nTh Zn Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Th\n0.000000 0.000000 0.000000 Zn\n0.750000 0.750000 0.750000 Rh\n0.250000 0.250000 0.250000 Rh\n",
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"density": 11.201724192644287,
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"volume": 74.60277139836056,
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"formula_full": "Th1 Zn1 Rh2",
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"updated_at": "2021-11-28T01:36:06.574000Z",
"spacegroup": 225
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{
"id": "mp-1185546",
"created_at": "2022-09-04T14:42:38.626290Z",
"structure_string": "Cs1 Rb2 Bi1\n1.0\n0.000000 4.613744 4.613744\n4.613744 0.000000 4.613744\n4.613744 4.613744 0.000000\nCs Rb Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Bi\n",
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"volume": 196.42215700440903,
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{
"id": "mp-1066751",
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"structure_string": "Sr2 U1 Mn1\n1.0\n0.000000 4.085617 4.085617\n4.085617 0.000000 4.085617\n4.085617 4.085617 0.000000\nSr U Mn\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.500000 Mn\n",
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"formula_full": "Sr2 U1 Mn1",
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{
"id": "mp-1113327",
"created_at": "2022-09-04T14:42:38.867495Z",
"structure_string": "Cs1 Rb2 Y1 Cl6\n1.0\n0.000000 5.906454 5.906454\n5.906454 0.000000 5.906454\n5.906454 5.906454 0.000000\nCs Rb Y Cl\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 Cs\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.776363 0.223637 0.223637 Cl\n0.223637 0.223637 0.776363 Cl\n0.223637 0.776363 0.776363 Cl\n0.223637 0.776363 0.223637 Cl\n0.776363 0.223637 0.776363 Cl\n0.776363 0.776363 0.223637 Cl\n",
"nsites": 10,
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"volume": 412.1074575333778,
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"formula_full": "Cs1 Rb2 Y1 Cl6",
"formula_reduced": "CsRb2YCl6",
"formula_anonymous": "ABC2D6",
"energy": -44.65259031000001,
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}
]
}