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{
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{
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"structure_string": "Rh8 Se12\n1.0\n6.401120 0.000000 0.000000\n0.000000 6.528961 0.000000\n0.000000 0.000000 9.028515\nRh Se\n8 12\ndirect\n0.748233 0.532482 0.107647 Rh\n0.751767 0.032482 0.392353 Rh\n0.751767 0.467518 0.607647 Rh\n0.748233 0.967518 0.892353 Rh\n0.251767 0.467518 0.892353 Rh\n0.248233 0.967518 0.607647 Rh\n0.248233 0.532482 0.392353 Rh\n0.251767 0.032482 0.107647 Rh\n0.609707 0.894619 0.151496 Se\n0.890293 0.394619 0.348504 Se\n0.890293 0.105381 0.651496 Se\n0.609707 0.605381 0.848504 Se\n0.390293 0.105381 0.848504 Se\n0.109707 0.605381 0.651496 Se\n0.109707 0.894619 0.348504 Se\n0.390293 0.394619 0.151496 Se\n0.044690 0.750000 0.000000 Se\n0.455310 0.250000 0.500000 Se\n0.955310 0.250000 0.000000 Se\n0.544690 0.750000 0.500000 Se\n",
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{
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"created_at": "2022-09-04T14:42:47.266515Z",
"structure_string": "Dy10 Si6 C2\n1.0\n8.464290 0.000000 0.000000\n-4.232145 7.330290 0.000000\n0.000000 0.000000 6.382430\nDy Si C\n10 6 2\ndirect\n0.666667 0.333333 0.000000 Dy\n0.333333 0.666667 0.000000 Dy\n0.333333 0.666667 0.500000 Dy\n0.666667 0.333333 0.500000 Dy\n0.776003 0.776003 0.750000 Dy\n0.223997 0.000000 0.750000 Dy\n0.000000 0.223997 0.750000 Dy\n0.223997 0.223997 0.250000 Dy\n0.776003 0.000000 0.250000 Dy\n0.000000 0.776003 0.250000 Dy\n0.407167 0.407167 0.750000 Si\n0.592833 0.000000 0.750000 Si\n0.000000 0.592833 0.750000 Si\n0.592833 0.592833 0.250000 Si\n0.407167 0.000000 0.250000 Si\n0.000000 0.407167 0.250000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
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{
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"created_at": "2022-09-04T14:48:14.816977Z",
"structure_string": "Sm4 Ge8 Ir4\n1.0\n-2.174565 4.496688 8.124273\n2.174565 -4.496688 8.124273\n2.174565 4.496688 -8.124273\nSm Ge Ir\n4 8 4\ndirect\n0.260319 0.000000 0.260319 Sm\n0.739681 0.000000 0.739681 Sm\n0.293709 0.793709 0.500000 Sm\n0.706291 0.206291 0.500000 Sm\n0.921561 0.421561 0.500000 Ge\n0.078439 0.578439 0.500000 Ge\n0.422654 0.422654 0.000000 Ge\n0.577346 0.577346 0.000000 Ge\n0.046216 0.199686 0.846530 Ge\n0.953784 0.800314 0.153470 Ge\n0.353155 0.199686 0.153470 Ge\n0.646845 0.800314 0.846530 Ge\n0.102435 0.353669 0.748766 Ir\n0.897565 0.646330 0.251234 Ir\n0.604904 0.353669 0.251234 Ir\n0.395096 0.646331 0.748766 Ir\n",
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{
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"structure_string": "Tb4 Al6 Ge8\n1.0\n3.015433 -7.422893 0.000000\n3.015433 7.422893 0.000000\n0.000000 0.000000 7.915692\nTb Al Ge\n4 6 8\ndirect\n0.113768 0.886232 0.417527 Tb\n0.886232 0.113768 0.582473 Tb\n0.386232 0.613768 0.917527 Tb\n0.613768 0.386232 0.082473 Tb\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.032698 0.467302 0.250000 Al\n0.467302 0.032698 0.750000 Al\n0.967302 0.532698 0.750000 Al\n0.532698 0.967302 0.250000 Al\n0.203321 0.296679 0.250000 Ge\n0.296679 0.203321 0.750000 Ge\n0.796679 0.703321 0.750000 Ge\n0.703321 0.796679 0.250000 Ge\n0.184676 0.815324 0.050966 Ge\n0.815324 0.184676 0.949034 Ge\n0.315324 0.684676 0.550966 Ge\n0.684676 0.315324 0.449034 Ge\n",
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{
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{
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{
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{
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"structure_string": "Ti6 Si6 Os6\n1.0\n-3.252966 3.554537 5.619534\n3.252966 -3.554537 5.619534\n3.252966 3.554537 -5.619534\nTi Si Os\n6 6 6\ndirect\n0.447472 0.403999 0.456527 Ti\n0.552528 0.009054 0.956527 Ti\n0.027465 0.005557 0.478092 Ti\n0.972535 0.450627 0.978092 Ti\n0.246764 0.580611 0.833847 Ti\n0.753236 0.587083 0.333847 Ti\n0.217831 0.960772 0.242941 Si\n0.782169 0.025110 0.742941 Si\n0.173067 0.671915 0.510340 Si\n0.826933 0.337273 0.498848 Si\n0.661574 0.671915 0.998848 Si\n0.338426 0.337273 0.010340 Si\n0.000000 0.255084 0.255084 Os\n0.500000 0.255084 0.755084 Os\n0.408982 0.749886 0.412417 Os\n0.591018 0.003435 0.340904 Os\n0.837469 0.749886 0.840904 Os\n0.162531 0.003435 0.912417 Os\n",
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"formula_full": "Ti6 Si6 Os6",
"formula_reduced": "TiSiOs",
"formula_anonymous": "ABC",
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"updated_at": "2021-11-28T01:35:41.191000Z",
"spacegroup": 46
},
{
"id": "mp-1105652",
"created_at": "2022-09-04T14:40:58.686763Z",
"structure_string": "Yb1 Co4 P12\n1.0\n-3.885065 3.885065 3.885065\n3.885065 -3.885065 3.885065\n3.885065 3.885065 -3.885065\nYb Co P\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Yb\n0.000000 0.000000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.353440 0.205050 0.851610 P\n0.646560 0.794950 0.148390 P\n0.646560 0.498170 0.851610 P\n0.353440 0.501830 0.148390 P\n0.205050 0.851610 0.353440 P\n0.794950 0.148390 0.646560 P\n0.498170 0.851610 0.646560 P\n0.501830 0.148390 0.353440 P\n0.851610 0.353440 0.205050 P\n0.148390 0.646560 0.794950 P\n0.851610 0.646560 0.498170 P\n0.148390 0.353440 0.501830 P\n",
"nsites": 17,
"nelements": 3,
"elements": [
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"Co",
"P"
],
"chemical_system": "Co-P-Yb",
"density": 5.525145670891629,
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"volume": 234.56048941247062,
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"formula_full": "Yb1 Co4 P12",
"formula_reduced": "Yb(CoP3)4",
"formula_anonymous": "AB4C12",
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"updated_at": "2021-11-28T01:35:10.901000Z",
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}
]
}