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{
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"results": [
{
"id": "mp-1026879",
"created_at": "2022-09-04T14:42:57.326325Z",
"structure_string": "Rb1 Mg14 Cu1\n1.0\n6.525158 0.081060 0.000000\n-3.192379 5.529362 0.000000\n0.000000 0.000000 10.643955\nRb Mg Cu\n1 14 1\ndirect\n0.164560 0.832280 0.125000 Rb\n0.161961 0.330980 0.625000 Mg\n0.166249 0.833124 0.625000 Mg\n0.659912 0.339406 0.125000 Mg\n0.664433 0.329089 0.625000 Mg\n0.659912 0.820505 0.125000 Mg\n0.664433 0.835342 0.625000 Mg\n0.339256 0.178808 0.387881 Mg\n0.339256 0.178808 0.862119 Mg\n0.339256 0.660449 0.387881 Mg\n0.339256 0.660449 0.862119 Mg\n0.843740 0.171870 0.360755 Mg\n0.843740 0.171870 0.889245 Mg\n0.823787 0.661894 0.392875 Mg\n0.823787 0.661894 0.857125 Mg\n0.166465 0.333232 0.125000 Cu\n",
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{
"id": "mp-1016279",
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"structure_string": "Mg7 Zn1\n1.0\n3.148341 -5.453087 0.000000\n3.148341 5.453087 0.000000\n0.000000 0.000000 5.059987\nMg Zn\n7 1\ndirect\n0.998862 0.499431 0.500000 Mg\n0.500569 0.499431 0.500000 Mg\n0.500569 0.001138 0.500000 Mg\n0.164076 0.328152 0.000000 Mg\n0.164076 0.835924 0.000000 Mg\n0.671848 0.835924 0.000000 Mg\n0.666667 0.333333 0.000000 Mg\n0.000000 0.000000 0.500000 Zn\n",
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"density": 2.251218012499969,
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"volume": 173.74150869949818,
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"formula_full": "Mg7 Zn1",
"formula_reduced": "Mg7Zn",
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"updated_at": "2021-11-28T01:38:06.198000Z",
"spacegroup": 187
},
{
"id": "mp-1099110",
"created_at": "2022-09-04T14:39:30.105502Z",
"structure_string": "Na1 Ca1 Mg6\n1.0\n3.317672 -5.788705 0.000000\n3.317672 5.788705 0.000000\n0.000000 0.000000 5.434896\nNa Ca Mg\n1 1 6\ndirect\n0.335073 0.664927 0.500000 Na\n0.165387 0.834613 0.000000 Ca\n0.168649 0.333558 0.000000 Mg\n0.666442 0.831351 0.000000 Mg\n0.665582 0.334418 0.000000 Mg\n0.333581 0.167784 0.500000 Mg\n0.832216 0.666419 0.500000 Mg\n0.833071 0.166929 0.500000 Mg\n",
"nsites": 8,
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"elements": [
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"Ca",
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],
"chemical_system": "Ca-Mg-Na",
"density": 1.6616777350117393,
"density_atomic": 0.03832250485372663,
"volume": 208.7546216129463,
"volume_molar": 15.714371445671262,
"formula_full": "Na1 Ca1 Mg6",
"formula_reduced": "NaCaMg6",
"formula_anonymous": "ABC6",
"energy": -12.46022309,
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"updated_at": "2021-11-28T01:34:23.797000Z",
"spacegroup": 38
},
{
"id": "mp-1096200",
"created_at": "2022-09-04T14:41:01.875578Z",
"structure_string": "Ba2 Hg1 Pd1\n1.0\n-6.330984 6.524784 9.746266\n6.330984 -6.524784 9.746266\n6.330984 6.524784 -9.746266\nBa Hg Pd\n2 1 1\ndirect\n0.000000 0.224251 0.224251 Ba\n0.000000 0.775749 0.775749 Ba\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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],
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"density": 0.5997712946931879,
"density_atomic": 0.0024838443924313806,
"volume": 1610.4068403755712,
"volume_molar": 242.45241684021354,
"formula_full": "Ba2 Hg1 Pd1",
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"formula_anonymous": "ABC2",
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"spacegroup": 71
},
{
"id": "mp-1022622",
"created_at": "2022-09-04T14:45:20.672488Z",
"structure_string": "Ba1 Mg6 Zn1\n1.0\n3.054925 -7.163102 0.000000\n3.054925 7.163102 0.000000\n0.000000 0.000000 5.021025\nBa Mg Zn\n1 6 1\ndirect\n0.292766 0.707234 0.500000 Ba\n0.323414 0.197660 0.500000 Mg\n0.802340 0.676586 0.500000 Mg\n0.174348 0.318860 0.000000 Mg\n0.681140 0.825652 0.000000 Mg\n0.702847 0.297153 0.000000 Mg\n0.125142 0.874858 0.000000 Mg\n0.898012 0.101988 0.500000 Zn\n",
"nsites": 8,
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"elements": [
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"density": 2.633965321301342,
"density_atomic": 0.036405409425628234,
"volume": 219.74756296431755,
"volume_molar": 16.541884447976038,
"formula_full": "Ba1 Mg6 Zn1",
"formula_reduced": "BaMg6Zn",
"formula_anonymous": "ABC6",
"energy": -12.46880533,
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"updated_at": "2021-11-28T01:37:02.613000Z",
"spacegroup": 38
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{
"id": "mp-2545",
"created_at": "2022-09-04T14:48:27.659646Z",
"structure_string": "Yb1 Hg1\n1.0\n3.754500 0.000000 0.000000\n0.000000 3.754500 0.000000\n0.000000 0.000000 3.754500\nYb Hg\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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"Hg"
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"chemical_system": "Hg-Yb",
"density": 11.722885182234823,
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"volume": 52.92444665362501,
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"formula_full": "Yb1 Hg1",
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"formula_anonymous": "AB",
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"energy_above_hull": null,
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"is_magnetic": false,
"total_magnetization": 1.1e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:17.650000Z",
"spacegroup": 221
},
{
"id": "mp-1977763",
"created_at": "2022-09-04T14:43:22.206173Z",
"structure_string": "Ba1\n1.0\n-3.605539 0.000000 0.000000\n0.000000 0.000000 -3.996080\n0.000000 -4.003220 0.000000\nBa\n1\ndirect\n0.500000 0.500000 0.500000 Ba\n",
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"elements": [
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"density_atomic": 0.01733748788681752,
"volume": 57.678482980244524,
"volume_molar": 34.73479433302968,
"formula_full": "Ba1",
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"formula_anonymous": "A",
"energy": -1.5597617,
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"updated_at": "2021-11-28T01:36:15.445000Z",
"spacegroup": 123
},
{
"id": "mp-975509",
"created_at": "2022-09-04T14:42:07.712714Z",
"structure_string": "Rb1 Ba3\n1.0\n-3.202505 3.202505 6.796472\n3.202505 -3.202505 6.796472\n3.202505 3.202505 -6.796472\nRb Ba\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.750000 0.250000 0.500000 Ba\n0.250000 0.750000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n",
"nsites": 4,
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"density_atomic": 0.014346198480078771,
"volume": 278.8195078685428,
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"formula_full": "Rb1 Ba3",
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"updated_at": "2021-11-28T01:35:41.365000Z",
"spacegroup": 139
},
{
"id": "mp-1186123",
"created_at": "2022-09-04T14:42:13.807602Z",
"structure_string": "Na1 Cd2 Ag1\n1.0\n0.000000 3.520544 3.520544\n3.520544 0.000000 3.520544\n3.520544 3.520544 0.000000\nNa Cd Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
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"updated_at": "2021-11-28T01:35:49.895000Z",
"spacegroup": 225
},
{
"id": "mp-1021281",
"created_at": "2022-09-04T14:45:16.259546Z",
"structure_string": "Na2 Li2 Mg12\n1.0\n5.282849 0.000000 0.000000\n0.000000 6.390030 0.000000\n0.000000 0.000000 11.177664\nNa Li Mg\n2 2 12\ndirect\n0.500000 0.500000 0.166733 Na\n0.500000 0.000000 0.666733 Na\n0.500000 0.000000 0.166651 Li\n0.500000 0.500000 0.666651 Li\n0.500000 0.250153 0.416747 Mg\n0.500000 0.749847 0.416747 Mg\n0.000000 0.752647 0.082981 Mg\n0.000000 0.247353 0.082981 Mg\n0.000000 0.000000 0.332674 Mg\n0.000000 0.500000 0.334482 Mg\n0.500000 0.750153 0.916747 Mg\n0.500000 0.249847 0.916747 Mg\n0.000000 0.252647 0.582981 Mg\n0.000000 0.747353 0.582981 Mg\n0.000000 0.500000 0.832674 Mg\n0.000000 0.000000 0.834482 Mg\n",
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"formula_full": "Na2 Li2 Mg12",
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{
"id": "mp-1248475",
"created_at": "2022-09-04T14:44:11.421100Z",
"structure_string": "Cs1 Mg6 Al1\n1.0\n9.220094 1.809750 0.000000\n-3.042758 5.270210 0.000000\n0.000000 0.000000 5.121055\nCs Mg Al\n1 6 1\ndirect\n0.079769 0.789884 0.250000 Cs\n0.637594 0.314360 0.250000 Mg\n0.637594 0.823233 0.250000 Mg\n0.407774 0.205384 0.750000 Mg\n0.407774 0.702392 0.750000 Mg\n0.743201 0.121601 0.750000 Mg\n0.717474 0.608738 0.750000 Mg\n0.368820 0.434410 0.250000 Al\n",
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"formula_full": "Cs1 Mg6 Al1",
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"updated_at": "2021-11-28T01:36:26.404000Z",
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{
"id": "mp-1093783",
"created_at": "2022-09-04T14:47:20.745711Z",
"structure_string": "Na1 Tl2 Au1\n1.0\n-5.804320 6.469479 9.139282\n5.804320 -6.469479 9.139282\n5.804320 6.469479 -9.139282\nNa Tl Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.266472 0.266472 Tl\n0.000000 0.733528 0.733528 Tl\n0.000000 0.500000 0.500000 Au\n",
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"volume": 1372.7540210692014,
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"formula_full": "Na1 Tl2 Au1",
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"updated_at": "2021-11-28T01:38:01.495000Z",
"spacegroup": 71
}
]
}