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{
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"results": [
{
"id": "mp-1028290",
"created_at": "2022-09-04T14:39:07.243988Z",
"structure_string": "Rb1 Mg14 Sn1\n1.0\n6.542465 -0.073010 0.000000\n-3.334461 5.775455 0.000000\n0.000000 0.000000 10.648900\nRb Mg Sn\n1 14 1\ndirect\n0.168767 0.834383 0.125000 Rb\n0.164769 0.332384 0.625000 Mg\n0.168408 0.834204 0.625000 Mg\n0.665296 0.338371 0.125000 Mg\n0.669179 0.331711 0.625000 Mg\n0.665296 0.826924 0.125000 Mg\n0.669179 0.837468 0.625000 Mg\n0.335137 0.176517 0.388151 Mg\n0.335137 0.176517 0.861849 Mg\n0.335137 0.658621 0.388151 Mg\n0.335137 0.658621 0.861849 Mg\n0.832222 0.166111 0.371379 Mg\n0.832222 0.166111 0.878621 Mg\n0.820872 0.660436 0.391273 Mg\n0.820872 0.660436 0.858727 Mg\n0.182371 0.341185 0.125000 Sn\n",
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{
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},
{
"id": "mp-25469",
"created_at": "2022-09-04T14:41:10.075182Z",
"structure_string": "Al2 Cl6\n1.0\n5.216302 3.013440 0.000000\n-5.216302 3.013440 0.000000\n0.000000 1.957904 6.358629\nAl Cl\n2 6\ndirect\n0.833383 0.166617 0.000000 Al\n0.166617 0.833383 0.000000 Al\n0.204527 0.204527 0.788733 Cl\n0.795473 0.795473 0.211267 Cl\n0.068497 0.431680 0.210368 Cl\n0.568320 0.931503 0.789632 Cl\n0.931503 0.568320 0.789632 Cl\n0.431680 0.068497 0.210368 Cl\n",
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"elements": [
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"volume": 199.90274508383646,
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"formula_full": "Al2 Cl6",
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"energy": -34.30886611,
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"updated_at": "2021-11-28T01:35:17.611000Z",
"spacegroup": 12
},
{
"id": "mp-21893",
"created_at": "2022-09-04T14:44:19.405289Z",
"structure_string": "Mn4 Te8\n1.0\n6.693249 0.000000 0.000000\n0.000000 6.693249 0.000000\n0.000000 0.000000 6.693249\nMn Te\n4 8\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.365670 0.365670 0.365670 Te\n0.134330 0.634330 0.865670 Te\n0.865670 0.134330 0.634330 Te\n0.634330 0.865670 0.134330 Te\n0.634330 0.634330 0.634330 Te\n0.865670 0.365670 0.134330 Te\n0.134330 0.865670 0.365670 Te\n0.365670 0.134330 0.865670 Te\n",
"nsites": 12,
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"density": 6.869943864370046,
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"formula_full": "Mn4 Te8",
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"updated_at": "2021-11-28T01:36:36.083000Z",
"spacegroup": 205
},
{
"id": "mp-9047",
"created_at": "2022-09-04T14:40:20.138403Z",
"structure_string": "Rb4 B4 S12\n1.0\n12.103425 0.000000 0.000000\n0.000000 5.877875 0.000000\n0.000000 1.822769 7.024813\nRb B S\n4 4 12\ndirect\n0.918989 0.297073 0.258950 Rb\n0.418989 0.202927 0.741050 Rb\n0.081011 0.702927 0.741050 Rb\n0.581011 0.797073 0.258950 Rb\n0.766854 0.308165 0.711668 B\n0.266854 0.191835 0.288332 B\n0.233146 0.691835 0.288332 B\n0.733146 0.808165 0.711668 B\n0.823398 0.827348 0.931592 S\n0.323398 0.672652 0.068408 S\n0.176602 0.172652 0.068408 S\n0.676602 0.327348 0.931592 S\n0.599854 0.648965 0.813031 S\n0.099854 0.851035 0.186969 S\n0.400146 0.351035 0.186969 S\n0.900146 0.148965 0.813031 S\n0.801355 0.615547 0.561167 S\n0.301355 0.884453 0.438833 S\n0.198645 0.384453 0.438833 S\n0.698645 0.115547 0.561167 S\n",
"nsites": 20,
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"elements": [
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"B",
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"density": 2.55809878935262,
"density_atomic": 0.04001903374067221,
"volume": 499.7621914012774,
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"formula_full": "Rb4 B4 S12",
"formula_reduced": "RbBS3",
"formula_anonymous": "ABC3",
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"updated_at": "2021-11-28T01:34:53.171000Z",
"spacegroup": 14
},
{
"id": "mp-1247299",
"created_at": "2022-09-04T14:40:26.021467Z",
"structure_string": "Ba2 Cd1 N2\n1.0\n0.000000 -4.241011 0.000000\n-4.240185 0.000000 0.000000\n2.120093 2.120505 -6.947960\nBa Cd N\n2 1 2\ndirect\n0.838723 0.838723 0.177446 Ba\n0.161277 0.161277 0.822554 Ba\n0.500000 0.500000 0.500000 Cd\n0.350524 0.350524 0.201048 N\n0.649476 0.649476 0.798952 N\n",
"nsites": 5,
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"Cd",
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],
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"density": 5.516552018116673,
"density_atomic": 0.040018286635056535,
"volume": 124.94288037859012,
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"formula_full": "Ba2 Cd1 N2",
"formula_reduced": "Ba2CdN2",
"formula_anonymous": "AB2C2",
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"updated_at": "2021-11-28T01:34:50.200000Z",
"spacegroup": 139
},
{
"id": "mp-1187034",
"created_at": "2022-09-04T14:44:59.827958Z",
"structure_string": "Sn3 P1\n1.0\n4.640921 0.000000 0.000000\n0.000000 4.640921 0.000000\n0.000000 0.000000 4.640921\nSn P\n3 1\ndirect\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n0.000000 0.000000 0.000000 P\n",
"nsites": 4,
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"elements": [
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],
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"density": 6.430784588314111,
"density_atomic": 0.040017270616398176,
"volume": 99.95684209309593,
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"formula_full": "Sn3 P1",
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"updated_at": "2021-11-28T01:36:48.349000Z",
"spacegroup": 221
},
{
"id": "mp-1232293",
"created_at": "2022-09-04T14:42:21.875278Z",
"structure_string": "Mg1 Al2 Sn2\n1.0\n2.233143 -3.867917 0.000000\n2.233143 3.867917 0.000000\n0.000000 0.000000 7.232930\nMg Al Sn\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333333 0.374781 Al\n0.333333 0.666667 0.625219 Al\n0.666667 0.333333 0.768216 Sn\n0.333333 0.666667 0.231784 Sn\n",
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"volume": 124.95048264446481,
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"updated_at": "2021-11-28T01:35:43.287000Z",
"spacegroup": 164
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{
"id": "mp-1187614",
"created_at": "2022-09-04T14:44:29.532989Z",
"structure_string": "Yb1 Lu1 Hg2\n1.0\n0.000000 3.683556 3.683556\n3.683556 0.000000 3.683556\n3.683556 3.683556 0.000000\nYb Lu Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Lu\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
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{
"id": "mp-1245679",
"created_at": "2022-09-04T14:41:46.725937Z",
"structure_string": "K2 Cd2 N2\n1.0\n9.373515 0.482028 0.353068\n-2.184313 3.795597 -1.469438\n-4.368627 3.539582 2.592614\nK Cd N\n2 2 2\ndirect\n0.383033 0.596879 0.593519 K\n0.883033 0.403121 0.190398 K\n0.132063 0.499470 0.891297 Cd\n0.632063 0.500530 0.390767 Cd\n0.381904 0.812133 0.984943 N\n0.881904 0.187867 0.797076 N\n",
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{
"id": "mp-675199",
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"structure_string": "Na2 Pr2 S4\n1.0\n-2.876416 2.876416 6.040999\n2.876416 -2.876416 6.040999\n2.876416 2.876416 -6.040999\nNa Pr S\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Pr\n0.750000 0.250000 0.500000 Pr\n0.763246 0.763246 0.000000 S\n0.513246 0.013246 0.500000 S\n0.236754 0.236754 0.000000 S\n0.986754 0.486754 0.500000 S\n",
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{
"id": "mp-1193115",
"created_at": "2022-09-04T14:44:03.199101Z",
"structure_string": "Yb8 Zn4 S16\n1.0\n6.297907 0.000000 0.000000\n0.000000 8.066472 0.000000\n0.000000 0.000000 13.774496\nYb Zn S\n8 4 16\ndirect\n0.000000 0.500000 0.000000 Yb\n0.500000 0.000000 0.500000 Yb\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Yb\n0.005682 0.750000 0.267405 Yb\n0.494318 0.750000 0.767405 Yb\n0.994318 0.250000 0.732595 Yb\n0.505682 0.250000 0.232595 Yb\n0.596575 0.750000 0.093227 Zn\n0.903425 0.750000 0.593227 Zn\n0.403425 0.250000 0.906773 Zn\n0.096575 0.250000 0.406773 Zn\n0.234797 0.750000 0.092302 S\n0.265203 0.750000 0.592302 S\n0.765203 0.250000 0.907698 S\n0.734797 0.250000 0.407698 S\n0.759551 0.750000 0.433885 S\n0.740449 0.750000 0.933885 S\n0.240449 0.250000 0.566115 S\n0.259551 0.250000 0.066115 S\n0.750295 0.518866 0.167474 S\n0.749705 0.981134 0.667474 S\n0.249705 0.018866 0.832526 S\n0.250295 0.481134 0.332526 S\n0.249705 0.481134 0.832526 S\n0.250295 0.018866 0.332526 S\n0.750295 0.981134 0.167474 S\n0.749705 0.518866 0.667474 S\n",
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}
]
}