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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom&page=12090",
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"results": [
{
"id": "mp-1028196",
"created_at": "2022-09-04T14:40:09.361747Z",
"structure_string": "Rb1 Ca1 Mg14\n1.0\n6.671555 -0.001272 0.000000\n-3.336879 5.779644 0.000000\n0.000000 0.000000 10.836388\nRb Ca Mg\n1 1 14\ndirect\n0.166741 0.833370 0.125000 Rb\n0.175047 0.337523 0.125000 Ca\n0.163003 0.331501 0.625000 Mg\n0.165071 0.832535 0.625000 Mg\n0.664998 0.331130 0.125000 Mg\n0.669144 0.333674 0.625000 Mg\n0.664998 0.833868 0.125000 Mg\n0.669144 0.835469 0.625000 Mg\n0.342217 0.177679 0.394755 Mg\n0.342217 0.177679 0.855245 Mg\n0.342217 0.664538 0.394755 Mg\n0.342217 0.664538 0.855245 Mg\n0.828122 0.164061 0.377991 Mg\n0.828122 0.164061 0.872009 Mg\n0.818371 0.659186 0.387820 Mg\n0.818371 0.659186 0.862180 Mg\n",
"nsites": 16,
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"elements": [
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"Mg"
],
"chemical_system": "Ca-Mg-Rb",
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"formula_full": "Rb1 Ca1 Mg14",
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"spacegroup": 38
},
{
"id": "mp-1097077",
"created_at": "2022-09-04T14:47:31.618638Z",
"structure_string": "In2 Hg1 Pb1\n1.0\n-5.808414 6.305594 8.935032\n5.808414 -6.305594 8.935032\n5.808414 6.305594 -8.935032\nIn Hg Pb\n2 1 1\ndirect\n0.000000 0.256258 0.256258 In\n0.000000 0.743742 0.743742 In\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
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"elements": [
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"Pb"
],
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"volume": 1309.0000747873778,
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"formula_full": "In2 Hg1 Pb1",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:38:10.581000Z",
"spacegroup": 71
},
{
"id": "mp-1094488",
"created_at": "2022-09-04T14:42:17.163583Z",
"structure_string": "Mg3 Zn3\n1.0\n1.522950 -7.632145 0.000000\n1.522950 7.632145 0.000000\n0.000000 0.000000 4.776632\nMg Zn\n3 3\ndirect\n0.333622 0.666378 0.000000 Mg\n0.455492 0.544508 0.500000 Mg\n0.766648 0.233352 0.500000 Mg\n0.006145 0.993855 0.000000 Zn\n0.661186 0.338814 0.000000 Zn\n0.110241 0.889759 0.500000 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
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],
"chemical_system": "Mg-Zn",
"density": 4.0248206761795675,
"density_atomic": 0.05403401175755818,
"volume": 111.04117212175589,
"volume_molar": 11.14509281121003,
"formula_full": "Mg3 Zn3",
"formula_reduced": "MgZn",
"formula_anonymous": "AB",
"energy": -8.70803783,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:47.702000Z",
"spacegroup": 38
},
{
"id": "mp-1094323",
"created_at": "2022-09-04T14:39:58.934789Z",
"structure_string": "Sr2 Mg4\n1.0\n2.026057 -3.509234 0.000000\n2.026057 3.509234 0.000000\n0.000000 0.000000 14.957651\nSr Mg\n2 4\ndirect\n0.666667 0.333333 0.182081 Sr\n0.666667 0.333333 0.817919 Sr\n0.666667 0.333333 0.500000 Mg\n0.000000 0.000000 0.367063 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.632937 Mg\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Mg-Sr",
"density": 2.1271321437630326,
"density_atomic": 0.028209401429835627,
"volume": 212.69504831301063,
"volume_molar": 21.34799199826584,
"formula_full": "Sr2 Mg4",
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"formula_anonymous": "AB2",
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"updated_at": "2021-11-28T01:35:04.241000Z",
"spacegroup": 187
},
{
"id": "mp-1222218",
"created_at": "2022-09-04T14:42:21.564779Z",
"structure_string": "Mg4 Al1 Zn11\n1.0\n-2.671408 -4.505752 0.000000\n-2.671408 4.505752 0.000000\n0.000000 0.000000 -11.815635\nMg Al Zn\n4 1 11\ndirect\n0.334464 0.665536 0.164590 Mg\n0.334464 0.665536 0.835410 Mg\n0.000917 0.999083 0.117002 Mg\n0.000917 0.999083 0.882998 Mg\n0.662539 0.337461 0.500000 Al\n0.664060 0.335940 0.112911 Zn\n0.664060 0.335940 0.887089 Zn\n0.333281 0.666719 0.396859 Zn\n0.333281 0.666719 0.603141 Zn\n0.002679 0.997321 0.500000 Zn\n0.833517 0.166483 0.311238 Zn\n0.333635 0.165833 0.310496 Zn\n0.834167 0.666365 0.310496 Zn\n0.833517 0.166483 0.688762 Zn\n0.333635 0.165833 0.689504 Zn\n0.834167 0.666365 0.689504 Zn\n",
"nsites": 16,
"nelements": 3,
"elements": [
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"Al",
"Zn"
],
"chemical_system": "Al-Mg-Zn",
"density": 4.9254153008536985,
"density_atomic": 0.05625037395883272,
"volume": 284.44255342568437,
"volume_molar": 10.705956842895572,
"formula_full": "Mg4 Al1 Zn11",
"formula_reduced": "Mg4AlZn11",
"formula_anonymous": "AB4C11",
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"updated_at": "2021-11-28T01:35:37.754000Z",
"spacegroup": 38
},
{
"id": "mp-1094474",
"created_at": "2022-09-04T14:46:15.927161Z",
"structure_string": "Mg3 Zn3\n1.0\n1.524973 -7.587880 0.000000\n1.524973 7.587880 0.000000\n0.000000 0.000000 4.800304\nMg Zn\n3 3\ndirect\n0.998286 0.001714 0.000000 Mg\n0.673049 0.326951 0.000000 Mg\n0.439279 0.560721 0.500000 Mg\n0.333241 0.666759 0.000000 Zn\n0.113130 0.886870 0.500000 Zn\n0.776348 0.223652 0.500000 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Zn"
],
"chemical_system": "Mg-Zn",
"density": 4.022992536024881,
"density_atomic": 0.054009468615251896,
"volume": 111.09163177927735,
"volume_molar": 11.15015739721496,
"formula_full": "Mg3 Zn3",
"formula_reduced": "MgZn",
"formula_anonymous": "AB",
"energy": -8.70097106,
"energy_per_atom": -1.4501618433333334,
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"total_magnetization": 8.6e-06,
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"updated_at": "2021-11-28T01:37:29.233000Z",
"spacegroup": 38
},
{
"id": "mp-1102731",
"created_at": "2022-09-04T14:42:23.081831Z",
"structure_string": "Yb4 Cd8\n1.0\n2.972021 -5.147691 0.000000\n2.972021 5.147691 0.000000\n0.000000 0.000000 9.985095\nYb Cd\n4 8\ndirect\n0.333333 0.666667 0.441334 Yb\n0.666667 0.333333 0.558666 Yb\n0.666667 0.333333 0.941334 Yb\n0.333333 0.666667 0.058666 Yb\n0.000000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.829672 0.170328 0.250000 Cd\n0.829672 0.659344 0.250000 Cd\n0.340656 0.170328 0.250000 Cd\n0.170328 0.829672 0.750000 Cd\n0.170328 0.340656 0.750000 Cd\n0.659344 0.829672 0.750000 Cd\n",
"nsites": 12,
"nelements": 2,
"elements": [
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],
"chemical_system": "Cd-Yb",
"density": 8.649579803399266,
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"volume": 305.5248505163078,
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"formula_full": "Yb4 Cd8",
"formula_reduced": "YbCd2",
"formula_anonymous": "AB2",
"energy": -17.39936652,
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"updated_at": "2021-11-28T01:35:45.689000Z",
"spacegroup": 194
},
{
"id": "mp-1026829",
"created_at": "2022-09-04T14:40:25.446138Z",
"structure_string": "K1 Mg14 Cd1\n1.0\n6.521947 0.004451 0.000000\n-3.257119 5.641494 0.000000\n0.000000 0.000000 10.569511\nK Mg Cd\n1 14 1\ndirect\n0.166829 0.333414 0.125000 K\n0.166725 0.333362 0.625000 Mg\n0.166418 0.833208 0.625000 Mg\n0.663866 0.325408 0.125000 Mg\n0.666362 0.333486 0.625000 Mg\n0.663866 0.838456 0.125000 Mg\n0.666362 0.832875 0.625000 Mg\n0.337163 0.160872 0.385621 Mg\n0.337163 0.160872 0.864379 Mg\n0.337163 0.676292 0.385621 Mg\n0.337163 0.676292 0.864379 Mg\n0.823793 0.161897 0.387521 Mg\n0.823793 0.161897 0.862479 Mg\n0.834440 0.667221 0.370393 Mg\n0.834440 0.667221 0.879607 Mg\n0.174453 0.837226 0.125000 Cd\n",
"nsites": 16,
"nelements": 3,
"elements": [
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"Mg",
"Cd"
],
"chemical_system": "Cd-K-Mg",
"density": 2.0990460351283007,
"density_atomic": 0.04112658077192238,
"volume": 389.04279664609015,
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"formula_full": "K1 Mg14 Cd1",
"formula_reduced": "KMg14Cd",
"formula_anonymous": "ABC14",
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"updated_at": "2021-11-28T01:34:59.613000Z",
"spacegroup": 38
},
{
"id": "mp-1096416",
"created_at": "2022-09-04T14:40:05.903758Z",
"structure_string": "Li2 Mg1 Au1\n1.0\n-5.408449 5.498078 7.638034\n5.408449 -5.498078 7.638034\n5.408449 5.498078 -7.638034\nLi Mg Au\n2 1 1\ndirect\n0.724392 0.000000 0.724392 Li\n0.275608 0.000000 0.275608 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Au\n",
"nsites": 4,
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"volume": 908.5005910392708,
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"formula_full": "Li2 Mg1 Au1",
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"updated_at": "2021-11-28T01:34:48.266000Z",
"spacegroup": 71
},
{
"id": "mp-1094282",
"created_at": "2022-09-04T14:45:23.451756Z",
"structure_string": "Sr2 Mg4\n1.0\n2.000796 -3.465480 0.000000\n2.000796 3.465480 0.000000\n0.000000 0.000000 15.095023\nSr Mg\n2 4\ndirect\n0.333333 0.666667 0.615750 Sr\n0.666667 0.333333 0.384250 Sr\n0.333333 0.666667 0.934427 Mg\n0.666667 0.333333 0.797460 Mg\n0.333333 0.666667 0.202540 Mg\n0.666667 0.333333 0.065573 Mg\n",
"nsites": 6,
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"elements": [
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"formula_full": "Sr2 Mg4",
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"energy": -8.68788078,
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"updated_at": "2021-11-28T01:37:04.153000Z",
"spacegroup": 164
},
{
"id": "mp-973554",
"created_at": "2022-09-04T14:46:11.047649Z",
"structure_string": "K3 Sm1\n1.0\n-2.953159 2.953159 6.593057\n2.953159 -2.953159 6.593057\n2.953159 2.953159 -6.593057\nK Sm\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Sm\n",
"nsites": 4,
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"volume": 229.9961055685606,
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"formula_full": "K3 Sm1",
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"energy": -5.78912845,
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"updated_at": "2021-11-28T01:37:14.483000Z",
"spacegroup": 139
},
{
"id": "mp-1027957",
"created_at": "2022-09-04T14:46:33.642545Z",
"structure_string": "K1 Mg14 Zn1\n1.0\n6.495296 -0.000000 0.000000\n-3.247648 5.625090 -0.000000\n0.000000 0.000000 10.507745\nK Mg Zn\n1 14 1\ndirect\n0.166667 0.333333 0.625000 K\n0.163139 0.831569 0.125000 Mg\n0.174164 0.837082 0.625000 Mg\n0.668431 0.336861 0.125000 Mg\n0.662918 0.325836 0.625000 Mg\n0.668431 0.831569 0.125000 Mg\n0.662918 0.837082 0.625000 Mg\n0.335267 0.164733 0.357694 Mg\n0.335267 0.164733 0.892306 Mg\n0.335267 0.670536 0.357694 Mg\n0.335267 0.670536 0.892306 Mg\n0.829464 0.164733 0.357694 Mg\n0.829464 0.164733 0.892306 Mg\n0.833333 0.666667 0.379628 Mg\n0.833333 0.666667 0.870372 Mg\n0.166667 0.333333 0.125000 Zn\n",
"nsites": 16,
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"elements": [
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],
"chemical_system": "K-Mg-Zn",
"density": 1.923772729220805,
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"volume": 383.9175342120661,
"volume_molar": 14.45003394535736,
"formula_full": "K1 Mg14 Zn1",
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"updated_at": "2021-11-28T01:37:31.521000Z",
"spacegroup": 187
}
]
}