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{
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"results": [
{
"id": "mp-1215080",
"created_at": "2022-09-04T14:39:07.800906Z",
"structure_string": "Ag12 S1 Br1\n1.0\n19.427257 0.000000 0.000000\n0.000000 19.427257 0.000000\n0.000000 0.000000 19.427257\nAg S Br\n12 1 1\ndirect\n0.097807 0.500000 0.000000 Ag\n0.902193 0.500000 0.000000 Ag\n0.000000 0.097807 0.500000 Ag\n0.500000 0.097807 0.000000 Ag\n0.000000 0.902193 0.500000 Ag\n0.500000 0.902193 0.000000 Ag\n0.500000 0.000000 0.097807 Ag\n0.097807 0.000000 0.500000 Ag\n0.500000 0.000000 0.902193 Ag\n0.902193 0.000000 0.500000 Ag\n0.000000 0.500000 0.097807 Ag\n0.000000 0.500000 0.902193 Ag\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 Br\n",
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{
"id": "mp-1026845",
"created_at": "2022-09-04T14:44:56.582822Z",
"structure_string": "Cs1 K1 Mg14\n1.0\n6.965608 -0.000000 0.000000\n-3.482804 6.032392 -0.000000\n0.000000 -0.000000 10.616500\nCs K Mg\n1 1 14\ndirect\n0.166667 0.333333 0.625000 Cs\n0.166667 0.333333 0.125000 K\n0.171816 0.835907 0.125000 Mg\n0.175635 0.837817 0.625000 Mg\n0.664093 0.328184 0.125000 Mg\n0.662183 0.324365 0.625000 Mg\n0.664093 0.835907 0.125000 Mg\n0.662183 0.837817 0.625000 Mg\n0.350508 0.149492 0.368537 Mg\n0.350508 0.149492 0.881463 Mg\n0.350508 0.701018 0.368537 Mg\n0.350508 0.701018 0.881463 Mg\n0.798982 0.149492 0.368537 Mg\n0.798982 0.149492 0.881463 Mg\n0.833333 0.666667 0.375641 Mg\n0.833333 0.666667 0.874359 Mg\n",
"nsites": 16,
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"elements": [
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"density": 1.9068707265229283,
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"volume": 446.09766461453813,
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"formula_full": "Cs1 K1 Mg14",
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"formula_anonymous": "ABC14",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:46.059000Z",
"spacegroup": 187
},
{
"id": "mp-1186096",
"created_at": "2022-09-04T14:43:03.046343Z",
"structure_string": "Na6 Yb2\n1.0\n3.847322 -6.663757 0.000000\n3.847322 6.663757 0.000000\n0.000000 0.000000 6.037561\nNa Yb\n6 2\ndirect\n0.161307 0.322615 0.250000 Na\n0.677385 0.838693 0.250000 Na\n0.161307 0.838693 0.250000 Na\n0.838693 0.677385 0.750000 Na\n0.322615 0.161307 0.750000 Na\n0.838693 0.161307 0.750000 Na\n0.333333 0.666667 0.750000 Yb\n0.666667 0.333333 0.250000 Yb\n",
"nsites": 8,
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"elements": [
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"density": 2.5962227291624407,
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"volume": 309.5773761127115,
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"formula_full": "Na6 Yb2",
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"formula_anonymous": "AB3",
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"spacegroup": 194
},
{
"id": "mp-1016325",
"created_at": "2022-09-04T14:44:24.592182Z",
"structure_string": "Rb1 Mg7\n1.0\n3.462617 -5.997428 0.000000\n3.462617 5.997428 0.000000\n0.000000 0.000000 5.408642\nRb Mg\n1 7\ndirect\n0.666667 0.333333 0.500000 Rb\n0.162891 0.325783 0.500000 Mg\n0.674217 0.837109 0.500000 Mg\n0.162891 0.837109 0.500000 Mg\n0.847814 0.152186 0.000000 Mg\n0.304371 0.152186 0.000000 Mg\n0.847814 0.695629 0.000000 Mg\n0.333333 0.666667 0.000000 Mg\n",
"nsites": 8,
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"elements": [
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"density": 1.8894133199174088,
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"volume": 224.64033171466144,
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"formula_full": "Rb1 Mg7",
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"spacegroup": 187
},
{
"id": "mp-974816",
"created_at": "2022-09-04T14:42:52.992086Z",
"structure_string": "Rb3 Sm1\n1.0\n0.000000 5.129492 5.129492\n5.129492 0.000000 5.129492\n5.129492 5.129492 0.000000\nRb Sm\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sm\n",
"nsites": 4,
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"elements": [
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"density": 2.502291496911429,
"density_atomic": 0.014818591468317266,
"volume": 269.9311880317477,
"volume_molar": 40.6390902460303,
"formula_full": "Rb3 Sm1",
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"updated_at": "2021-11-28T01:35:52.559000Z",
"spacegroup": 225
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{
"id": "mp-1096529",
"created_at": "2022-09-04T14:48:26.268420Z",
"structure_string": "La1 Mg2 Sc1\n1.0\n-6.113243 6.983582 9.218310\n6.113243 -6.983582 9.218310\n6.113243 6.983582 -9.218310\nLa Mg Sc\n1 2 1\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.245280 0.245280 Mg\n0.000000 0.754720 0.754720 Mg\n0.000000 0.000000 0.000000 Sc\n",
"nsites": 4,
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"elements": [
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"chemical_system": "La-Mg-Sc",
"density": 0.24522085288981424,
"density_atomic": 0.0025409656555490322,
"volume": 1574.2046694982623,
"volume_molar": 237.00205261919538,
"formula_full": "La1 Mg2 Sc1",
"formula_reduced": "LaMg2Sc",
"formula_anonymous": "ABC2",
"energy": -5.13609459,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:39:17.407000Z",
"spacegroup": 71
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{
"id": "mp-1038975",
"created_at": "2022-09-04T14:47:16.991901Z",
"structure_string": "Mg2 Cd2\n1.0\n1.624655 -2.813984 0.000000\n1.624655 2.813984 0.000000\n0.000000 0.000000 9.783840\nMg Cd\n2 2\ndirect\n0.333333 0.666667 0.628974 Mg\n0.666667 0.333333 0.371026 Mg\n0.666667 0.333333 0.874065 Cd\n0.333333 0.666667 0.125935 Cd\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Cd-Mg",
"density": 5.075470686227626,
"density_atomic": 0.044713418921383356,
"volume": 89.45860317755918,
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"formula_full": "Mg2 Cd2",
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"energy": -5.1354222,
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"updated_at": "2021-11-28T01:38:04.966000Z",
"spacegroup": 164
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{
"id": "mp-1095866",
"created_at": "2022-09-04T14:41:48.995358Z",
"structure_string": "Sr2 In1 Pb1\n1.0\n-6.573448 7.141582 9.877578\n6.573448 -7.141582 9.877578\n6.573448 7.141582 -9.877578\nSr In Pb\n2 1 1\ndirect\n0.000000 0.252360 0.252360 Sr\n0.000000 0.747640 0.747640 Sr\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
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"elements": [
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"density": 0.44517704078360576,
"density_atomic": 0.002156561626878283,
"volume": 1854.8044025944087,
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"formula_full": "Sr2 In1 Pb1",
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"updated_at": "2021-11-28T01:35:29.284000Z",
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{
"id": "mp-975055",
"created_at": "2022-09-04T14:41:11.971809Z",
"structure_string": "Rb3 Ac1\n1.0\n-3.171003 3.171003 7.130632\n3.171003 -3.171003 7.130632\n3.171003 3.171003 -7.130632\nRb Ac\n3 1\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Ac\n",
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"volume": 286.8014356391224,
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"formula_full": "Rb3 Ac1",
"formula_reduced": "Rb3Ac",
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{
"id": "mp-1094428",
"created_at": "2022-09-04T14:40:05.986438Z",
"structure_string": "Mg1 Zn5\n1.0\n1.398633 -2.422503 0.000000\n1.398633 2.422503 0.000000\n0.000000 0.000000 14.372677\nMg Zn\n1 5\ndirect\n0.666667 0.333333 0.000000 Mg\n0.000000 0.000000 0.824952 Zn\n0.666667 0.333333 0.663621 Zn\n0.000000 0.000000 0.500000 Zn\n0.666667 0.333333 0.336379 Zn\n0.000000 0.000000 0.175048 Zn\n",
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"updated_at": "2021-11-28T01:34:49.949000Z",
"spacegroup": 187
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{
"id": "mp-1096341",
"created_at": "2022-09-04T14:40:40.627360Z",
"structure_string": "Cd1 In2 Ga1\n1.0\n-5.819324 5.899212 8.355359\n5.819324 -5.899212 8.355359\n5.819324 5.899212 -8.355359\nCd In Ga\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Cd\n0.000000 0.234774 0.234774 In\n0.000000 0.765226 0.765226 In\n0.000000 0.000000 0.000000 Ga\n",
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{
"id": "mp-1095901",
"created_at": "2022-09-04T14:48:04.025214Z",
"structure_string": "Sr1 Ca1 Ag2\n1.0\n-6.171157 6.543149 9.253444\n6.171157 -6.543149 9.253444\n6.171157 6.543149 -9.253444\nSr Ca Ag\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Ca\n0.000000 0.242091 0.242091 Ag\n0.000000 0.757909 0.757909 Ag\n",
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"volume": 1494.5718492209435,
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"formula_full": "Sr1 Ca1 Ag2",
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"updated_at": "2021-11-28T01:38:27.005000Z",
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}
]
}