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"results": [
{
"id": "mp-1097227",
"created_at": "2022-09-04T14:45:39.832408Z",
"structure_string": "Sr2 Hg1 Sb1\n1.0\n-6.397372 6.442477 9.398187\n6.397372 -6.442477 9.398187\n6.397372 6.442477 -9.398187\nSr Hg Sb\n2 1 1\ndirect\n0.771167 0.000000 0.771167 Sr\n0.228833 0.000000 0.228833 Sr\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n",
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{
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"structure_string": "K3 Dy1\n1.0\n-2.912462 2.912462 6.644916\n2.912462 -2.912462 6.644916\n2.912462 2.912462 -6.644916\nK Dy\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 Dy\n",
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"formula_full": "K3 Dy1",
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"updated_at": "2021-11-28T01:34:37.292000Z",
"spacegroup": 139
},
{
"id": "mp-1185073",
"created_at": "2022-09-04T14:42:53.331159Z",
"structure_string": "K3 Tb1\n1.0\n0.000000 4.862582 4.862582\n4.862582 0.000000 4.862582\n4.862582 4.862582 0.000000\nK Tb\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Tb\n",
"nsites": 4,
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"elements": [
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"Tb"
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"density": 1.9946826102249435,
"density_atomic": 0.017395190185295978,
"volume": 229.94862127929878,
"volume_molar": 34.61957412279671,
"formula_full": "K3 Tb1",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:56.100000Z",
"spacegroup": 225
},
{
"id": "mp-1095961",
"created_at": "2022-09-04T14:45:16.566674Z",
"structure_string": "Na1 In2 Ag1\n1.0\n-5.813494 6.148276 8.687164\n5.813494 -6.148276 8.687164\n5.813494 6.148276 -8.687164\nNa In Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.267882 0.267882 In\n0.000000 0.732118 0.732118 In\n0.000000 0.500000 0.500000 Ag\n",
"nsites": 4,
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"elements": [
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"Ag"
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"chemical_system": "Ag-In-Na",
"density": 0.48196833458142996,
"density_atomic": 0.0032205600104902622,
"volume": 1242.0200173171388,
"volume_molar": 186.99048427553618,
"formula_full": "Na1 In2 Ag1",
"formula_reduced": "NaIn2Ag",
"formula_anonymous": "ABC2",
"energy": -5.58798962,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:53.901000Z",
"spacegroup": 71
},
{
"id": "mp-1180648",
"created_at": "2022-09-04T14:46:11.097212Z",
"structure_string": "K1 S1\n1.0\n6.139753 5.665404 0.000000\n-6.139753 5.665404 0.000000\n0.000000 2.063230 5.667774\nK S\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
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],
"chemical_system": "K-S",
"density": 0.29969594818178147,
"density_atomic": 0.005072308860820278,
"volume": 394.29775569237836,
"volume_molar": 118.7258293065797,
"formula_full": "K1 S1",
"formula_reduced": "KS",
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"updated_at": "2021-11-28T01:37:25.203000Z",
"spacegroup": 12
},
{
"id": "mp-1096712",
"created_at": "2022-09-04T14:39:41.791341Z",
"structure_string": "Sr1 La1 Tl2\n1.0\n-6.511275 6.796878 9.589337\n6.511275 -6.796878 9.589337\n6.511275 6.796878 -9.589337\nSr La Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 La\n0.000000 0.258279 0.258279 Tl\n0.000000 0.741721 0.741721 Tl\n",
"nsites": 4,
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"elements": [
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"La",
"Tl"
],
"chemical_system": "La-Sr-Tl",
"density": 0.6214389162052045,
"density_atomic": 0.0023563288793596164,
"volume": 1697.55590360845,
"volume_molar": 255.57301498747697,
"formula_full": "Sr1 La1 Tl2",
"formula_reduced": "SrLaTl2",
"formula_anonymous": "ABC2",
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"energy_per_atom": -1.39844549,
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"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.196000Z",
"spacegroup": 71
},
{
"id": "mp-1094867",
"created_at": "2022-09-04T14:41:15.095832Z",
"structure_string": "Mg1 Zn3\n1.0\n4.036356 0.000000 0.000000\n0.000000 4.036356 0.000000\n0.000000 0.000000 4.036356\nMg Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n",
"nsites": 4,
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"elements": [
"Mg",
"Zn"
],
"chemical_system": "Mg-Zn",
"density": 5.568680787362802,
"density_atomic": 0.06082632826183144,
"volume": 65.76099715869259,
"volume_molar": 9.90054953519017,
"formula_full": "Mg1 Zn3",
"formula_reduced": "MgZn3",
"formula_anonymous": "AB3",
"energy": -5.59762659,
"energy_per_atom": -1.3994066475,
"energy_above_hull": null,
"is_stable": null,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:18.156000Z",
"spacegroup": 221
},
{
"id": "mp-1008777",
"created_at": "2022-09-04T14:44:13.754749Z",
"structure_string": "Sm1 Hg2\n1.0\n2.721517 -4.713806 0.000000\n2.721517 4.713806 0.000000\n0.000000 0.000000 3.418864\nSm Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.666667 0.333333 0.945104 Hg\n0.333333 0.666667 0.054896 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sm",
"Hg"
],
"chemical_system": "Hg-Sm",
"density": 10.44074610918181,
"density_atomic": 0.03420004499980618,
"volume": 87.71918282613376,
"volume_molar": 17.608575544371735,
"formula_full": "Sm1 Hg2",
"formula_reduced": "SmHg2",
"formula_anonymous": "AB2",
"energy": -5.60071079,
"energy_per_atom": -1.8669035966666667,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:30.962000Z",
"spacegroup": 164
},
{
"id": "mp-980189",
"created_at": "2022-09-04T14:44:24.906214Z",
"structure_string": "Na1 Yb3\n1.0\n0.000000 4.324975 4.324975\n4.324975 0.000000 4.324975\n4.324975 4.324975 0.000000\nNa Yb\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.500000 0.500000 0.500000 Yb\n",
"nsites": 4,
"nelements": 2,
"elements": [
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"Yb"
],
"chemical_system": "Na-Yb",
"density": 5.563595295849851,
"density_atomic": 0.024721748925026255,
"volume": 161.80085042246873,
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"formula_full": "Na1 Yb3",
"formula_reduced": "NaYb3",
"formula_anonymous": "AB3",
"energy": -5.6009213,
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"updated_at": "2021-11-28T01:36:37.559000Z",
"spacegroup": 225
},
{
"id": "mp-1180106",
"created_at": "2022-09-04T14:45:36.222085Z",
"structure_string": "Na1 S1\n1.0\n5.713813 5.324788 0.000000\n-5.713813 5.324788 0.000000\n0.000000 1.730208 4.974654\nNa S\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 S\n",
"nsites": 2,
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"elements": [
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"density": 0.30201104396961054,
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"volume": 302.7061328303233,
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"formula_full": "Na1 S1",
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"energy": -5.60360961,
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"updated_at": "2021-11-28T01:37:01.206000Z",
"spacegroup": 12
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{
"id": "mp-396",
"created_at": "2022-09-04T14:40:29.449535Z",
"structure_string": "Yb1 Ga1\n1.0\n3.650813 0.000000 0.000000\n0.000000 3.650813 0.000000\n0.000000 0.000000 3.531405\nYb Ga\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 2,
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"volume": 47.06810398218372,
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"spacegroup": 123
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{
"id": "mp-1039154",
"created_at": "2022-09-04T14:43:18.335536Z",
"structure_string": "Mg1 Bi1\n1.0\n3.771803 0.000000 0.000000\n0.000000 3.771803 0.000000\n0.000000 0.000000 3.771803\nMg Bi\n1 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Bi\n",
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"formula_full": "Mg1 Bi1",
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"updated_at": "2021-11-28T01:36:10.951000Z",
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]
}