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{
"id": "jvasp-8009",
"created_at": "2022-09-04T14:37:05.795489Z",
"updated_at": "2022-09-04T14:37:05.795513Z",
"structure_string": "Sr1 Mg1\n1.0\n4.153085 0.000000 0.000000\n0.000000 4.153085 0.000000\n0.000000 -0.000000 4.153085\nSr Mg\n1 1\ndirect\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Mg\n",
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"elements": [
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"volume": 71.63288775631189,
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"formula_full": "Sr1 Mg1",
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{
"id": "jvasp-78551",
"created_at": "2022-09-04T14:37:10.022085Z",
"updated_at": "2022-09-04T14:37:10.022104Z",
"structure_string": "Sr1 Mg1\n1.0\n4.040964 0.000000 -0.000000\n-2.020483 3.499578 -0.000000\n-0.000000 -0.000000 5.541023\nSr Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.500000 Mg\n",
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"formula_full": "Sr1 Mg1",
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},
{
"id": "jvasp-86887",
"created_at": "2022-09-04T14:36:14.801882Z",
"updated_at": "2022-09-04T14:36:14.801905Z",
"structure_string": "Sr1 Li4 P2\n1.0\n4.128931 0.004313 7.083380\n1.917069 3.656902 7.083380\n0.007122 0.004313 8.198920\nSr Li P\n1 4 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.430290 0.430289 0.430291 Li\n0.137856 0.137856 0.137857 Li\n0.569710 0.569709 0.569711 Li\n0.862144 0.862142 0.862145 Li\n0.754266 0.754264 0.754267 P\n0.245734 0.245734 0.245734 P\n",
"nsites": 7,
"nelements": 3,
"elements": [
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"Li",
"P"
],
"chemical_system": "Li-P-Sr",
"density": 2.38479034579791,
"density_atomic": 0.056690880327137955,
"volume": 123.47665020557277,
"volume_molar": 10.622768115874887,
"formula_full": "Sr1 Li4 P2",
"formula_reduced": "Sr(Li2P)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.197038187142857,
"spacegroup": 166
},
{
"id": "jvasp-86285",
"created_at": "2022-09-04T14:35:44.376243Z",
"updated_at": "2022-09-04T14:35:44.376263Z",
"structure_string": "Sr1 Li4 P2\n1.0\n4.128909 0.004328 7.083394\n1.917073 3.656875 7.083394\n0.007147 0.004328 8.198921\nSr Li P\n1 4 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.430288 0.430290 0.430288 Li\n0.137861 0.137861 0.137861 Li\n0.569711 0.569713 0.569710 Li\n0.862138 0.862141 0.862137 Li\n0.754264 0.754266 0.754263 P\n0.245735 0.245736 0.245735 P\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sr",
"Li",
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],
"chemical_system": "Li-P-Sr",
"density": 2.384841989090213,
"density_atomic": 0.05669210798377821,
"volume": 123.47397634257962,
"volume_molar": 10.622538081884633,
"formula_full": "Sr1 Li4 P2",
"formula_reduced": "Sr(Li2P)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.197038187142857,
"spacegroup": 166
},
{
"id": "jvasp-80761",
"created_at": "2022-09-04T14:37:15.578969Z",
"updated_at": "2022-09-04T14:37:15.578987Z",
"structure_string": "Sr1 Li2 Tl1\n1.0\n-10.857392 -0.000001 -6.268517\n-7.079617 -0.030185 -0.274778\n-5.964774 3.123069 -2.205744\nSr Li Tl\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.715859 -0.000001 0.000000 Li\n0.284141 -0.000000 0.000000 Li\n0.500000 -0.000001 0.000000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Li",
"Tl"
],
"chemical_system": "Li-Sr-Tl",
"density": 3.9166421638053284,
"density_atomic": 0.030843679542805983,
"volume": 129.68621316560672,
"volume_molar": 19.52471575786622,
"formula_full": "Sr1 Li2 Tl1",
"formula_reduced": "SrLi2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.207694075,
"spacegroup": 71
},
{
"id": "jvasp-9777",
"created_at": "2022-09-04T14:37:10.155322Z",
"updated_at": "2022-09-04T14:37:10.155347Z",
"structure_string": "Sr1 Li2 Ta2 O7\n1.0\n3.890764 -0.000000 -0.821082\n-0.173276 3.886904 -0.821082\n-0.020217 -0.021138 9.533086\nSr Li Ta O\n1 2 2 7\ndirect\n0.000000 0.000000 0.000000 Sr\n0.249999 0.749999 0.500000 Li\n0.749999 0.249999 0.500000 Li\n0.615676 0.615677 0.231354 Ta\n0.384321 0.384322 0.768647 Ta\n0.499999 0.499999 0.000000 O\n0.604968 0.104969 0.209939 O\n0.104968 0.604969 0.209939 O\n0.395029 0.895029 0.790062 O\n0.895029 0.395030 0.790062 O\n0.280420 0.280420 0.560843 O\n0.719577 0.719578 0.439157 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
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"Ta",
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],
"chemical_system": "Li-O-Sr-Ta",
"density": 6.633594456496056,
"density_atomic": 0.08331363230880846,
"volume": 144.03405142055342,
"volume_molar": 7.228277765730422,
"formula_full": "Sr1 Li2 Ta2 O7",
"formula_reduced": "SrLi2Ta2O7",
"formula_anonymous": "AB2C2D7",
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"spacegroup": 139
},
{
"id": "jvasp-40280",
"created_at": "2022-09-04T14:37:46.353097Z",
"updated_at": "2022-09-04T14:37:46.353116Z",
"structure_string": "Sr1 Li2 Sn1\n1.0\n0.000000 3.563733 3.563733\n3.563733 -0.000000 3.563733\n3.563733 3.563733 0.000000\nSr Li Sn\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 Sn\n",
"nsites": 4,
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"elements": [
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"Sn"
],
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"density": 4.0396580762206025,
"density_atomic": 0.04418903523091985,
"volume": 90.52019305461391,
"volume_molar": 13.628133604931485,
"formula_full": "Sr1 Li2 Sn1",
"formula_reduced": "SrLi2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1775295025,
"spacegroup": 225
},
{
"id": "jvasp-40283",
"created_at": "2022-09-04T14:37:47.611678Z",
"updated_at": "2022-09-04T14:37:47.611697Z",
"structure_string": "Sr1 Li2 Pb1\n1.0\n-0.000000 3.601765 3.601765\n3.601765 -0.000000 3.601765\n3.601765 3.601765 -0.000000\nSr Li Pb\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.249999 0.249999 0.249999 Pb\n",
"nsites": 4,
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"elements": [
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"Pb"
],
"chemical_system": "Li-Pb-Sr",
"density": 5.485452066389429,
"density_atomic": 0.042803952663015996,
"volume": 93.44931369985675,
"volume_molar": 14.069123025648343,
"formula_full": "Sr1 Li2 Pb1",
"formula_reduced": "SrLi2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1564417825,
"spacegroup": 225
},
{
"id": "jvasp-57139",
"created_at": "2022-09-04T14:38:34.790795Z",
"updated_at": "2022-09-04T14:38:34.790813Z",
"structure_string": "Sr1 Li2 Nb2 O7\n1.0\n3.921675 0.002700 -0.841273\n-0.182918 3.917409 -0.841273\n-0.018220 -0.019103 9.477598\nSr Li Nb O\n1 2 2 7\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250018 0.749982 0.500000 Li\n0.749980 0.250019 0.500000 Li\n0.383028 0.383029 0.766130 Nb\n0.616970 0.616972 0.233871 Nb\n0.106080 0.606072 0.212151 O\n0.606071 0.106081 0.212151 O\n0.722154 0.722155 0.444305 O\n0.393927 0.893920 0.787850 O\n0.277844 0.277846 0.555695 O\n0.499999 0.500000 0.000000 O\n0.893918 0.393929 0.787850 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Sr",
"Li",
"Nb",
"O"
],
"chemical_system": "Li-Nb-O-Sr",
"density": 4.557776391667671,
"density_atomic": 0.08248488392407025,
"volume": 145.48120127133055,
"volume_molar": 7.30090226658203,
"formula_full": "Sr1 Li2 Nb2 O7",
"formula_reduced": "SrLi2Nb2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.6812641341666668,
"spacegroup": 139
},
{
"id": "jvasp-101020",
"created_at": "2022-09-04T14:37:08.403435Z",
"updated_at": "2022-09-04T14:37:08.403458Z",
"structure_string": "Sr1 Li2 In1\n1.0\n4.468599 -0.000000 2.579947\n1.489533 4.213036 2.579947\n-0.000000 -0.000000 5.159894\nSr Li In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Li\n0.749999 0.750001 0.750000 Li\n0.500000 0.500001 0.500000 In\n",
"nsites": 4,
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"elements": [
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"In"
],
"chemical_system": "In-Li-Sr",
"density": 3.6977575936576774,
"density_atomic": 0.04117680608923984,
"volume": 97.14206564081385,
"volume_molar": 14.625079825153517,
"formula_full": "Sr1 Li2 In1",
"formula_reduced": "SrLi2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.15844624625,
"spacegroup": 225
},
{
"id": "jvasp-80462",
"created_at": "2022-09-04T14:37:19.444672Z",
"updated_at": "2022-09-04T14:37:19.444703Z",
"structure_string": "Sr1 Li2 In1\n1.0\n-11.753225 3.294882 -1.405213\n-8.706832 1.153775 1.720214\n-7.303002 5.124399 -0.711286\nSr Li In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.939247 -0.151400 -0.151402 Li\n0.060753 0.151401 0.151402 Li\n0.500000 0.000001 -0.000000 In\n",
"nsites": 4,
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],
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"density": 3.511000904038555,
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"volume": 102.30923337949886,
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"formula_full": "Sr1 Li2 In1",
"formula_reduced": "SrLi2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.16798374625,
"spacegroup": 166
},
{
"id": "jvasp-81530",
"created_at": "2022-09-04T14:37:12.977351Z",
"updated_at": "2022-09-04T14:37:12.977377Z",
"structure_string": "Sr1 Li2 Ge1\n1.0\n-11.057720 4.186885 0.442714\n-7.782249 1.449821 2.705819\n-6.383711 5.399486 0.300656\nSr Li Ge\n1 2 1\ndirect\n0.500001 -0.000001 -0.000001 Sr\n0.750535 0.999576 0.999655 Li\n0.249465 0.000424 0.000344 Li\n-0.000000 0.000001 0.000001 Ge\n",
"nsites": 4,
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"elements": [
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],
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"density": 3.6280548669599124,
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"volume": 79.70375441928296,
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"formula_full": "Sr1 Li2 Ge1",
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}
]
}