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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=913",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=911",
"results": [
{
"id": "jvasp-90872",
"created_at": "2022-09-04T14:36:07.529610Z",
"updated_at": "2022-09-04T14:36:07.529633Z",
"structure_string": "Sr2 Hg6\n1.0\n0.000000 0.000000 -5.295079\n-3.461805 -5.998128 0.000000\n-3.461805 5.998128 -0.000000\nSr Hg\n2 6\ndirect\n0.750000 0.666711 0.333290 Sr\n0.250000 0.333290 0.666711 Sr\n0.750000 0.159424 0.318683 Hg\n0.750000 0.159398 0.840604 Hg\n0.750000 0.681318 0.840577 Hg\n0.250000 0.840577 0.681318 Hg\n0.250000 0.840604 0.159398 Hg\n0.250000 0.318683 0.159424 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Hg"
],
"chemical_system": "Hg-Sr",
"density": 10.411739718642963,
"density_atomic": 0.03638054637509615,
"volume": 219.8977419832348,
"volume_molar": 16.55318943786502,
"formula_full": "Sr2 Hg6",
"formula_reduced": "SrHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-77191",
"created_at": "2022-09-04T14:37:01.413973Z",
"updated_at": "2022-09-04T14:37:01.414008Z",
"structure_string": "Sr1 Hg2 Pb1\n1.0\n-10.715288 -0.000000 -6.186475\n-10.904510 -0.040664 6.514217\n-7.187431 10.472827 0.076047\nSr Hg Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.737849 0.000000 0.000000 Hg\n0.262151 0.000000 0.000000 Hg\n0.500000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb-Sr",
"density": 0.8029482825076504,
"density_atomic": 0.002779004357432385,
"volume": 1439.3644217584938,
"volume_molar": 216.70137881914138,
"formula_full": "Sr1 Hg2 Pb1",
"formula_reduced": "SrHg2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3689274999999999,
"spacegroup": 71
},
{
"id": "jvasp-81731",
"created_at": "2022-09-04T14:36:51.327386Z",
"updated_at": "2022-09-04T14:36:51.327401Z",
"structure_string": "Sr1 Hg2 Pb1\n1.0\n-11.097574 -0.000001 -6.407187\n-7.125554 -1.338632 -0.472552\n-5.443340 3.419392 -3.386235\nSr Hg Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.742635 -0.000001 -0.000000 Hg\n0.257366 -0.000000 -0.000000 Hg\n0.500000 -0.000001 -0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb-Sr",
"density": 8.588869140226608,
"density_atomic": 0.02972607985605707,
"volume": 134.56197451427315,
"volume_molar": 20.25877878671214,
"formula_full": "Sr1 Hg2 Pb1",
"formula_reduced": "SrHg2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0679499999999999,
"spacegroup": 71
},
{
"id": "jvasp-111300",
"created_at": "2022-09-04T14:38:49.791892Z",
"updated_at": "2022-09-04T14:38:49.791924Z",
"structure_string": "Sr1 Hg2 Pb1\n1.0\n4.716171 -0.000000 2.722883\n1.572057 4.446449 2.722883\n-0.000000 -0.000000 5.445766\nSr Hg Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n0.500000 0.500000 0.500000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb-Sr",
"density": 10.120372598680829,
"density_atomic": 0.03502661399653143,
"volume": 114.19887747060298,
"volume_molar": 17.193042869049098,
"formula_full": "Sr1 Hg2 Pb1",
"formula_reduced": "SrHg2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-81217",
"created_at": "2022-09-04T14:37:09.903898Z",
"updated_at": "2022-09-04T14:37:09.903933Z",
"structure_string": "Sr1 Hg2 Bi1\n1.0\n-12.573485 1.940406 -4.090634\n-8.363999 -0.441259 0.378860\n-6.652623 4.399250 -2.585334\nSr Hg Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.752477 -0.002023 -0.002023 Hg\n0.247521 0.002025 0.002025 Hg\n0.499999 0.000001 0.000001 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Bi"
],
"chemical_system": "Bi-Hg-Sr",
"density": 9.475158691316716,
"density_atomic": 0.032709855067391186,
"volume": 122.28730429281674,
"volume_molar": 18.41078399030737,
"formula_full": "Sr1 Hg2 Bi1",
"formula_reduced": "SrHg2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-16556",
"created_at": "2022-09-04T14:37:43.459127Z",
"updated_at": "2022-09-04T14:37:43.459153Z",
"structure_string": "Sr1 Hg2\n1.0\n2.544897 -4.407892 0.000000\n2.544897 4.407892 -0.000000\n0.000000 -0.000000 3.849200\nSr Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.333334 0.666668 0.500000 Hg\n0.666668 0.333334 0.500000 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sr",
"Hg"
],
"chemical_system": "Hg-Sr",
"density": 9.398935451773967,
"density_atomic": 0.034739185129478746,
"volume": 86.35781146905141,
"volume_molar": 17.33529654640567,
"formula_full": "Sr1 Hg2",
"formula_reduced": "SrHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1130066666666666,
"spacegroup": 191
},
{
"id": "jvasp-93434",
"created_at": "2022-09-04T14:35:51.157699Z",
"updated_at": "2022-09-04T14:35:51.157717Z",
"structure_string": "Sr2 Hg4\n1.0\n4.669017 -0.000000 2.012602\n2.068297 5.811086 1.623883\n0.019301 0.113644 6.377326\nSr Hg\n2 4\ndirect\n0.485475 0.264525 0.764526 Sr\n0.514526 0.735475 0.235474 Sr\n0.833620 0.683605 0.649155 Hg\n0.166381 0.850844 0.816395 Hg\n0.833620 0.149156 0.183605 Hg\n0.166381 0.316395 0.350844 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Hg"
],
"chemical_system": "Hg-Sr",
"density": 9.415286644705432,
"density_atomic": 0.0347996203906047,
"volume": 172.41567386809476,
"volume_molar": 17.30519095439867,
"formula_full": "Sr2 Hg4",
"formula_reduced": "SrHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.11292,
"spacegroup": 74
},
{
"id": "jvasp-14770",
"created_at": "2022-09-04T14:38:06.804909Z",
"updated_at": "2022-09-04T14:38:06.804929Z",
"structure_string": "Sr1 Hg1\n1.0\n3.958816 -0.000000 -0.000000\n0.000000 3.958816 -0.000000\n0.000000 0.000000 3.958816\nSr Hg\n1 1\ndirect\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sr",
"Hg"
],
"chemical_system": "Hg-Sr",
"density": 7.713690195693451,
"density_atomic": 0.032235472852122436,
"volume": 62.04345160918949,
"volume_molar": 18.68171994133938,
"formula_full": "Sr1 Hg1",
"formula_reduced": "SrHg",
"formula_anonymous": "AB",
"energy_above_hull": 0.25513,
"spacegroup": 221
},
{
"id": "jvasp-51174",
"created_at": "2022-09-04T14:37:03.638575Z",
"updated_at": "2022-09-04T14:37:03.638592Z",
"structure_string": "Sr1 Hf1 Re2\n1.0\n0.000016 3.368522 3.368519\n3.368526 0.000007 3.368527\n3.368542 3.368547 -0.000009\nSr Hf Re\n1 1 2\ndirect\n0.250000 0.249999 0.250000 Sr\n0.500000 0.500001 0.500001 Hf\n0.000002 0.000000 0.999999 Re\n0.749999 0.749999 0.750002 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hf",
"Re"
],
"chemical_system": "Hf-Re-Sr",
"density": 13.869978183532266,
"density_atomic": 0.05232502520702467,
"volume": 76.4452570098905,
"volume_molar": 11.509102453698432,
"formula_full": "Sr1 Hf1 Re2",
"formula_reduced": "SrHfRe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.8757688275,
"spacegroup": 216
},
{
"id": "jvasp-8061",
"created_at": "2022-09-04T14:36:37.857774Z",
"updated_at": "2022-09-04T14:36:37.857803Z",
"structure_string": "Sr1 Hf1 O3\n1.0\n4.125872 0.000000 0.000000\n-0.000000 4.125872 0.000000\n-0.000000 -0.000000 4.125872\nSr Hf O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Hf\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Hf",
"O"
],
"chemical_system": "Hf-O-Sr",
"density": 7.426447587388869,
"density_atomic": 0.07119061637593911,
"volume": 70.23397541041507,
"volume_molar": 8.459177721117966,
"formula_full": "Sr1 Hf1 O3",
"formula_reduced": "SrHfO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.860763962,
"spacegroup": 221
},
{
"id": "jvasp-7773",
"created_at": "2022-09-04T14:36:34.432346Z",
"updated_at": "2022-09-04T14:36:34.432361Z",
"structure_string": "Sr1 Hf1 O3\n1.0\n4.125890 0.000000 0.000000\n0.000000 4.125890 0.000000\n0.000000 -0.000000 4.125822\nSr Hf O\n1 1 3\ndirect\n0.500000 0.500000 0.489914 Sr\n0.000000 0.000000 0.988999 Hf\n0.500000 0.000000 0.988189 O\n0.000000 0.500000 0.988189 O\n0.000000 0.000000 0.488709 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Hf",
"O"
],
"chemical_system": "Hf-O-Sr",
"density": 7.426472787704294,
"density_atomic": 0.0711908579485035,
"volume": 70.23373708484861,
"volume_molar": 8.45914901651581,
"formula_full": "Sr1 Hf1 O3",
"formula_reduced": "SrHfO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.860763962,
"spacegroup": 221
},
{
"id": "jvasp-21240",
"created_at": "2022-09-04T14:36:49.912203Z",
"updated_at": "2022-09-04T14:36:49.912220Z",
"structure_string": "Sr4 Hf4 O12\n1.0\n5.796521 -0.035723 0.000000\n-0.035723 5.796521 -0.000000\n-0.000000 0.000000 8.197105\nSr Hf O\n4 4 12\ndirect\n0.506685 0.493315 0.250000 Sr\n0.493315 0.506685 0.750000 Sr\n0.009773 0.990227 0.250000 Sr\n0.990227 0.009773 0.750000 Sr\n0.000000 0.500000 0.500000 Hf\n0.500000 0.000000 0.500000 Hf\n0.500000 0.000000 0.000000 Hf\n0.000000 0.500000 0.000000 Hf\n0.284316 0.284316 0.500000 O\n0.715684 0.715684 0.000000 O\n0.958751 0.451292 0.750000 O\n0.218099 0.781901 0.956186 O\n0.781901 0.218099 0.456186 O\n0.781901 0.218099 0.043815 O\n0.218099 0.781901 0.543815 O\n0.548709 0.041250 0.750000 O\n0.451292 0.958751 0.250000 O\n0.041250 0.548709 0.250000 O\n0.284316 0.284316 0.000000 O\n0.715684 0.715684 0.500000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sr",
"Hf",
"O"
],
"chemical_system": "Hf-O-Sr",
"density": 7.575469126203574,
"density_atomic": 0.07261915068883526,
"volume": 275.40944517098126,
"volume_molar": 8.292772227265758,
"formula_full": "Sr4 Hf4 O12",
"formula_reduced": "SrHfO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8541039619999995,
"spacegroup": 63
}
]
}