HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=3498",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=3496",
"results": [
{
"id": "jvasp-102513",
"created_at": "2022-09-04T14:36:46.748216Z",
"updated_at": "2022-09-04T14:36:46.748226Z",
"structure_string": "Li3 La1\n1.0\n4.556981 -0.000000 2.630974\n1.518994 4.296363 2.630974\n-0.000000 -0.000000 5.261949\nLi La\n3 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.750000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 La\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"La"
],
"chemical_system": "La-Li",
"density": 2.57458129114658,
"density_atomic": 0.03882711939507156,
"volume": 103.02077677458945,
"volume_molar": 15.510140473527912,
"formula_full": "Li3 La1",
"formula_reduced": "Li3La",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0295912500000002,
"spacegroup": 225
},
{
"id": "jvasp-106832",
"created_at": "2022-09-04T14:36:46.752580Z",
"updated_at": "2022-09-04T14:36:46.752600Z",
"structure_string": "Ce3 Y1\n1.0\n3.443630 -0.000000 0.000000\n-1.721815 2.982271 0.000000\n0.000000 -0.000000 11.130891\nCe Y\n3 1\ndirect\n0.333334 0.666666 -0.000000 Ce\n0.000000 0.000000 0.755970 Ce\n0.000000 0.000000 0.244030 Ce\n0.666667 0.333333 0.500000 Y\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"Y"
],
"chemical_system": "Ce-Y",
"density": 7.397583918489123,
"density_atomic": 0.034991815305038254,
"volume": 114.31244607146931,
"volume_molar": 17.21014102155743,
"formula_full": "Ce3 Y1",
"formula_reduced": "Ce3Y",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3567379875,
"spacegroup": 187
},
{
"id": "jvasp-102456",
"created_at": "2022-09-04T14:36:46.764894Z",
"updated_at": "2022-09-04T14:36:46.764905Z",
"structure_string": "Ba1 La3\n1.0\n5.417503 -0.000000 0.000000\n0.000000 5.417503 0.000000\n-0.000000 -0.000000 5.417503\nBa La\n1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n-0.000000 0.500000 0.500000 La\n0.500000 0.000000 0.500000 La\n0.500000 0.500000 -0.000000 La\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"La"
],
"chemical_system": "Ba-La",
"density": 5.786226228485768,
"density_atomic": 0.02515721201642815,
"volume": 159.00013075327752,
"volume_molar": 23.938029206366053,
"formula_full": "Ba1 La3",
"formula_reduced": "BaLa3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.3695802425,
"spacegroup": 221
},
{
"id": "jvasp-104585",
"created_at": "2022-09-04T14:36:46.070750Z",
"updated_at": "2022-09-04T14:36:46.070777Z",
"structure_string": "K3 Rb1\n1.0\n5.916436 -0.260388 -5.491160\n-1.301173 5.777454 -5.491160\n0.217826 0.260388 8.069052\nK Rb\n3 1\ndirect\n0.750001 0.250000 0.500000 K\n0.250001 0.750000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Rb"
],
"chemical_system": "K-Rb",
"density": 1.1585261817919252,
"density_atomic": 0.013763493469572776,
"volume": 290.62388911963944,
"volume_molar": 43.75444921242753,
"formula_full": "K3 Rb1",
"formula_reduced": "K3Rb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-80499",
"created_at": "2022-09-04T14:36:46.778908Z",
"updated_at": "2022-09-04T14:36:46.778924Z",
"structure_string": "Mg2 Zr2\n1.0\n5.200879 0.000000 -0.000000\n0.000000 3.036000 0.000000\n0.000000 0.000000 5.623675\nMg Zr\n2 2\ndirect\n0.750000 0.000000 0.160558 Mg\n0.250000 0.000000 0.839441 Mg\n0.250000 0.500000 0.345416 Zr\n0.750000 0.500000 0.654583 Zr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Zr"
],
"chemical_system": "Mg-Zr",
"density": 4.320871749398278,
"density_atomic": 0.04504652146175617,
"volume": 88.7970895465467,
"volume_molar": 13.36871430819072,
"formula_full": "Mg2 Zr2",
"formula_reduced": "MgZr",
"formula_anonymous": "AB",
"energy_above_hull": 1.329429785714286,
"spacegroup": 51
},
{
"id": "jvasp-79215",
"created_at": "2022-09-04T14:36:45.835511Z",
"updated_at": "2022-09-04T14:36:45.835535Z",
"structure_string": "Ti3 Ag1\n1.0\n0.000000 0.000000 4.074660\n4.074485 0.000000 -0.000000\n0.000000 4.074485 0.000000\nTi Ag\n3 1\ndirect\n0.000000 0.500001 0.500001 Ti\n0.500000 0.500001 0.000000 Ti\n0.500000 0.000000 0.500001 Ti\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ag"
],
"chemical_system": "Ag-Ti",
"density": 6.173011344024387,
"density_atomic": 0.059132081765303164,
"volume": 67.64517467651669,
"volume_molar": 10.184219090919273,
"formula_full": "Ti3 Ag1",
"formula_reduced": "Ti3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 2.820745565,
"spacegroup": 221
},
{
"id": "jvasp-99966",
"created_at": "2022-09-04T14:36:41.832316Z",
"updated_at": "2022-09-04T14:36:41.832346Z",
"structure_string": "Li1 Ga1 O2\n1.0\n2.982214 -0.000000 0.000000\n0.000000 2.982214 0.000000\n0.000000 -0.000000 3.844993\nLi Ga O\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Li\n0.000000 0.000000 0.500000 Ga\n0.000000 0.000000 0.000000 O\n0.499999 0.499999 0.500000 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ga",
"O"
],
"chemical_system": "Ga-Li-O",
"density": 5.276632235514445,
"density_atomic": 0.11697332324218694,
"volume": 34.195831059003226,
"volume_molar": 5.148302701062432,
"formula_full": "Li1 Ga1 O2",
"formula_reduced": "LiGaO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7683923312500001,
"spacegroup": 123
},
{
"id": "jvasp-102946",
"created_at": "2022-09-04T14:36:40.305603Z",
"updated_at": "2022-09-04T14:36:40.305623Z",
"structure_string": "K3 Ge1\n1.0\n5.164507 0.000000 2.981729\n1.721502 4.869144 2.981729\n0.000000 0.000000 5.963458\nK Ge\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.749999 0.750001 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ge"
],
"chemical_system": "Ge-K",
"density": 2.10316921430107,
"density_atomic": 0.026673520358810526,
"volume": 149.9614578875323,
"volume_molar": 22.577225199338294,
"formula_full": "K3 Ge1",
"formula_reduced": "K3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-102705",
"created_at": "2022-09-04T14:36:46.820177Z",
"updated_at": "2022-09-04T14:36:46.820209Z",
"structure_string": "Na1 Co1 O2\n1.0\n2.803933 0.003691 4.776675\n1.301205 2.483731 4.776675\n0.006091 0.003691 5.538828\nNa Co O\n1 1 2\ndirect\n0.830488 0.830489 0.830492 Na\n0.000863 0.000863 0.000863 Co\n0.604405 0.604406 0.604408 O\n0.396595 0.396595 0.396596 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Co",
"O"
],
"chemical_system": "Co-Na-O",
"density": 4.920148576899359,
"density_atomic": 0.10403570375759301,
"volume": 38.448338940640475,
"volume_molar": 5.788532727218155,
"formula_full": "Na1 Co1 O2",
"formula_reduced": "NaCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.475546725,
"spacegroup": 160
},
{
"id": "jvasp-104573",
"created_at": "2022-09-04T14:36:46.830671Z",
"updated_at": "2022-09-04T14:36:46.830694Z",
"structure_string": "Er1 Tm1 Ru2\n1.0\n4.106096 -0.000000 2.370656\n1.368699 3.871265 2.370656\n-0.000000 -0.000000 4.741312\nEr Tm Ru\n1 1 2\ndirect\n0.500001 0.499999 0.500001 Er\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Ru\n0.750001 0.749999 0.750001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Tm",
"Ru"
],
"chemical_system": "Er-Ru-Tm",
"density": 11.860957098767683,
"density_atomic": 0.053073711147624957,
"volume": 75.36687963790524,
"volume_molar": 11.34674894553608,
"formula_full": "Er1 Tm1 Ru2",
"formula_reduced": "ErTmRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8076863125000004,
"spacegroup": 225
},
{
"id": "jvasp-103678",
"created_at": "2022-09-04T14:36:45.727170Z",
"updated_at": "2022-09-04T14:36:45.727183Z",
"structure_string": "Ti1 Cu2 Sn1\n1.0\n3.349399 -0.000000 0.000000\n0.000000 3.349399 0.000000\n-0.000000 -0.000000 5.803118\nTi Cu Sn\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.718995 Cu\n0.000000 0.000000 0.281006 Cu\n0.500000 0.500000 -0.000000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Cu",
"Sn"
],
"chemical_system": "Cu-Sn-Ti",
"density": 7.49052102975371,
"density_atomic": 0.06144192546371009,
"volume": 65.10212643584144,
"volume_molar": 9.801354229298855,
"formula_full": "Ti1 Cu2 Sn1",
"formula_reduced": "TiCu2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8459477333333334,
"spacegroup": 123
},
{
"id": "jvasp-8123",
"created_at": "2022-09-04T14:36:45.688406Z",
"updated_at": "2022-09-04T14:36:45.688432Z",
"structure_string": "Li1 Sn1 Pd2\n1.0\n3.884925 0.000000 2.242963\n1.294975 3.662743 2.242963\n0.000000 0.000000 4.485926\nLi Sn Pd\n1 1 2\ndirect\n0.500001 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Sn\n0.250001 0.250000 0.250000 Pd\n0.750002 0.749999 0.749999 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sn",
"Pd"
],
"chemical_system": "Li-Pd-Sn",
"density": 8.80552049350017,
"density_atomic": 0.0626640990693969,
"volume": 63.832402594190796,
"volume_molar": 9.610192836780154,
"formula_full": "Li1 Sn1 Pd2",
"formula_reduced": "LiSnPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9502707750000002,
"spacegroup": 225
}
]
}