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=formula_anonymous&page=3510",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=3508",
"results": [
{
"id": "jvasp-100780",
"created_at": "2022-09-04T14:36:34.382975Z",
"updated_at": "2022-09-04T14:36:34.383000Z",
"structure_string": "Zr1 Ti1 N2\n1.0\n3.006102 -0.002633 4.501315\n1.362912 2.679389 4.501315\n-0.004298 -0.002633 5.412806\nZr Ti N\n1 1 2\ndirect\n0.499998 0.500001 0.500001 Zr\n0.000000 0.000000 0.000000 Ti\n0.255240 0.255241 0.255241 N\n0.744757 0.744762 0.744762 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"N"
],
"chemical_system": "N-Ti-Zr",
"density": 6.3514313176603,
"density_atomic": 0.09155764524606343,
"volume": 43.688323233411055,
"volume_molar": 6.577430801999492,
"formula_full": "Zr1 Ti1 N2",
"formula_reduced": "ZrTiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.137304833333333,
"spacegroup": 166
},
{
"id": "jvasp-100825",
"created_at": "2022-09-04T14:36:34.461706Z",
"updated_at": "2022-09-04T14:36:34.461722Z",
"structure_string": "Li1 Ti1 O2\n1.0\n2.961209 -0.000000 0.000000\n0.000000 2.961209 0.000000\n-0.000000 -0.000000 3.975324\nLi Ti O\n1 1 2\ndirect\n0.000000 0.000000 0.499999 Li\n0.500000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.499999 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ti",
"O"
],
"chemical_system": "Li-O-Ti",
"density": 4.135158802365843,
"density_atomic": 0.11474911357822616,
"volume": 34.85865707601428,
"volume_molar": 5.248093490408201,
"formula_full": "Li1 Ti1 O2",
"formula_reduced": "LiTiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6209113333333334,
"spacegroup": 123
},
{
"id": "jvasp-100145",
"created_at": "2022-09-04T14:36:34.462488Z",
"updated_at": "2022-09-04T14:36:34.462512Z",
"structure_string": "Al1 Fe2 Ge1\n1.0\n3.506029 0.000000 2.024207\n1.168677 3.305516 2.024207\n-0.000000 -0.000000 4.048415\nAl Fe Ge\n1 2 1\ndirect\n0.500000 0.500001 0.500000 Al\n0.250000 0.250000 0.250000 Fe\n0.750001 0.750001 0.750000 Fe\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Fe",
"Ge"
],
"chemical_system": "Al-Fe-Ge",
"density": 7.478810286101214,
"density_atomic": 0.0852550666644982,
"volume": 46.918032634248995,
"volume_molar": 7.063674917643026,
"formula_full": "Al1 Fe2 Ge1",
"formula_reduced": "AlFe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2834524375,
"spacegroup": 225
},
{
"id": "jvasp-99403",
"created_at": "2022-09-04T14:36:34.398161Z",
"updated_at": "2022-09-04T14:36:34.398183Z",
"structure_string": "Na1 Bi1 Se2\n1.0\n4.252351 -0.000000 0.000000\n0.000000 4.252351 0.000000\n0.000000 -0.000000 5.818147\nNa Bi Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Se\n0.500000 0.500000 -0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Bi",
"Se"
],
"chemical_system": "Bi-Na-Se",
"density": 6.153872335415861,
"density_atomic": 0.038020435861912595,
"volume": 105.20657928614241,
"volume_molar": 15.839220733481248,
"formula_full": "Na1 Bi1 Se2",
"formula_reduced": "NaBiSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5721050083333333,
"spacegroup": 123
},
{
"id": "jvasp-100281",
"created_at": "2022-09-04T14:36:34.430980Z",
"updated_at": "2022-09-04T14:36:34.431008Z",
"structure_string": "La1 Mg2 Ag1\n1.0\n4.432872 0.000000 2.559320\n1.477624 4.179351 2.559320\n0.000000 0.000000 5.118640\nLa Mg Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 La\n0.250000 0.250000 0.250000 Mg\n0.749999 0.750000 0.750001 Mg\n0.499999 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Mg",
"Ag"
],
"chemical_system": "Ag-La-Mg",
"density": 5.172338695200566,
"density_atomic": 0.042180465415243604,
"volume": 94.83062741537317,
"volume_molar": 14.277084666362306,
"formula_full": "La1 Mg2 Ag1",
"formula_reduced": "LaMg2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-101041",
"created_at": "2022-09-04T14:36:34.441927Z",
"updated_at": "2022-09-04T14:36:34.441948Z",
"structure_string": "Zn1 In1 Rh2\n1.0\n3.835895 -0.000000 2.214655\n1.278632 3.616516 2.214655\n-0.000000 -0.000000 4.429310\nZn In Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499999 0.500001 0.499999 In\n0.250000 0.250000 0.250000 Rh\n0.749999 0.750001 0.749999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"In",
"Rh"
],
"chemical_system": "In-Rh-Zn",
"density": 10.432441930083062,
"density_atomic": 0.06509787512648751,
"volume": 61.44593801606974,
"volume_molar": 9.250902196575177,
"formula_full": "Zn1 In1 Rh2",
"formula_reduced": "ZnInRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8264940925000002,
"spacegroup": 225
},
{
"id": "jvasp-106349",
"created_at": "2022-09-04T14:36:34.451382Z",
"updated_at": "2022-09-04T14:36:34.451412Z",
"structure_string": "Mn1 Zn1 Se2\n1.0\n4.093458 0.000000 0.000000\n-2.046730 3.545039 0.000000\n-0.000000 -0.000000 6.731942\nMn Zn Se\n1 1 2\ndirect\n0.333333 0.666667 0.496958 Mn\n0.666667 0.333333 0.998933 Zn\n0.333333 0.666667 0.121356 Se\n0.666667 0.333333 0.630752 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"Se"
],
"chemical_system": "Mn-Se-Zn",
"density": 4.729978339175027,
"density_atomic": 0.04094569712357667,
"volume": 97.69036262657221,
"volume_molar": 14.70762786581653,
"formula_full": "Mn1 Zn1 Se2",
"formula_reduced": "MnZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2367535936781608,
"spacegroup": 156
},
{
"id": "jvasp-100595",
"created_at": "2022-09-04T14:36:34.455847Z",
"updated_at": "2022-09-04T14:36:34.455872Z",
"structure_string": "Al1 Ga1 Ir2\n1.0\n3.723797 0.000000 2.149935\n1.241266 3.510830 2.149935\n-0.000000 0.000000 4.299870\nAl Ga Ir\n1 1 2\ndirect\n0.500001 0.500000 0.500001 Al\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250000 Ir\n0.750001 0.750000 0.750001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ga",
"Ir"
],
"chemical_system": "Al-Ga-Ir",
"density": 14.21242278467113,
"density_atomic": 0.07115556432335933,
"volume": 56.2148587821242,
"volume_molar": 8.463344809736853,
"formula_full": "Al1 Ga1 Ir2",
"formula_reduced": "AlGaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.46074683125,
"spacegroup": 225
},
{
"id": "jvasp-51290",
"created_at": "2022-09-04T14:36:34.460833Z",
"updated_at": "2022-09-04T14:36:34.460867Z",
"structure_string": "Hf1 Ge1 B2\n1.0\n0.000000 3.032783 3.032783\n3.032783 0.000000 3.032783\n3.032783 3.032783 0.000000\nHf Ge B\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Hf\n0.499999 0.499999 0.499999 Ge\n0.000000 0.000000 0.000000 B\n0.749999 0.749999 0.749999 B\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Ge",
"B"
],
"chemical_system": "B-Ge-Hf",
"density": 8.118261464942554,
"density_atomic": 0.07169782554886928,
"volume": 55.78969751702718,
"volume_molar": 8.399335285134004,
"formula_full": "Hf1 Ge1 B2",
"formula_reduced": "HfGeB2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.120208529166668,
"spacegroup": 216
},
{
"id": "jvasp-100731",
"created_at": "2022-09-04T14:36:34.477472Z",
"updated_at": "2022-09-04T14:36:34.477499Z",
"structure_string": "Lu2 Co1 Ir1\n1.0\n4.040207 -0.000000 2.332615\n1.346736 3.809144 2.332615\n-0.000000 -0.000000 4.665229\nLu Co Ir\n2 1 1\ndirect\n0.250001 0.250000 0.249999 Lu\n0.750002 0.749999 0.749998 Lu\n0.500001 0.500000 0.499999 Co\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Co",
"Ir"
],
"chemical_system": "Co-Ir-Lu",
"density": 13.902100759390194,
"density_atomic": 0.05571293230339063,
"volume": 71.79661587757721,
"volume_molar": 10.809233172660521,
"formula_full": "Lu2 Co1 Ir1",
"formula_reduced": "Lu2CoIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4542558750000003,
"spacegroup": 225
},
{
"id": "jvasp-101394",
"created_at": "2022-09-04T14:36:34.493857Z",
"updated_at": "2022-09-04T14:36:34.493867Z",
"structure_string": "Ce2 Cd1 In1\n1.0\n4.682555 -0.000000 2.703475\n1.560852 4.414755 2.703475\n0.000000 -0.000000 5.406950\nCe Cd In\n2 1 1\ndirect\n0.750000 0.750001 0.749998 Ce\n0.250000 0.250000 0.249999 Ce\n0.500000 0.500001 0.499999 Cd\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Cd",
"In"
],
"chemical_system": "Cd-Ce-In",
"density": 7.538933641402073,
"density_atomic": 0.03578641084498087,
"volume": 111.77427144977322,
"volume_molar": 16.82800990042459,
"formula_full": "Ce2 Cd1 In1",
"formula_reduced": "Ce2CdIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.558913875,
"spacegroup": 225
},
{
"id": "jvasp-103587",
"created_at": "2022-09-04T14:36:34.921432Z",
"updated_at": "2022-09-04T14:36:34.921460Z",
"structure_string": "Ba2 In1 Hg1\n1.0\n5.161909 -0.000000 2.980229\n1.720636 4.866694 2.980229\n-0.000000 -0.000000 5.960459\nBa In Hg\n2 1 1\ndirect\n0.750001 0.749999 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 In\n0.500001 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"In",
"Hg"
],
"chemical_system": "Ba-Hg-In",
"density": 6.5436890697076615,
"density_atomic": 0.026713814264312033,
"volume": 149.73526282780767,
"volume_molar": 22.543170737116334,
"formula_full": "Ba2 In1 Hg1",
"formula_reduced": "Ba2InHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}