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=nelements&page=280",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=278",
"results": [
{
"id": "jvasp-14527",
"created_at": "2022-09-04T14:38:12.407089Z",
"updated_at": "2022-09-04T14:38:12.407104Z",
"structure_string": "La1 P1\n1.0\n3.704685 -0.000000 2.138900\n1.234895 3.492810 2.138900\n0.000000 0.000000 4.277801\nLa P\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"P"
],
"chemical_system": "La-P",
"density": 5.096154195305486,
"density_atomic": 0.036131265191262335,
"volume": 55.35372175352615,
"volume_molar": 16.667395199480428,
"formula_full": "La1 P1",
"formula_reduced": "LaP",
"formula_anonymous": "AB",
"energy_above_hull": 0.7767552499999999,
"spacegroup": 225
},
{
"id": "jvasp-109702",
"created_at": "2022-09-04T14:38:12.412934Z",
"updated_at": "2022-09-04T14:38:12.412949Z",
"structure_string": "Nb4 C3\n1.0\n3.123325 -0.000431 9.981371\n1.524840 2.725807 9.981371\n-0.000736 -0.000431 10.458630\nNb C\n4 3\ndirect\n0.373569 0.373570 0.373569 Nb\n0.624464 0.624466 0.624464 Nb\n0.209320 0.209321 0.209320 Nb\n0.794357 0.794360 0.794357 Nb\n0.503274 0.503276 0.503274 C\n0.995515 0.995518 0.995515 C\n0.084495 0.084496 0.084495 C\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Nb",
"C"
],
"chemical_system": "C-Nb",
"density": 7.599637253358921,
"density_atomic": 0.0785861912659405,
"volume": 89.07417304792861,
"volume_molar": 7.663102973931776,
"formula_full": "Nb4 C3",
"formula_reduced": "Nb4C3",
"formula_anonymous": "A3B4",
"energy_above_hull": 6.461538228571428,
"spacegroup": 160
},
{
"id": "jvasp-30467",
"created_at": "2022-09-04T14:38:05.495133Z",
"updated_at": "2022-09-04T14:38:05.495158Z",
"structure_string": "Si1 C3\n1.0\n-1.277095 1.277095 6.543134\n1.277095 -1.277095 6.543134\n1.277095 1.277095 -6.543134\nSi C\n1 3\ndirect\n0.000000 0.000000 0.000000 Si\n0.750001 0.250000 0.500001 C\n0.250000 0.750001 0.500001 C\n0.500000 0.500000 0.000000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 2.494216456288733,
"density_atomic": 0.09370608126860586,
"volume": 42.68666393736082,
"volume_molar": 6.426627470140066,
"formula_full": "Si1 C3",
"formula_reduced": "SiC3",
"formula_anonymous": "AB3",
"energy_above_hull": 5.84840715,
"spacegroup": 139
},
{
"id": "jvasp-108896",
"created_at": "2022-09-04T14:38:20.338286Z",
"updated_at": "2022-09-04T14:38:20.338302Z",
"structure_string": "Tl3 Bi1\n1.0\n5.014692 -0.000000 0.000000\n0.000000 5.014692 0.000000\n0.000000 0.000000 5.014692\nTl Bi\n3 1\ndirect\n-0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 -0.000000 Tl\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"Bi"
],
"chemical_system": "Bi-Tl",
"density": 10.825724234726385,
"density_atomic": 0.03171956328236302,
"volume": 126.10514099429967,
"volume_molar": 18.985572740682976,
"formula_full": "Tl3 Bi1",
"formula_reduced": "Tl3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-55150",
"created_at": "2022-09-04T14:38:17.185457Z",
"updated_at": "2022-09-04T14:38:17.185491Z",
"structure_string": "Lu1 Cu5\n1.0\n4.275329 -0.000000 2.468362\n1.425109 4.030819 2.468362\n-0.000000 -0.000000 4.936725\nLu Cu\n1 5\ndirect\n0.000000 0.000000 0.000000 Lu\n0.624129 0.624129 0.127612 Cu\n0.127613 0.624129 0.624128 Cu\n0.250000 0.250000 0.249999 Cu\n0.624129 0.127612 0.624128 Cu\n0.624129 0.624129 0.624128 Cu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Lu",
"Cu"
],
"chemical_system": "Cu-Lu",
"density": 9.616725996142756,
"density_atomic": 0.07052603643107609,
"volume": 85.07496385201938,
"volume_molar": 8.538890124479542,
"formula_full": "Lu1 Cu5",
"formula_reduced": "LuCu5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-20510",
"created_at": "2022-09-04T14:38:12.372865Z",
"updated_at": "2022-09-04T14:38:12.372903Z",
"structure_string": "Th1 Te1\n1.0\n3.867657 0.000000 -0.000000\n0.000000 3.867657 -0.000000\n0.000000 0.000000 3.867657\nTh Te\n1 1\ndirect\n0.500000 0.500000 0.500000 Th\n0.000000 0.000000 0.000000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Th",
"Te"
],
"chemical_system": "Te-Th",
"density": 10.322167152089799,
"density_atomic": 0.03456894610076297,
"volume": 57.855394091862635,
"volume_molar": 17.420666347323458,
"formula_full": "Th1 Te1",
"formula_reduced": "ThTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.8685316833333334,
"spacegroup": 221
},
{
"id": "jvasp-20462",
"created_at": "2022-09-04T14:38:12.383355Z",
"updated_at": "2022-09-04T14:38:12.383382Z",
"structure_string": "Ti6 Al2\n1.0\n2.865499 -4.963190 0.000000\n2.865499 4.963190 0.000000\n-0.000000 0.000000 4.656414\nTi Al\n6 2\ndirect\n0.169486 0.338972 0.749999 Ti\n0.338972 0.169486 0.250000 Ti\n0.830514 0.169486 0.250000 Ti\n0.169486 0.830514 0.749999 Ti\n0.661028 0.830514 0.749999 Ti\n0.830514 0.661028 0.250000 Ti\n0.666667 0.333333 0.749999 Al\n0.333333 0.666667 0.250000 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"Al"
],
"chemical_system": "Al-Ti",
"density": 4.2773119204467305,
"density_atomic": 0.06040143306498487,
"volume": 132.44718865184765,
"volume_molar": 9.970195166596266,
"formula_full": "Ti6 Al2",
"formula_reduced": "Ti3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 3.2191519500000005,
"spacegroup": 194
},
{
"id": "jvasp-20630",
"created_at": "2022-09-04T14:38:12.388353Z",
"updated_at": "2022-09-04T14:38:12.388369Z",
"structure_string": "Zr2 Ag1\n1.0\n3.142998 -0.000000 -0.822961\n-0.215483 3.135603 -0.822961\n0.016096 0.017240 6.474718\nZr Ag\n2 1\ndirect\n0.662592 0.662590 0.325183 Zr\n0.337410 0.337409 0.674818 Zr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 7.544452978289365,
"density_atomic": 0.04694924824191078,
"volume": 63.89878671841974,
"volume_molar": 12.826916267051406,
"formula_full": "Zr2 Ag1",
"formula_reduced": "Zr2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 2.429658753333334,
"spacegroup": 139
},
{
"id": "jvasp-118616",
"created_at": "2022-09-04T14:38:26.503635Z",
"updated_at": "2022-09-04T14:38:26.503659Z",
"structure_string": "Li2 O1\n1.0\n3.273409 0.000000 -0.546342\n0.000000 3.282055 0.000000\n-1.143808 0.000000 3.124776\nLi O\n2 1\ndirect\n-0.200185 0.000000 -0.199184 Li\n0.133504 0.000000 0.465840 Li\n0.466681 0.000000 0.133344 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"O"
],
"chemical_system": "Li-O",
"density": 1.5742108696693236,
"density_atomic": 0.09517746269933948,
"volume": 31.52006698767375,
"volume_molar": 6.327276005480017,
"formula_full": "Li2 O1",
"formula_reduced": "Li2O",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6008445000000002,
"spacegroup": 191
},
{
"id": "jvasp-110010",
"created_at": "2022-09-04T14:38:12.396835Z",
"updated_at": "2022-09-04T14:38:12.396869Z",
"structure_string": "Na6 Zn2\n1.0\n6.867465 -0.000000 0.000000\n-3.433732 5.947400 0.000000\n-0.000000 -0.000000 5.424188\nNa Zn\n6 2\ndirect\n0.174176 0.348351 0.250000 Na\n0.651650 0.825825 0.250000 Na\n0.174176 0.825825 0.250000 Na\n0.825825 0.651649 0.750000 Na\n0.348351 0.174175 0.750000 Na\n0.825825 0.174175 0.750000 Na\n0.333334 0.666667 0.750000 Zn\n0.666667 0.333333 0.250000 Zn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 2.0144195343486873,
"density_atomic": 0.03611034603643869,
"volume": 221.54315530311612,
"volume_molar": 16.677050820623823,
"formula_full": "Na6 Zn2",
"formula_reduced": "Na3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-109968",
"created_at": "2022-09-04T14:38:27.203806Z",
"updated_at": "2022-09-04T14:38:27.203829Z",
"structure_string": "Ho3 Ga1\n1.0\n4.653978 -0.000000 0.000000\n0.000000 4.653978 0.000000\n-0.000000 -0.000000 4.653978\nHo Ga\n3 1\ndirect\n0.500000 0.500000 -0.000000 Ho\n0.500000 0.000000 0.500000 Ho\n-0.000000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ho",
"Ga"
],
"chemical_system": "Ga-Ho",
"density": 9.299311716517554,
"density_atomic": 0.03968140249168608,
"volume": 100.80288872950162,
"volume_molar": 15.176229623591908,
"formula_full": "Ho3 Ga1",
"formula_reduced": "Ho3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.908172877777778,
"spacegroup": 221
},
{
"id": "jvasp-14513",
"created_at": "2022-09-04T14:38:12.405792Z",
"updated_at": "2022-09-04T14:38:12.405820Z",
"structure_string": "Ti6 Hg2\n1.0\n5.172939 -0.000000 -0.000000\n0.000000 5.172939 0.000000\n0.000000 0.000000 5.172939\nTi Hg\n6 2\ndirect\n0.500000 0.250000 0.000000 Ti\n0.500000 0.750000 0.000000 Ti\n0.250000 0.000000 0.500000 Ti\n0.750000 0.000000 0.500000 Ti\n0.000000 0.500000 0.250000 Ti\n0.000000 0.500000 0.750000 Ti\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"Hg"
],
"chemical_system": "Hg-Ti",
"density": 8.257841288100096,
"density_atomic": 0.057793356163135086,
"volume": 138.42421570773902,
"volume_molar": 10.420126394807593,
"formula_full": "Ti6 Hg2",
"formula_reduced": "Ti3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4334124000000004,
"spacegroup": 223
}
]
}