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=density&page=4504",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=4502",
"results": [
{
"id": "jvasp-41178",
"created_at": "2022-09-04T14:37:44.196889Z",
"updated_at": "2022-09-04T14:37:44.196925Z",
"structure_string": "Li1 Ti1 Ir2\n1.0\n-0.000000 3.014319 3.014319\n3.014319 0.000000 3.014319\n3.014319 3.014319 0.000000\nLi Ti Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.749999 Ti\n0.000000 0.000000 0.000000 Ir\n0.499999 0.499999 0.499999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ti",
"Ir"
],
"chemical_system": "Ir-Li-Ti",
"density": 13.315434085678778,
"density_atomic": 0.07302345255888149,
"volume": 54.776922479454846,
"volume_molar": 8.246858439272131,
"formula_full": "Li1 Ti1 Ir2",
"formula_reduced": "LiTiIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.257570133333333,
"spacegroup": 225
},
{
"id": "jvasp-14641",
"created_at": "2022-09-04T14:35:58.890669Z",
"updated_at": "2022-09-04T14:35:58.890696Z",
"structure_string": "Ti1 Os1\n1.0\n3.096399 -0.000000 0.000000\n0.000000 3.096399 0.000000\n-0.000000 -0.000000 3.096399\nTi Os\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Os\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"Os"
],
"chemical_system": "Os-Ti",
"density": 13.317793151315568,
"density_atomic": 0.06736886646829007,
"volume": 29.687303718274407,
"volume_molar": 8.939056088815994,
"formula_full": "Ti1 Os1",
"formula_reduced": "TiOs",
"formula_anonymous": "AB",
"energy_above_hull": 2.879046666666667,
"spacegroup": 221
},
{
"id": "jvasp-40876",
"created_at": "2022-09-04T14:37:41.355536Z",
"updated_at": "2022-09-04T14:37:41.355546Z",
"structure_string": "Pm1 Tl1 Au2\n1.0\n-0.000000 3.591819 3.591819\n3.591819 -0.000000 3.591819\n3.591819 3.591819 -0.000000\nPm Tl Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pm\n0.749999 0.749999 0.749999 Tl\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Tl",
"Au"
],
"chemical_system": "Au-Pm-Tl",
"density": 13.318321932622968,
"density_atomic": 0.043160519688637815,
"volume": 92.67729000614922,
"volume_molar": 13.952892141809297,
"formula_full": "Pm1 Tl1 Au2",
"formula_reduced": "PmTlAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.29537722875,
"spacegroup": 225
},
{
"id": "jvasp-121320",
"created_at": "2022-09-04T14:38:54.028518Z",
"updated_at": "2022-09-04T14:38:54.028553Z",
"structure_string": "Ta8 Al2 N6\n1.0\n2.970149 -0.000000 0.000000\n-1.485075 2.572225 0.000000\n-0.000000 -0.000000 25.873219\nTa Al N\n8 2 6\ndirect\n0.333334 0.666665 0.445018 Ta\n0.666667 0.333333 0.554982 Ta\n0.666667 0.333333 0.945018 Ta\n0.333334 0.666665 0.054982 Ta\n0.333334 0.666665 0.836516 Ta\n0.666667 0.333333 0.163484 Ta\n0.666667 0.333333 0.336516 Ta\n0.333334 0.666665 0.663484 Ta\n0.333334 0.666665 0.250000 Al\n0.666667 0.333333 0.750000 Al\n0.000000 0.000000 0.500000 N\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.391583 N\n0.000000 0.000000 0.608417 N\n0.000000 0.000000 0.891583 N\n0.000000 0.000000 0.108417 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ta",
"Al",
"N"
],
"chemical_system": "Al-N-Ta",
"density": 13.319911239348501,
"density_atomic": 0.08094356471333264,
"volume": 197.66858621392734,
"volume_molar": 7.439925312565412,
"formula_full": "Ta8 Al2 N6",
"formula_reduced": "Ta4AlN3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 6.28676616875,
"spacegroup": 194
},
{
"id": "jvasp-39767",
"created_at": "2022-09-04T14:37:37.213687Z",
"updated_at": "2022-09-04T14:37:37.213717Z",
"structure_string": "Lu2 Cu1 Ir1\n1.0\n-0.000000 3.354554 3.354554\n3.354554 -0.000000 3.354554\n3.354554 3.354554 -0.000000\nLu Cu Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499999 0.499999 0.499999 Lu\n0.250000 0.250000 0.250000 Cu\n0.749998 0.749998 0.749998 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cu",
"Ir"
],
"chemical_system": "Cu-Ir-Lu",
"density": 13.322022488001569,
"density_atomic": 0.052981668826727314,
"volume": 75.49781063110164,
"volume_molar": 11.366461067307965,
"formula_full": "Lu2 Cu1 Ir1",
"formula_reduced": "Lu2CuIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5218932625,
"spacegroup": 225
},
{
"id": "jvasp-35889",
"created_at": "2022-09-04T14:37:28.794724Z",
"updated_at": "2022-09-04T14:37:28.794746Z",
"structure_string": "Hf5 Pb1\n1.0\n3.182359 0.000000 0.000000\n0.000000 3.182359 0.000000\n0.000000 0.000000 13.533229\nHf Pb\n5 1\ndirect\n0.500000 0.500000 0.337286 Hf\n0.500000 0.500000 0.662714 Hf\n0.000000 0.000000 0.180094 Hf\n0.000000 0.000000 0.819906 Hf\n0.000000 0.000000 0.500000 Hf\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"Pb"
],
"chemical_system": "Hf-Pb",
"density": 13.323054491514585,
"density_atomic": 0.04377755260061546,
"volume": 137.05654253307088,
"volume_molar": 13.75622985355133,
"formula_full": "Hf5 Pb1",
"formula_reduced": "Hf5Pb",
"formula_anonymous": "AB5",
"energy_above_hull": 5.12031597,
"spacegroup": 123
},
{
"id": "jvasp-40000",
"created_at": "2022-09-04T14:37:47.719356Z",
"updated_at": "2022-09-04T14:37:47.719386Z",
"structure_string": "Ho2 Os1 Ru1\n1.0\n0.000000 3.382586 3.382586\n3.382586 0.000000 3.382586\n3.382586 3.382586 -0.000000\nHo Os Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500001 0.500001 0.500001 Ho\n0.250001 0.250001 0.250001 Os\n0.750002 0.750002 0.750002 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Os",
"Ru"
],
"chemical_system": "Ho-Os-Ru",
"density": 13.32528447610896,
"density_atomic": 0.05167535329341059,
"volume": 77.40634064537808,
"volume_molar": 11.653796977074402,
"formula_full": "Ho2 Os1 Ru1",
"formula_reduced": "Ho2OsRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.232179158333333,
"spacegroup": 225
},
{
"id": "jvasp-40646",
"created_at": "2022-09-04T14:37:48.997662Z",
"updated_at": "2022-09-04T14:37:48.997681Z",
"structure_string": "Sm1 Pb1 Au2\n1.0\n-0.000001 3.604224 3.604223\n3.604223 0.000000 3.604223\n3.604225 3.604225 -0.000002\nSm Pb Au\n1 1 2\ndirect\n0.749999 0.750000 0.750001 Sm\n0.250000 0.250000 0.250000 Pb\n0.500001 0.500001 0.500002 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Pb",
"Au"
],
"chemical_system": "Au-Pb-Sm",
"density": 13.326272140516846,
"density_atomic": 0.04271639093209793,
"volume": 93.64086976257917,
"volume_molar": 14.097962464976987,
"formula_full": "Sm1 Pb1 Au2",
"formula_reduced": "SmPbAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4940612087499998,
"spacegroup": 225
},
{
"id": "jvasp-41277",
"created_at": "2022-09-04T14:37:57.813078Z",
"updated_at": "2022-09-04T14:37:57.813112Z",
"structure_string": "Mg4 Al2 B4 Ir10\n1.0\n9.466933 -0.000000 0.000000\n-0.000000 9.466933 0.000000\n0.000000 -0.000000 2.941330\nMg Al B Ir\n4 2 4 10\ndirect\n0.176334 0.676333 0.000000 Mg\n0.323666 0.176334 0.000000 Mg\n0.676333 0.823666 0.000000 Mg\n0.823666 0.323666 0.000000 Mg\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.626138 0.126138 0.000000 B\n0.873862 0.626138 0.000000 B\n0.126138 0.373862 0.000000 B\n0.373862 0.873862 0.000000 B\n0.786518 0.071326 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.071326 0.213481 0.500000 Ir\n0.213481 0.928674 0.500000 Ir\n0.286519 0.428674 0.500000 Ir\n0.428674 0.713481 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.571326 0.286519 0.500000 Ir\n0.713481 0.571326 0.500000 Ir\n0.928674 0.786518 0.500000 Ir\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Al",
"B",
"Ir"
],
"chemical_system": "Al-B-Ir-Mg",
"density": 13.33290946093777,
"density_atomic": 0.07586957234965835,
"volume": 263.61029040504485,
"volume_molar": 7.937491373018288,
"formula_full": "Mg4 Al2 B4 Ir10",
"formula_reduced": "Mg2AlB2Ir5",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 3.780784156666666,
"spacegroup": 127
},
{
"id": "jvasp-91784",
"created_at": "2022-09-04T14:35:52.251736Z",
"updated_at": "2022-09-04T14:35:52.251747Z",
"structure_string": "Hf4 Tl2 C2\n1.0\n-1.670448 -2.893267 0.000000\n-1.670448 2.893267 -0.000000\n0.000000 -0.000000 -14.775380\nHf Tl C\n4 2 2\ndirect\n0.666668 0.333334 0.581779 Hf\n0.333334 0.666668 0.418221 Hf\n0.333334 0.666668 0.081779 Hf\n0.666668 0.333334 0.918221 Hf\n0.666690 0.333311 0.250000 Tl\n0.333311 0.666690 0.750000 Tl\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Hf",
"Tl",
"C"
],
"chemical_system": "C-Hf-Tl",
"density": 13.332971771534432,
"density_atomic": 0.05601442185033466,
"volume": 142.82036189492874,
"volume_molar": 10.751054034067515,
"formula_full": "Hf4 Tl2 C2",
"formula_reduced": "Hf2TlC",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.91648215,
"spacegroup": 194
},
{
"id": "jvasp-19816",
"created_at": "2022-09-04T14:35:50.480973Z",
"updated_at": "2022-09-04T14:35:50.480995Z",
"structure_string": "Ba2 Pt4\n1.0\n4.941827 -0.000000 2.853165\n1.647276 4.659200 2.853165\n-0.000000 -0.000000 5.706330\nBa Pt\n2 4\ndirect\n0.875001 0.875000 0.875001 Ba\n0.125000 0.125000 0.125000 Ba\n0.500001 0.500000 0.500000 Pt\n0.500001 0.500000 0.000001 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Pt"
],
"chemical_system": "Ba-Pt",
"density": 13.333423265273105,
"density_atomic": 0.04566626323124311,
"volume": 131.3880220419487,
"volume_molar": 13.187286048576626,
"formula_full": "Ba2 Pt4",
"formula_reduced": "BaPt2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2043995899999995,
"spacegroup": 227
},
{
"id": "jvasp-40001",
"created_at": "2022-09-04T14:37:48.055207Z",
"updated_at": "2022-09-04T14:37:48.055231Z",
"structure_string": "Ho2 Ir1 Ru1\n1.0\n0.000000 3.385472 3.385472\n3.385472 0.000000 3.385472\n3.385472 3.385472 0.000000\nHo Ir Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500001 0.500001 0.500001 Ho\n0.249999 0.249999 0.249999 Ir\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Ir",
"Ru"
],
"chemical_system": "Ho-Ir-Ru",
"density": 13.333752134390522,
"density_atomic": 0.05154331146307437,
"volume": 77.60463746815336,
"volume_molar": 11.683651261549738,
"formula_full": "Ho2 Ir1 Ru1",
"formula_reduced": "Ho2IrRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.793798183333333,
"spacegroup": 225
}
]
}