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_reduced&page=47",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=45",
"results": [
{
"id": "jvasp-38846",
"created_at": "2022-09-04T14:37:59.255926Z",
"updated_at": "2022-09-04T14:37:59.255958Z",
"structure_string": "Zr1 Cd1 Rh2\n1.0\n-0.000009 3.239815 3.239816\n3.239816 -0.000007 3.239815\n3.239821 3.239820 -0.000013\nZr Cd Rh\n1 1 2\ndirect\n0.750000 0.750002 0.749999 Zr\n0.250000 0.250000 0.250001 Cd\n0.000000 0.000001 0.000000 Rh\n0.500000 0.500001 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"Rh"
],
"chemical_system": "Cd-Rh-Zr",
"density": 9.996599292548833,
"density_atomic": 0.058812080793901655,
"volume": 68.01323717855547,
"volume_molar": 10.239632195813158,
"formula_full": "Zr1 Cd1 Rh2",
"formula_reduced": "ZrCdRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8864050625,
"spacegroup": 225
},
{
"id": "jvasp-41006",
"created_at": "2022-09-04T14:37:36.993762Z",
"updated_at": "2022-09-04T14:37:36.993782Z",
"structure_string": "Zr1 Cd1 Pd2\n1.0\n0.000094 3.297708 3.297708\n3.297708 0.000094 3.297708\n3.297708 3.297708 0.000094\nZr Cd Pd\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Zr\n0.250001 0.250001 0.250001 Cd\n0.999981 0.999981 0.999981 Pd\n0.500019 0.500019 0.500019 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"Pd"
],
"chemical_system": "Cd-Pd-Zr",
"density": 9.6425081523375,
"density_atomic": 0.05577145460629444,
"volume": 71.72127799493605,
"volume_molar": 10.797890789314886,
"formula_full": "Zr1 Cd1 Pd2",
"formula_reduced": "ZrCdPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2822964125,
"spacegroup": 225
},
{
"id": "jvasp-120076",
"created_at": "2022-09-04T14:38:38.011040Z",
"updated_at": "2022-09-04T14:38:38.011070Z",
"structure_string": "Zr1 Cd1 O4\n1.0\n3.524006 -3.496254 0.000000\n3.524006 3.496254 0.000000\n0.000000 0.000000 3.345909\nZr Cd O\n1 1 4\ndirect\n0.000000 0.000000 0.500000 Zr\n0.500001 0.500001 0.000000 Cd\n0.182114 0.182114 0.000000 O\n0.297864 0.702138 0.500000 O\n0.702138 0.297864 0.500000 O\n0.817888 0.817888 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"O"
],
"chemical_system": "Cd-O-Zr",
"density": 5.390193729228062,
"density_atomic": 0.07277253676636937,
"volume": 82.44868554276923,
"volume_molar": 8.275293163592222,
"formula_full": "Zr1 Cd1 O4",
"formula_reduced": "ZrCdO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.923746375,
"spacegroup": 65
},
{
"id": "jvasp-36601",
"created_at": "2022-09-04T14:37:19.230237Z",
"updated_at": "2022-09-04T14:37:19.230254Z",
"structure_string": "Zr1 Cd1 O3\n1.0\n4.129486 -0.000000 -0.000000\n0.000000 4.129486 -0.000000\n-0.000000 0.000000 4.129486\nZr Cd O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"O"
],
"chemical_system": "Cd-O-Zr",
"density": 5.933747254006286,
"density_atomic": 0.07100386834932391,
"volume": 70.41869853345264,
"volume_molar": 8.481426294089147,
"formula_full": "Zr1 Cd1 O3",
"formula_reduced": "ZrCdO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.58581695,
"spacegroup": 221
},
{
"id": "jvasp-120075",
"created_at": "2022-09-04T14:38:37.982264Z",
"updated_at": "2022-09-04T14:38:37.982287Z",
"structure_string": "Zr1 Cd1 O2\n1.0\n3.097274 0.000000 0.000000\n-0.000000 3.097274 0.000000\n-0.000000 0.000000 6.981884\nZr Cd O\n1 1 2\ndirect\n0.499999 0.499999 0.572125 Zr\n0.000000 0.000000 0.071454 Cd\n0.000000 0.000000 0.531547 O\n0.499999 0.499999 0.834873 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"O"
],
"chemical_system": "Cd-O-Zr",
"density": 5.841909190361236,
"density_atomic": 0.059721142660604264,
"volume": 66.97795490504983,
"volume_molar": 10.083766806378563,
"formula_full": "Zr1 Cd1 O2",
"formula_reduced": "ZrCdO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2731078125,
"spacegroup": 99
},
{
"id": "jvasp-120077",
"created_at": "2022-09-04T14:38:50.846629Z",
"updated_at": "2022-09-04T14:38:50.846653Z",
"structure_string": "Zr1 Cd1 O1\n1.0\n4.591131 -0.000000 -0.000000\n-2.295566 3.976037 0.000000\n-0.000000 -0.000000 3.106324\nZr Cd O\n1 1 1\ndirect\n0.666666 0.333334 0.000000 Zr\n0.000000 0.000000 0.000000 Cd\n0.333332 0.666668 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"O"
],
"chemical_system": "Cd-O-Zr",
"density": 6.431801096428218,
"density_atomic": 0.05290593580477162,
"volume": 56.704412356872595,
"volume_molar": 11.38273176420567,
"formula_full": "Zr1 Cd1 O1",
"formula_reduced": "ZrCdO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4543059166666668,
"spacegroup": 187
},
{
"id": "jvasp-106861",
"created_at": "2022-09-04T14:36:52.371294Z",
"updated_at": "2022-09-04T14:36:52.371316Z",
"structure_string": "Zr2 Cd2 N4\n1.0\n3.838967 -0.000000 0.000000\n0.000000 3.838967 0.000000\n-0.000000 -0.000000 8.437781\nZr Cd N\n2 2 4\ndirect\n0.750001 0.750001 0.608235 Zr\n0.250000 0.250000 0.391765 Zr\n0.750001 0.750001 0.118339 Cd\n0.250000 0.250000 0.881661 Cd\n0.750001 0.250000 0.500000 N\n0.250000 0.750001 0.500000 N\n0.750001 0.750001 0.854368 N\n0.250000 0.250000 0.145632 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"N"
],
"chemical_system": "Cd-N-Zr",
"density": 6.186590793671129,
"density_atomic": 0.06433287792513605,
"volume": 124.35321188816663,
"volume_molar": 9.360906824358059,
"formula_full": "Zr2 Cd2 N4",
"formula_reduced": "ZrCdN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9960901874999992,
"spacegroup": 129
},
{
"id": "jvasp-16469",
"created_at": "2022-09-04T14:38:14.247765Z",
"updated_at": "2022-09-04T14:38:14.247787Z",
"structure_string": "Zr1 Cd1 Cu2\n1.0\n3.919103 -0.000000 2.262695\n1.306368 3.694965 2.262695\n0.000000 0.000000 4.525391\nZr Cd Cu\n1 1 2\ndirect\n0.500000 0.500001 0.499999 Zr\n0.000000 0.000000 0.000000 Cd\n0.750000 0.750001 0.749998 Cu\n0.250000 0.250000 0.249999 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"Cu"
],
"chemical_system": "Cd-Cu-Zr",
"density": 8.380417085352253,
"density_atomic": 0.06103892495374238,
"volume": 65.53195363501818,
"volume_molar": 9.86606622669683,
"formula_full": "Zr1 Cd1 Cu2",
"formula_reduced": "ZrCdCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3462062875,
"spacegroup": 225
},
{
"id": "jvasp-38841",
"created_at": "2022-09-04T14:37:50.630417Z",
"updated_at": "2022-09-04T14:37:50.630437Z",
"structure_string": "Zr1 Cd1 Au2\n1.0\n-0.000000 3.383709 3.383709\n3.383709 -0.000000 3.383709\n3.383709 3.383709 0.000000\nZr Cd Au\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Zr\n0.250001 0.250001 0.250001 Cd\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"Au"
],
"chemical_system": "Au-Cd-Zr",
"density": 12.80641334968585,
"density_atomic": 0.051623919646936064,
"volume": 77.48346168513774,
"volume_molar": 11.665407820999157,
"formula_full": "Zr1 Cd1 Au2",
"formula_reduced": "ZrCdAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6923023475000001,
"spacegroup": 225
},
{
"id": "jvasp-106629",
"created_at": "2022-09-04T14:36:54.444345Z",
"updated_at": "2022-09-04T14:36:54.444373Z",
"structure_string": "Zr1 Cd1 Ag2\n1.0\n4.134828 -0.000000 2.387244\n1.378276 3.898354 2.387244\n-0.000000 -0.000000 4.774489\nZr Cd Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500001 0.500000 0.499999 Cd\n0.250000 0.250000 0.250000 Ag\n0.750001 0.749999 0.749999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Zr",
"density": 9.048618691691066,
"density_atomic": 0.05197498490718436,
"volume": 76.96009930821724,
"volume_molar": 11.58661377344157,
"formula_full": "Zr1 Cd1 Ag2",
"formula_reduced": "ZrCdAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4355596925,
"spacegroup": 225
},
{
"id": "jvasp-16483",
"created_at": "2022-09-04T14:37:56.366193Z",
"updated_at": "2022-09-04T14:37:56.366204Z",
"structure_string": "Zr1 Cd3\n1.0\n4.405937 0.000000 0.000000\n0.000000 4.405937 0.000000\n0.000000 0.000000 4.405161\nZr Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 8.319897742788593,
"density_atomic": 0.046775844794874545,
"volume": 85.51422251251995,
"volume_molar": 12.874467123808902,
"formula_full": "Zr1 Cd3",
"formula_reduced": "ZrCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-30112",
"created_at": "2022-09-04T14:37:59.347236Z",
"updated_at": "2022-09-04T14:37:59.347262Z",
"structure_string": "Zr2 Cd4 H24 O12 F16\n1.0\n5.788147 -0.030025 4.141174\n-6.958974 11.742629 0.000000\n-5.788147 0.030025 4.141174\nZr Cd H O F\n2 4 24 12 16\ndirect\n0.515970 0.750000 0.515970 Zr\n0.484029 0.250000 0.484029 Zr\n0.084104 0.786848 0.657843 Cd\n0.657843 0.713153 0.084104 Cd\n0.915895 0.213152 0.342156 Cd\n0.342156 0.286848 0.915895 Cd\n0.964428 0.112195 0.030156 H\n0.030156 0.387805 0.964428 H\n0.309782 0.950880 0.356826 H\n0.356827 0.549120 0.309781 H\n0.180430 0.019403 0.376025 H\n0.643173 0.450880 0.690217 H\n0.969844 0.612195 0.035571 H\n0.376025 0.480597 0.180430 H\n0.623974 0.519404 0.819568 H\n0.690218 0.049120 0.643172 H\n0.035571 0.887805 0.969843 H\n0.819569 0.980597 0.623974 H\n-0.000220 0.098655 0.833833 H\n0.002432 0.641477 0.333716 H\n0.333716 0.858523 0.002432 H\n0.833833 0.401345 -0.000220 H\n0.666283 0.141477 0.997567 H\n0.799465 0.527618 0.338427 H\n0.997567 0.358523 0.666283 H\n0.200534 0.472382 0.661572 H\n0.661572 0.027618 0.200534 H\n0.000220 0.901345 0.166166 H\n0.166167 0.598655 0.000219 H\n0.338428 0.972382 0.799465 H\n0.626574 0.444808 0.829508 O\n0.829508 0.055192 0.626573 O\n0.373426 0.555192 0.170491 O\n0.170492 0.944808 0.373425 O\n0.958054 0.375036 0.076192 O\n0.076192 0.124965 0.958054 O\n0.041945 0.624965 0.923807 O\n0.756826 0.101251 0.119023 O\n0.119023 0.398749 0.756826 O\n0.243173 0.898749 0.880976 O\n0.880976 0.601251 0.243173 O\n0.923807 0.875036 0.041945 O\n0.506428 0.919823 0.353391 F\n0.353392 0.580177 0.506427 F\n0.541970 0.223083 0.811755 F\n0.811755 0.276917 0.541970 F\n0.458029 0.776917 0.188244 F\n0.188245 0.723083 0.458029 F\n0.543306 0.212112 0.248106 F\n0.751893 0.712112 0.456693 F\n0.456694 0.787888 0.751893 F\n0.384846 0.359872 0.183295 F\n0.183295 0.140128 0.384846 F\n0.615153 0.640128 0.816704 F\n0.816704 0.859872 0.615153 F\n0.646608 0.419823 0.493572 F\n0.248106 0.287888 0.543306 F\n0.493572 0.080177 0.646607 F\n",
"nsites": 58,
"nelements": 5,
"elements": [
"Zr",
"Cd",
"H",
"O",
"F"
],
"chemical_system": "Cd-F-H-O-Zr",
"density": 3.4093729731275126,
"density_atomic": 0.10334911559908412,
"volume": 561.2046089005332,
"volume_molar": 5.8269881895857925,
"formula_full": "Zr2 Cd4 H24 O12 F16",
"formula_reduced": "ZrCd2H12(O3F4)2",
"formula_anonymous": "AB2C6D8E12",
"energy_above_hull": 1.9167416296551725,
"spacegroup": 15
}
]
}