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=912",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=910",
"results": [
{
"id": "jvasp-36508",
"created_at": "2022-09-04T14:37:31.638201Z",
"updated_at": "2022-09-04T14:37:31.638227Z",
"structure_string": "Cd8 S2 F12\n1.0\n5.566766 -0.000437 -0.000475\n-0.000849 7.948966 0.000121\n-0.000813 0.000013 7.949052\nCd S F\n8 2 12\ndirect\n0.516206 0.250020 0.485989 Cd\n0.516212 0.250056 0.013991 Cd\n0.016200 0.485990 0.250024 Cd\n0.016201 0.013987 0.250024 Cd\n0.483797 0.749944 0.514008 Cd\n0.483777 0.749945 0.986007 Cd\n0.983803 0.514009 0.749930 Cd\n0.983790 0.986012 0.749966 Cd\n0.250001 0.750015 0.249986 S\n0.749990 0.249982 0.750006 S\n0.278416 0.250089 0.249945 F\n0.778415 0.249933 0.250081 F\n0.749896 0.535953 0.036168 F\n0.750078 0.536072 0.463974 F\n0.749978 0.963916 0.036084 F\n0.250050 0.464019 0.963825 F\n0.249934 0.036139 0.535980 F\n0.249968 0.036108 0.963930 F\n0.250084 0.463974 0.536064 F\n0.221577 0.750075 0.749932 F\n0.750062 0.963839 0.464006 F\n0.721576 0.749920 0.750068 F\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Cd",
"S",
"F"
],
"chemical_system": "Cd-F-S",
"density": 5.62441468916518,
"density_atomic": 0.06254516532642007,
"volume": 351.7458125689349,
"volume_molar": 9.62846725013956,
"formula_full": "Cd8 S2 F12",
"formula_reduced": "Cd4SF6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 137
},
{
"id": "jvasp-120665",
"created_at": "2022-09-04T14:38:51.628668Z",
"updated_at": "2022-09-04T14:38:51.628684Z",
"structure_string": "Cd8 Sn2 N8\n1.0\n6.038327 0.005758 0.372028\n2.091482 5.237165 2.243933\n0.005761 -0.017283 9.120491\nCd Sn N\n8 2 8\ndirect\n0.714783 0.633177 0.207688 Cd\n0.285216 0.366825 0.792311 Cd\n0.751350 0.238638 0.995424 Cd\n0.248649 0.761364 0.004575 Cd\n0.750053 0.478929 0.588941 Cd\n0.249947 0.521072 0.411058 Cd\n0.248080 0.924045 0.585574 Cd\n0.751919 0.075957 0.414426 Cd\n0.272901 0.159903 0.212859 Sn\n0.727098 0.840099 0.787140 Sn\n0.955125 0.704714 0.622238 N\n0.044874 0.295288 0.377762 N\n0.853692 0.834223 0.993402 N\n0.146307 0.165779 0.006598 N\n0.476444 0.662915 0.811839 N\n0.523555 0.337087 0.188160 N\n0.444549 0.781272 0.370468 N\n0.555450 0.218730 0.629532 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Cd",
"Sn",
"N"
],
"chemical_system": "Cd-N-Sn",
"density": 7.186995370297549,
"density_atomic": 0.06238658843885248,
"volume": 288.52355050064165,
"volume_molar": 9.652941298276847,
"formula_full": "Cd8 Sn2 N8",
"formula_reduced": "Cd4SnN4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.808571522222222,
"spacegroup": 2
},
{
"id": "jvasp-107770",
"created_at": "2022-09-04T14:35:59.618617Z",
"updated_at": "2022-09-04T14:35:59.618635Z",
"structure_string": "Cd4 Te3 Se1\n1.0\n4.546712 0.004312 14.529158\n2.223859 3.965736 14.529158\n0.007354 0.004312 15.223961\nCd Te Se\n4 3 1\ndirect\n0.003597 0.003597 0.003597 Cd\n0.746299 0.746300 0.746300 Cd\n0.498885 0.498886 0.498886 Cd\n0.251317 0.251317 0.251318 Cd\n0.809878 0.809878 0.809879 Te\n0.562218 0.562218 0.562219 Te\n0.314610 0.314610 0.314611 Te\n0.063193 0.063193 0.063193 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cd",
"Te",
"Se"
],
"chemical_system": "Cd-Se-Te",
"density": 5.527687121329948,
"density_atomic": 0.02921954253735287,
"volume": 273.78936510635583,
"volume_molar": 20.60997619076884,
"formula_full": "Cd4 Te3 Se1",
"formula_reduced": "Cd4Te3Se",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-100024",
"created_at": "2022-09-04T14:36:42.618618Z",
"updated_at": "2022-09-04T14:36:42.618633Z",
"structure_string": "Cd4 Te3 Se1\n1.0\n4.583433 0.000000 0.000000\n0.000000 6.462422 0.000000\n0.000000 0.000000 9.172595\nCd Te Se\n4 3 1\ndirect\n0.000000 0.024718 0.000000 Cd\n0.500000 0.491354 0.761559 Cd\n0.000000 0.991704 0.500000 Cd\n0.500000 0.491354 0.238441 Cd\n0.000000 0.750316 0.757667 Te\n0.500000 0.251210 0.500000 Te\n0.000000 0.750316 0.242333 Te\n0.500000 0.249025 0.000000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cd",
"Te",
"Se"
],
"chemical_system": "Cd-Se-Te",
"density": 5.570338762495854,
"density_atomic": 0.02944500056635854,
"volume": 271.69298169890845,
"volume_molar": 20.452167241186633,
"formula_full": "Cd4 Te3 Se1",
"formula_reduced": "Cd4Te3Se",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.00065125,
"spacegroup": 25
},
{
"id": "jvasp-104969",
"created_at": "2022-09-04T14:36:55.159427Z",
"updated_at": "2022-09-04T14:36:55.159440Z",
"structure_string": "Cd4 Te5 Pb1\n1.0\n6.486898 0.022425 -11.066390\n-0.194509 4.620028 -11.965068\n-0.041098 -0.022425 12.827437\nCd Te Pb\n4 5 1\ndirect\n0.394701 0.393645 0.001056 Cd\n0.785136 0.793388 0.991749 Cd\n0.198361 0.206614 0.991749 Cd\n0.607412 0.606355 0.001056 Cd\n0.632748 0.889000 0.743748 Te\n0.038470 0.300773 0.737699 Te\n0.436927 0.699229 0.737699 Te\n0.854748 0.111000 0.743748 Te\n0.303755 0.500001 0.803756 Te\n0.997742 0.000000 0.997742 Pb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cd",
"Te",
"Pb"
],
"chemical_system": "Cd-Pb-Te",
"density": 5.649181084839902,
"density_atomic": 0.02627356166719082,
"volume": 380.6107495691201,
"volume_molar": 22.920915086743506,
"formula_full": "Cd4 Te5 Pb1",
"formula_reduced": "Cd4Te5Pb",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.0,
"spacegroup": 44
},
{
"id": "jvasp-35220",
"created_at": "2022-09-04T14:37:34.910411Z",
"updated_at": "2022-09-04T14:37:34.910423Z",
"structure_string": "Cd5 S4 Cl2\n1.0\n0.000000 4.257796 0.000000\n4.351744 -2.128898 -5.741079\n-8.683157 0.000000 -4.444474\nCd S Cl\n5 4 2\ndirect\n0.555390 0.110777 0.924623 Cd\n0.830103 0.660203 0.988606 Cd\n0.856849 0.713699 0.615444 Cd\n0.451429 0.902858 0.331426 Cd\n0.182112 0.364225 0.272907 Cd\n0.963129 0.926256 0.848925 S\n0.592947 0.185893 0.190341 S\n0.316324 0.632648 0.119454 S\n0.313437 0.626873 0.487459 S\n0.689477 0.378954 0.780689 Cl\n0.026884 0.053767 0.471798 Cl\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Cd",
"S",
"Cl"
],
"chemical_system": "Cd-Cl-S",
"density": 4.29061682081662,
"density_atomic": 0.03733812952640791,
"volume": 294.60500939716593,
"volume_molar": 16.12866213809869,
"formula_full": "Cd5 S4 Cl2",
"formula_reduced": "Cd5(S2Cl)2",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-36509",
"created_at": "2022-09-04T14:37:31.729169Z",
"updated_at": "2022-09-04T14:37:31.729195Z",
"structure_string": "Cd10 S8 Cl4\n1.0\n6.631685 -0.000180 -0.000039\n-3.315465 -9.523384 0.127907\n-3.315603 1.052777 -9.466112\nCd S Cl\n10 8 4\ndirect\n0.000207 0.750061 0.249945 Cd\n0.999793 0.249938 0.750055 Cd\n0.304715 0.055088 0.554504 Cd\n0.695178 0.445185 0.945237 Cd\n0.695285 0.944911 0.445496 Cd\n0.304822 0.554814 0.054762 Cd\n0.404564 0.601187 0.601266 Cd\n0.595436 0.398812 0.398734 Cd\n0.202366 0.898697 0.898630 Cd\n0.797634 0.101303 0.101370 Cd\n0.049428 0.694765 0.017460 S\n0.950303 0.982355 0.305242 S\n0.336998 0.805243 0.482578 S\n0.662951 0.517634 0.194759 S\n0.337049 0.482365 0.805240 S\n0.049697 0.017644 0.694758 S\n0.663002 0.194756 0.517422 S\n0.950572 0.305234 0.982540 S\n0.806924 0.608771 0.608592 Cl\n0.589930 0.891284 0.891514 Cl\n0.410069 0.108715 0.108486 Cl\n0.193076 0.391228 0.391408 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Cd",
"S",
"Cl"
],
"chemical_system": "Cd-Cl-S",
"density": 4.234938096832717,
"density_atomic": 0.03685359793228144,
"volume": 596.9566401745915,
"volume_molar": 16.340713248854822,
"formula_full": "Cd10 S8 Cl4",
"formula_reduced": "Cd5(S2Cl)2",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 0.0025336363636366,
"spacegroup": 72
},
{
"id": "jvasp-106834",
"created_at": "2022-09-04T14:38:47.646321Z",
"updated_at": "2022-09-04T14:38:47.646347Z",
"structure_string": "Cd5 Te4 S1\n1.0\n4.540808 0.003857 18.300277\n2.239752 3.949995 18.300277\n0.006615 0.003857 18.855212\nCd Te S\n5 4 1\ndirect\n0.994960 0.994961 0.994962 Cd\n0.604922 0.604923 0.604923 Cd\n0.202379 0.202379 0.202379 Cd\n0.799898 0.799899 0.799899 Cd\n0.397396 0.397397 0.397397 Cd\n0.553921 0.553922 0.553923 Te\n0.151589 0.151589 0.151589 Te\n0.749117 0.749119 0.749119 Te\n0.346654 0.346655 0.346655 Te\n0.949155 0.949157 0.949157 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cd",
"Te",
"S"
],
"chemical_system": "Cd-S-Te",
"density": 5.4361821952156015,
"density_atomic": 0.029639530644902327,
"volume": 337.38725892138547,
"volume_molar": 20.317935638551493,
"formula_full": "Cd5 Te4 S1",
"formula_reduced": "Cd5Te4S",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-100420",
"created_at": "2022-09-04T14:36:41.965227Z",
"updated_at": "2022-09-04T14:36:41.965256Z",
"structure_string": "Cd5 Te1 S4\n1.0\n4.240210 -0.004975 -14.698876\n-0.089502 4.239268 -14.698876\n0.004876 0.004975 15.298246\nCd Te S\n5 1 4\ndirect\n0.810176 0.810177 0.000001 Cd\n0.189825 0.189825 0.000000 Cd\n0.594488 0.594489 0.000001 Cd\n0.000000 0.000000 0.000000 Cd\n0.405513 0.405513 0.000001 Cd\n0.750001 0.250000 0.500001 Te\n0.141962 0.641961 0.500001 S\n0.547267 0.047266 0.500000 S\n0.952734 0.452734 0.500001 S\n0.358039 0.858039 0.500001 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cd",
"Te",
"S"
],
"chemical_system": "Cd-S-Te",
"density": 4.927978274657248,
"density_atomic": 0.03628369554594746,
"volume": 275.60588439335265,
"volume_molar": 16.59737430101057,
"formula_full": "Cd5 Te1 S4",
"formula_reduced": "Cd5TeS4",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.0,
"spacegroup": 119
},
{
"id": "jvasp-106372",
"created_at": "2022-09-04T14:38:40.227804Z",
"updated_at": "2022-09-04T14:38:40.227834Z",
"structure_string": "Cd1 Ag1\n1.0\n2.894306 -0.009336 4.218387\n1.301145 2.585365 4.218387\n-0.015205 -0.009336 5.115815\nCd Ag\n1 1\ndirect\n0.500001 0.499999 0.500001 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd",
"density": 9.483071411448753,
"density_atomic": 0.051850915471466856,
"volume": 38.57212513635529,
"volume_molar": 11.614338349173288,
"formula_full": "Cd1 Ag1",
"formula_reduced": "CdAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.35632125,
"spacegroup": 166
},
{
"id": "jvasp-109776",
"created_at": "2022-09-04T14:38:20.439565Z",
"updated_at": "2022-09-04T14:38:20.439592Z",
"structure_string": "Cd1 Ag1\n1.0\n3.043812 0.507794 0.000000\n-0.544641 3.037435 0.000000\n0.000000 0.000000 4.031926\nCd Ag\n1 1\ndirect\n0.500000 0.499999 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd",
"density": 9.527617134131681,
"density_atomic": 0.05209447965033188,
"volume": 38.39178380174604,
"volume_molar": 11.560036304080128,
"formula_full": "Cd1 Ag1",
"formula_reduced": "CdAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.34519625,
"spacegroup": 123
},
{
"id": "jvasp-14994",
"created_at": "2022-09-04T14:36:47.944262Z",
"updated_at": "2022-09-04T14:36:47.944288Z",
"structure_string": "Cd1 Ag1\n1.0\n3.372443 -0.000000 -0.000000\n0.000000 3.372443 0.000000\n0.000000 0.000000 3.372443\nCd Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd",
"density": 9.536493865498514,
"density_atomic": 0.05214301525950265,
"volume": 38.356048073677826,
"volume_molar": 11.549276024850736,
"formula_full": "Cd1 Ag1",
"formula_reduced": "CdAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.34684125,
"spacegroup": 221
}
]
}