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=-created_at&page=651",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=649",
"results": [
{
"id": "jvasp-32820",
"created_at": "2022-09-04T14:38:34.541281Z",
"updated_at": "2022-09-04T14:38:34.541313Z",
"structure_string": "Sn4 I4 Cl4\n1.0\n4.404704 0.000000 0.000000\n0.000000 8.532576 0.000000\n0.000000 0.000000 10.186893\nSn I Cl\n4 4 4\ndirect\n0.749999 0.647439 0.851797 Sn\n0.250000 0.352561 0.148203 Sn\n0.749999 0.147439 0.648202 Sn\n0.250000 0.852562 0.351797 Sn\n0.749999 0.991876 0.169252 I\n0.250000 0.508124 0.669252 I\n0.749999 0.491876 0.330747 I\n0.250000 0.008124 0.830747 I\n0.250000 0.645798 0.053007 Cl\n0.749999 0.854203 0.553007 Cl\n0.250000 0.145797 0.446993 Cl\n0.749999 0.354203 0.946993 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sn",
"I",
"Cl"
],
"chemical_system": "Cl-I-Sn",
"density": 4.876194662249585,
"density_atomic": 0.03134314757880977,
"volume": 382.858804139788,
"volume_molar": 19.213580081125617,
"formula_full": "Sn4 I4 Cl4",
"formula_reduced": "SnICl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-20859",
"created_at": "2022-09-04T14:38:34.539174Z",
"updated_at": "2022-09-04T14:38:34.539199Z",
"structure_string": "Ag2 Te8 Au2\n1.0\n0.000000 9.014416 0.054644\n4.502062 0.000000 0.000000\n0.000000 -5.753913 -8.551847\nAg Te Au\n2 8 2\ndirect\n0.500001 0.488826 0.750001 Ag\n0.500001 0.511173 0.250000 Ag\n0.808673 0.412507 0.546832 Te\n0.191328 0.412507 0.953169 Te\n0.299523 0.971914 0.297005 Te\n0.700478 0.971914 0.202996 Te\n0.700479 0.028085 0.702996 Te\n0.299523 0.028085 0.797005 Te\n0.808673 0.587492 0.046832 Te\n0.191328 0.587492 0.453169 Te\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Te",
"Au"
],
"chemical_system": "Ag-Au-Te",
"density": 7.8329926772346505,
"density_atomic": 0.034717398926829436,
"volume": 345.6480142792742,
"volume_molar": 17.346174961702328,
"formula_full": "Ag2 Te8 Au2",
"formula_reduced": "AgTe4Au",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.694055982777778,
"spacegroup": 13
},
{
"id": "jvasp-56600",
"created_at": "2022-09-04T14:38:34.537371Z",
"updated_at": "2022-09-04T14:38:34.537395Z",
"structure_string": "Dy16 Cd4 Rh4\n1.0\n8.260751 -0.000000 4.769347\n2.753584 7.788310 4.769347\n-0.000000 -0.000000 9.538694\nDy Cd Rh\n16 4 4\ndirect\n0.935886 0.564113 0.564114 Dy\n0.935886 0.564113 0.935887 Dy\n0.564113 0.935886 0.935887 Dy\n0.810735 0.189264 0.810736 Dy\n0.350152 0.350153 0.949541 Dy\n0.189264 0.810736 0.810736 Dy\n0.949541 0.350153 0.350153 Dy\n0.189264 0.810736 0.189265 Dy\n0.189264 0.189264 0.810735 Dy\n0.935886 0.935886 0.564114 Dy\n0.810735 0.189264 0.189265 Dy\n0.564113 0.935886 0.564114 Dy\n0.564113 0.564113 0.935887 Dy\n0.810735 0.810736 0.189265 Dy\n0.350152 0.350153 0.350153 Dy\n0.350152 0.949541 0.350153 Dy\n0.581777 0.254669 0.581777 Cd\n0.254669 0.581777 0.581778 Cd\n0.581777 0.581777 0.254670 Cd\n0.581777 0.581777 0.581778 Cd\n0.572332 0.142556 0.142557 Rh\n0.142556 0.142556 0.572332 Rh\n0.142556 0.572332 0.142557 Rh\n0.142556 0.142556 0.142556 Rh\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Dy",
"Cd",
"Rh"
],
"chemical_system": "Cd-Dy-Rh",
"density": 9.365530784816476,
"density_atomic": 0.03910745584842234,
"volume": 613.6937184822827,
"volume_molar": 15.3989581509505,
"formula_full": "Dy16 Cd4 Rh4",
"formula_reduced": "Dy4CdRh",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1390314583333327,
"spacegroup": 216
},
{
"id": "jvasp-11396",
"created_at": "2022-09-04T14:38:34.536480Z",
"updated_at": "2022-09-04T14:38:34.536516Z",
"structure_string": "Sr4 Mg4 Si4\n1.0\n4.597113 0.000000 0.000000\n0.000000 7.802468 0.000000\n0.000000 0.000000 8.481038\nSr Mg Si\n4 4 4\ndirect\n0.250000 0.014401 0.184141 Sr\n0.250000 0.514401 0.315859 Sr\n0.749999 0.485599 0.684141 Sr\n0.749999 0.985599 0.815859 Sr\n0.749999 0.355198 0.065163 Mg\n0.250000 0.644802 0.934837 Mg\n0.749999 0.855198 0.434837 Mg\n0.250000 0.144802 0.565163 Mg\n0.749999 0.218843 0.391249 Si\n0.250000 0.281157 0.891249 Si\n0.250000 0.781158 0.608752 Si\n0.749999 0.718843 0.108752 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Si"
],
"chemical_system": "Mg-Si-Sr",
"density": 3.05705682076497,
"density_atomic": 0.03944709823690406,
"volume": 304.2048854375201,
"volume_molar": 15.266371999870168,
"formula_full": "Sr4 Mg4 Si4",
"formula_reduced": "SrMgSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5156258083333332,
"spacegroup": 62
},
{
"id": "jvasp-26249",
"created_at": "2022-09-04T14:38:34.536122Z",
"updated_at": "2022-09-04T14:38:34.536146Z",
"structure_string": "Ga6 Te6\n1.0\n4.143298 -0.000000 0.000000\n-2.071649 8.513650 -2.171211\n0.000000 0.041204 10.575395\nGa Te\n6 6\ndirect\n0.136297 0.272595 0.417897 Ga\n0.863702 0.727405 0.582103 Ga\n0.239995 0.479990 0.299481 Ga\n0.760005 0.520010 0.700519 Ga\n0.563075 0.126152 0.081963 Ga\n0.436924 0.873848 0.918036 Ga\n0.156610 0.313220 0.049241 Te\n0.843390 0.686779 0.950759 Te\n0.158897 0.317794 0.677983 Te\n0.841103 0.682205 0.322017 Te\n0.538943 0.077887 0.327490 Te\n0.461057 0.922113 0.672509 Te\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ga",
"Te"
],
"chemical_system": "Ga-Te",
"density": 5.264876391298269,
"density_atomic": 0.03213596663678929,
"volume": 373.413382445524,
"volume_molar": 18.73956625628882,
"formula_full": "Ga6 Te6",
"formula_reduced": "GaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0486225888888889,
"spacegroup": 12
},
{
"id": "jvasp-21714",
"created_at": "2022-09-04T14:38:34.531569Z",
"updated_at": "2022-09-04T14:38:34.531581Z",
"structure_string": "Sm2 Zn6 Ge3\n1.0\n3.821767 -6.619496 -0.000000\n3.821767 6.619496 0.000000\n-0.000000 -0.000000 4.060666\nSm Zn Ge\n2 6 3\ndirect\n0.666667 0.333333 0.000000 Sm\n0.333333 0.666667 0.000000 Sm\n0.000000 0.285087 0.500000 Zn\n0.285087 0.000000 0.500000 Zn\n0.000000 0.809895 0.000000 Zn\n0.190106 0.190106 0.000000 Zn\n0.714914 0.714914 0.500000 Zn\n0.809895 0.000000 0.000000 Zn\n0.000000 0.612347 0.500000 Ge\n0.387653 0.387653 0.500000 Ge\n0.612347 0.000000 0.500000 Ge\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Sm",
"Zn",
"Ge"
],
"chemical_system": "Ge-Sm-Zn",
"density": 7.363696646903701,
"density_atomic": 0.05353974398976478,
"volume": 205.4548486840519,
"volume_molar": 11.247981987271467,
"formula_full": "Sm2 Zn6 Ge3",
"formula_reduced": "Sm2(Zn2Ge)3",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-13955",
"created_at": "2022-09-04T14:38:34.525197Z",
"updated_at": "2022-09-04T14:38:34.525223Z",
"structure_string": "Bi2 Te1 Se2\n1.0\n4.181373 -0.008043 9.303451\n1.988143 3.678482 9.303451\n-0.013519 -0.008043 10.199897\nBi Te Se\n2 1 2\ndirect\n0.594687 0.594689 0.594689 Bi\n0.405311 0.405312 0.405312 Bi\n0.000000 0.000000 0.000000 Te\n0.210223 0.210224 0.210224 Se\n0.789775 0.789777 0.789778 Se\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Bi",
"Te",
"Se"
],
"chemical_system": "Bi-Se-Te",
"density": 7.408566306728528,
"density_atomic": 0.03171048104250371,
"volume": 157.67657366339418,
"volume_molar": 18.991010423109373,
"formula_full": "Bi2 Te1 Se2",
"formula_reduced": "Bi2TeSe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.10677262,
"spacegroup": 166
},
{
"id": "jvasp-56746",
"created_at": "2022-09-04T14:38:34.522328Z",
"updated_at": "2022-09-04T14:38:34.522354Z",
"structure_string": "Lu2 Al2 Si2\n1.0\n3.978179 0.000000 0.000000\n-1.989089 5.048517 0.000000\n0.000000 0.000000 5.626847\nLu Al Si\n2 2 2\ndirect\n0.306653 0.613305 0.750000 Lu\n0.693348 0.386695 0.250000 Lu\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.604446 0.208891 0.750000 Si\n0.395554 0.791110 0.250000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Lu",
"Al",
"Si"
],
"chemical_system": "Al-Lu-Si",
"density": 6.760175137042939,
"density_atomic": 0.053093089830567736,
"volume": 113.00905671806595,
"volume_molar": 11.342607445183614,
"formula_full": "Lu2 Al2 Si2",
"formula_reduced": "LuAlSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.63048905,
"spacegroup": 63
},
{
"id": "jvasp-58575",
"created_at": "2022-09-04T14:38:34.520586Z",
"updated_at": "2022-09-04T14:38:34.520611Z",
"structure_string": "Mg2 Mo4 O8\n1.0\n2.791263 0.000000 0.000000\n-1.395631 4.844604 -0.000000\n-0.000000 -0.000000 10.400207\nMg Mo O\n2 4 8\ndirect\n0.414835 0.829670 0.750000 Mg\n0.585164 0.170329 0.250000 Mg\n0.842597 0.685196 0.063079 Mo\n0.157402 0.314804 0.936921 Mo\n0.842597 0.685196 0.436921 Mo\n0.157402 0.314804 0.563079 Mo\n0.197618 0.395239 0.367900 O\n0.802380 0.604760 0.632101 O\n0.802380 0.604760 0.867900 O\n0.197618 0.395239 0.132100 O\n0.932521 0.865045 0.250000 O\n0.067478 0.134954 0.750000 O\n0.499999 -0.000000 0.000000 O\n0.499999 -0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O",
"density": 6.616361542888526,
"density_atomic": 0.09954673266957498,
"volume": 140.63746367718704,
"volume_molar": 6.049561445667197,
"formula_full": "Mg2 Mo4 O8",
"formula_reduced": "Mg(MoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.075152121428571,
"spacegroup": 63
},
{
"id": "jvasp-56879",
"created_at": "2022-09-04T14:38:34.519152Z",
"updated_at": "2022-09-04T14:38:34.519179Z",
"structure_string": "Fe3 Ni1 N1\n1.0\n3.761724 -0.000000 -0.000000\n-0.000000 3.761724 0.000000\n-0.000000 0.000000 3.761724\nFe Ni N\n3 1 1\ndirect\n0.000000 0.499999 0.499999 Fe\n0.499999 0.000000 0.499999 Fe\n0.499999 0.499999 0.000000 Fe\n0.000000 0.000000 0.000000 Ni\n0.499999 0.499999 0.499999 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Fe",
"Ni",
"N"
],
"chemical_system": "Fe-N-Ni",
"density": 7.494191298215177,
"density_atomic": 0.0939310593993452,
"volume": 53.23052919846931,
"volume_molar": 6.411234791249444,
"formula_full": "Fe3 Ni1 N1",
"formula_reduced": "Fe3NiN",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.4929304300000004,
"spacegroup": 221
},
{
"id": "jvasp-57680",
"created_at": "2022-09-04T14:38:34.518156Z",
"updated_at": "2022-09-04T14:38:34.518184Z",
"structure_string": "Rh4 N12\n1.0\n5.371854 -0.000000 -1.899238\n-2.685927 4.652162 -1.899238\n0.000000 0.000000 5.697712\nRh N\n4 12\ndirect\n0.500000 0.000000 -0.000000 Rh\n-0.000000 -0.000000 0.500000 Rh\n-0.000000 0.500000 -0.000000 Rh\n0.499999 0.500000 0.499999 Rh\n0.506706 0.888418 0.618288 N\n0.270129 0.888418 0.381710 N\n0.729870 0.111581 0.618288 N\n0.111581 0.381711 0.493293 N\n0.493293 0.111581 0.381710 N\n0.111581 0.618289 0.729870 N\n0.381710 0.270129 0.888418 N\n0.888417 0.618289 0.506706 N\n0.618288 0.729870 0.111580 N\n0.888418 0.381711 0.270128 N\n0.618288 0.506707 0.888417 N\n0.381710 0.493293 0.111581 N\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Rh",
"N"
],
"chemical_system": "N-Rh",
"density": 6.760435480119113,
"density_atomic": 0.11236743287381878,
"volume": 142.39001097379295,
"volume_molar": 5.359329305638287,
"formula_full": "Rh4 N12",
"formula_reduced": "RhN3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.7333806875,
"spacegroup": 204
},
{
"id": "jvasp-26078",
"created_at": "2022-09-04T14:38:34.517552Z",
"updated_at": "2022-09-04T14:38:34.517571Z",
"structure_string": "Na2 C1 N2\n1.0\n3.428187 0.009038 0.842450\n-0.174125 3.423774 0.842450\n-0.030162 -0.031819 5.498857\nNa C N\n2 1 2\ndirect\n0.323047 0.323046 0.309240 Na\n0.676955 0.676953 0.690760 Na\n0.000000 0.000000 0.000000 C\n0.160345 0.160344 0.773751 N\n0.839657 0.839655 0.226250 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"C",
"N"
],
"chemical_system": "C-N-Na",
"density": 2.206144606803469,
"density_atomic": 0.07723925165333494,
"volume": 64.73392598935307,
"volume_molar": 7.79673628510613,
"formula_full": "Na2 C1 N2",
"formula_reduced": "Na2CN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.0635069,
"spacegroup": 12
}
]
}