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=-updated_at&page=170",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=168",
"results": [
{
"id": "jvasp-113679",
"created_at": "2022-09-04T14:38:50.868214Z",
"updated_at": "2022-09-04T14:38:50.868241Z",
"structure_string": "Rb2 Al1 O2\n1.0\n-2.049188 2.049188 6.912616\n2.049188 -2.049188 6.912616\n2.049188 2.049188 -6.912616\nRb Al O\n2 1 2\ndirect\n0.333529 0.333529 0.000000 Rb\n0.666471 0.666471 0.000000 Rb\n0.000000 0.000000 0.000000 Al\n0.877001 0.877001 0.000000 O\n0.123000 0.123000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Al",
"O"
],
"chemical_system": "Al-O-Rb",
"density": 3.2881539670936477,
"density_atomic": 0.043062969356995696,
"volume": 116.10903926641873,
"volume_molar": 13.984499559414816,
"formula_full": "Rb2 Al1 O2",
"formula_reduced": "Rb2AlO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6471119599999996,
"spacegroup": 139
},
{
"id": "jvasp-116676",
"created_at": "2022-09-04T14:38:50.864813Z",
"updated_at": "2022-09-04T14:38:50.864839Z",
"structure_string": "Mn2 Cr3 Ga1 S8\n1.0\n6.205985 0.006784 3.602238\n2.077397 5.847967 3.602238\n0.009598 0.006784 7.175672\nMn Cr Ga S\n2 3 1 8\ndirect\n0.374968 0.374967 0.374968 Mn\n0.625033 0.625032 0.625033 Mn\n0.500000 -0.000000 0.000000 Cr\n0.000000 -0.000000 0.500000 Cr\n0.000000 0.500000 -0.000000 Cr\n0.000000 0.000000 0.000000 Ga\n0.240000 0.240000 0.240000 S\n0.779271 0.243546 0.243548 S\n0.243547 0.243546 0.779271 S\n0.243547 0.779271 0.243547 S\n0.760000 0.759999 0.760000 S\n0.220730 0.756453 0.756453 S\n0.756453 0.756453 0.220730 S\n0.756453 0.220728 0.756453 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Mn",
"Cr",
"Ga",
"S"
],
"chemical_system": "Cr-Ga-Mn-S",
"density": 3.781338690557607,
"density_atomic": 0.053842353511409466,
"volume": 260.01835148297016,
"volume_molar": 11.184765091525723,
"formula_full": "Mn2 Cr3 Ga1 S8",
"formula_reduced": "Mn2Cr3GaS8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.263957071982759,
"spacegroup": 166
},
{
"id": "jvasp-119342",
"created_at": "2022-09-04T14:38:50.859401Z",
"updated_at": "2022-09-04T14:38:50.859430Z",
"structure_string": "Li2 Mn1 Cu3 O8\n1.0\n5.052505 0.018464 2.922239\n1.694369 4.759964 2.922239\n0.026070 0.018464 5.836661\nLi Mn Cu O\n2 1 3 8\ndirect\n0.130664 0.130663 0.130664 Li\n0.869338 0.869334 0.869337 Li\n0.500001 0.499999 0.500000 Mn\n0.500001 -0.000001 0.500000 Cu\n0.000000 0.499999 0.500000 Cu\n0.500001 0.499999 0.000000 Cu\n0.267869 0.267867 0.267868 O\n0.274854 0.274852 0.717063 O\n0.717064 0.274852 0.274853 O\n0.274854 0.717061 0.274854 O\n0.725148 0.282936 0.725147 O\n0.282938 0.725145 0.725147 O\n0.725148 0.725145 0.282938 O\n0.732133 0.732130 0.732132 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Cu",
"O"
],
"chemical_system": "Cu-Li-Mn-O",
"density": 4.6072571598292384,
"density_atomic": 0.10025408769266306,
"volume": 139.64517878730413,
"volume_molar": 6.006878022232225,
"formula_full": "Li2 Mn1 Cu3 O8",
"formula_reduced": "Li2MnCu3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.0038026136699507,
"spacegroup": 166
},
{
"id": "jvasp-113674",
"created_at": "2022-09-04T14:38:50.851902Z",
"updated_at": "2022-09-04T14:38:50.851932Z",
"structure_string": "Al1 P1 O4\n1.0\n-2.459017 2.459017 3.703786\n2.459017 -2.459017 3.703786\n2.459017 2.459017 -3.703786\nAl P O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.750002 0.250000 0.500001 P\n-0.014696 0.597007 0.846834 O\n0.861531 0.014697 0.611705 O\n0.750176 0.138471 0.153169 O\n0.402995 0.249826 0.388298 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"P",
"O"
],
"chemical_system": "Al-O-P",
"density": 2.2605405001957726,
"density_atomic": 0.06697647874017462,
"volume": 89.58368837627484,
"volume_molar": 8.99142635336505,
"formula_full": "Al1 P1 O4",
"formula_reduced": "AlPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.1843503833333338,
"spacegroup": 82
},
{
"id": "jvasp-119502",
"created_at": "2022-09-04T14:38:50.850697Z",
"updated_at": "2022-09-04T14:38:50.850724Z",
"structure_string": "Dy4 Mn2 Sb2 O14\n1.0\n6.371322 -0.034455 -3.494182\n-2.051542 5.855534 -3.782609\n-0.016659 0.034455 7.266551\nDy Mn Sb O\n4 2 2 14\ndirect\n0.000000 0.500000 -0.000000 Dy\n-0.000000 -0.000000 0.500000 Dy\n-0.000000 0.499999 0.499999 Dy\n0.500000 0.500000 0.000000 Dy\n0.500000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 -0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.590508 0.917084 0.255737 O\n0.161346 0.334770 0.244263 O\n0.580682 0.330682 0.250000 O\n0.167540 0.917539 0.249999 O\n0.409492 0.665229 0.326576 O\n0.838654 0.082916 0.173425 O\n0.832460 0.082460 0.750000 O\n0.838653 0.665229 0.755737 O\n0.419318 0.669317 0.749999 O\n0.161346 0.917083 0.826575 O\n0.126163 0.376162 0.749999 O\n0.873837 0.623837 0.250000 O\n0.409492 0.082915 0.744262 O\n0.590507 0.334770 0.673424 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Sb",
"O"
],
"chemical_system": "Dy-Mn-O-Sb",
"density": 7.51195637186928,
"density_atomic": 0.08108581329670972,
"volume": 271.31749816083686,
"volume_molar": 7.426873475343639,
"formula_full": "Dy4 Mn2 Sb2 O14",
"formula_reduced": "Dy2MnSbO7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.5624509855799364,
"spacegroup": 74
},
{
"id": "jvasp-119370",
"created_at": "2022-09-04T14:38:50.849778Z",
"updated_at": "2022-09-04T14:38:50.849795Z",
"structure_string": "Li6 Fe1 O5 F1\n1.0\n4.851018 0.072286 2.462453\n1.641138 4.595434 2.560919\n0.062437 0.023195 5.507949\nLi Fe O F\n6 1 5 1\ndirect\n0.697950 0.468582 0.057573 Li\n0.510341 0.084408 0.747200 Li\n0.915229 0.306630 0.509301 Li\n0.076841 0.707923 0.473258 Li\n0.516932 0.916965 0.268979 Li\n0.261191 0.487367 0.926265 Li\n0.034169 0.987248 0.961490 Fe\n0.356705 0.807757 0.089567 O\n0.920421 0.666598 0.209074 O\n0.208105 0.888689 0.646965 O\n0.102192 0.340355 0.789372 O\n0.657216 0.210940 0.917975 O\n0.777713 0.126905 0.385410 F\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 2.6910624318006096,
"density_atomic": 0.1072224003793413,
"volume": 121.24332186191879,
"volume_molar": 5.616495003557386,
"formula_full": "Li6 Fe1 O5 F1",
"formula_reduced": "Li6FeO5F",
"formula_anonymous": "ABC5D6",
"energy_above_hull": 1.6835448678846154,
"spacegroup": 1
},
{
"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-119089",
"created_at": "2022-09-04T14:38:50.843043Z",
"updated_at": "2022-09-04T14:38:50.843063Z",
"structure_string": "Na10 Tb2 O12\n1.0\n5.877013 -0.019443 0.526369\n-3.004052 5.051270 0.526369\n-0.017765 -0.031115 11.058976\nTb Na O\n2 10 12\ndirect\n0.084137 0.915863 0.250000 Tb\n0.915862 0.084136 0.750000 Tb\n0.821538 0.643112 0.000015 Na\n0.178462 0.356889 -0.000015 Na\n0.356888 0.178462 0.499985 Na\n0.643111 0.821538 0.500016 Na\n0.583333 0.416666 0.750000 Na\n0.500000 0.000000 0.000000 Na\n0.749993 0.250007 0.250000 Na\n0.250006 0.749992 0.750000 Na\n0.416666 0.583334 0.250000 Na\n-0.000000 0.500000 0.500000 Na\n0.188180 0.042188 0.870110 O\n0.811819 0.957811 0.129891 O\n0.729475 0.564100 0.368844 O\n0.270524 0.435900 0.631157 O\n0.435900 0.270525 0.131156 O\n0.122558 0.641932 0.131195 O\n0.877441 0.358067 0.868805 O\n0.358067 0.877442 0.368805 O\n0.641932 0.122557 0.631195 O\n0.042189 0.188181 0.370109 O\n0.564099 0.729475 0.868844 O\n0.957810 0.811818 0.629891 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tb",
"Na",
"O"
],
"chemical_system": "Na-O-Tb",
"density": 3.7467653730760833,
"density_atomic": 0.07320467871337577,
"volume": 327.8478974543301,
"volume_molar": 8.226442443083423,
"formula_full": "Na10 Tb2 O12",
"formula_reduced": "Na5TbO6",
"formula_anonymous": "AB5C6",
"energy_above_hull": 1.1212253666666667,
"spacegroup": 15
},
{
"id": "jvasp-117134",
"created_at": "2022-09-04T14:38:50.838304Z",
"updated_at": "2022-09-04T14:38:50.838330Z",
"structure_string": "La6 Mn2 O14\n1.0\n5.311074 0.000000 0.000000\n-0.000000 5.328689 1.464310\n-0.000000 0.047274 10.546288\nLa Mn O\n6 2 14\ndirect\n0.239139 0.403569 0.140203 La\n0.245434 0.063541 0.855088 La\n0.234509 0.241622 0.500280 La\n0.739139 0.596431 0.859797 La\n0.745434 0.936459 0.144912 La\n0.734509 0.758378 0.499720 La\n0.236997 0.648713 0.676073 Mn\n0.736996 0.351287 0.323927 Mn\n0.735530 0.308497 0.495145 O\n0.484953 0.418705 0.709134 O\n0.499837 0.103907 0.326536 O\n0.477283 0.900589 0.668195 O\n0.497267 0.589544 0.291831 O\n0.219654 0.024558 0.075865 O\n-0.000163 0.896092 0.673464 O\n0.235530 0.691503 0.504855 O\n0.977283 0.099410 0.331805 O\n0.739361 0.406401 0.099494 O\n0.997267 0.410456 0.708169 O\n0.984952 0.581294 0.290866 O\n0.239362 0.593598 0.900507 O\n0.719653 0.975441 0.924135 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"La",
"Mn",
"O"
],
"chemical_system": "La-Mn-O",
"density": 6.502265623802251,
"density_atomic": 0.07379987308474015,
"volume": 298.10349368404286,
"volume_molar": 8.160096363695805,
"formula_full": "La6 Mn2 O14",
"formula_reduced": "La3MnO7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.6666115219435733,
"spacegroup": 4
},
{
"id": "jvasp-118027",
"created_at": "2022-09-04T14:38:50.838058Z",
"updated_at": "2022-09-04T14:38:50.838093Z",
"structure_string": "H1 N1 Cl2\n1.0\n4.965236 0.000000 0.000000\n-0.000000 4.965236 -0.000000\n0.000000 -0.000000 3.832759\nH N Cl\n1 1 2\ndirect\n0.500000 0.500000 0.443508 H\n0.000000 0.000000 0.096426 N\n0.000000 0.000000 0.690683 Cl\n0.500000 0.500000 0.779384 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 1.5099247278946717,
"density_atomic": 0.042331990318176166,
"volume": 94.49118668730566,
"volume_molar": 14.22598067025982,
"formula_full": "H1 N1 Cl2",
"formula_reduced": "HNCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.16052534625,
"spacegroup": 99
},
{
"id": "jvasp-119410",
"created_at": "2022-09-04T14:38:50.835470Z",
"updated_at": "2022-09-04T14:38:50.835505Z",
"structure_string": "La4 H10\n1.0\n5.097551 -0.009250 -4.645973\n-1.000239 4.998463 -4.645973\n0.007596 0.009250 6.897103\nLa H\n4 10\ndirect\n0.504575 0.004574 0.500000 La\n0.245426 0.245426 -0.000000 La\n0.995426 0.495425 0.500000 La\n0.754574 0.754574 -0.000000 La\n0.605224 0.625000 0.480224 H\n0.144776 0.125000 0.519776 H\n0.605225 0.125000 0.980225 H\n0.144775 0.625000 0.019775 H\n0.375000 0.394775 0.519776 H\n0.875000 0.855224 0.480224 H\n0.875000 0.394775 0.019776 H\n0.375000 0.855224 0.980224 H\n0.750000 0.250000 0.500000 H\n0.000000 0.000000 0.000000 H\n",
"nsites": 14,
"nelements": 2,
"elements": [
"La",
"H"
],
"chemical_system": "H-La",
"density": 5.333911802111097,
"density_atomic": 0.07949459608571921,
"volume": 176.11259996722,
"volume_molar": 7.5755347615155015,
"formula_full": "La4 H10",
"formula_reduced": "La2H5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.611008571428572,
"spacegroup": 141
},
{
"id": "jvasp-123410",
"created_at": "2022-09-04T14:38:50.833499Z",
"updated_at": "2022-09-04T14:38:50.833521Z",
"structure_string": "Zr1 Mn1\n1.0\n1.601811 -2.774416 -0.000000\n1.601811 2.774416 -0.000000\n0.000000 -0.000000 3.834700\nZr Mn\n1 1\ndirect\n0.333333 0.666667 0.750000 Zr\n0.666667 0.333333 0.250000 Mn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Mn"
],
"chemical_system": "Mn-Zr",
"density": 7.120975096739789,
"density_atomic": 0.05867941214949647,
"volume": 34.0835043627335,
"volume_molar": 10.262783043322761,
"formula_full": "Zr1 Mn1",
"formula_reduced": "ZrMn",
"formula_anonymous": "AB",
"energy_above_hull": 3.032795870689655,
"spacegroup": 187
}
]
}