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_anonymous&page=160",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=158",
"results": [
{
"id": "jvasp-100853",
"created_at": "2022-09-04T14:36:42.769095Z",
"updated_at": "2022-09-04T14:36:42.769104Z",
"structure_string": "Ba2 Ge3\n1.0\n6.430618 0.064655 -1.504090\n-1.029626 3.862420 -5.257461\n-0.045975 -0.064655 6.604015\nBa Ge\n2 3\ndirect\n0.777516 0.764945 0.012569 Ba\n0.247624 0.235054 0.012570 Ba\n0.646202 -0.000000 0.646202 Ge\n0.341436 -0.000000 0.341436 Ge\n0.822282 0.499999 0.322281 Ge\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ba",
"Ge"
],
"chemical_system": "Ba-Ge",
"density": 5.051153752318222,
"density_atomic": 0.030877349299165795,
"volume": 161.93099840131302,
"volume_molar": 19.503425315600843,
"formula_full": "Ba2 Ge3",
"formula_reduced": "Ba2Ge3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.4215051899999999,
"spacegroup": 44
},
{
"id": "jvasp-7767",
"created_at": "2022-09-04T14:36:32.282270Z",
"updated_at": "2022-09-04T14:36:32.282296Z",
"structure_string": "Dy2 O3\n1.0\n1.836215 -3.180418 0.000000\n1.836215 3.180418 -0.000000\n0.000000 0.000000 5.832771\nDy O\n2 3\ndirect\n0.666666 0.333332 0.751445 Dy\n0.333332 0.666666 0.248555 Dy\n0.666666 0.333332 0.354165 O\n0.333332 0.666666 0.645835 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Dy",
"O"
],
"chemical_system": "Dy-O",
"density": 9.091659837042984,
"density_atomic": 0.07339345779635448,
"volume": 68.12596313248447,
"volume_molar": 8.205282787887839,
"formula_full": "Dy2 O3",
"formula_reduced": "Dy2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3808626999999998,
"spacegroup": 164
},
{
"id": "jvasp-92796",
"created_at": "2022-09-04T14:36:31.781976Z",
"updated_at": "2022-09-04T14:36:31.781994Z",
"structure_string": "La2 O3\n1.0\n7.912945 -0.000000 -0.000000\n2.637649 3.730198 -0.000000\n2.637649 -1.865099 3.230447\nLa O\n2 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.000000 0.000000 La\n-0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"La",
"O"
],
"chemical_system": "La-O",
"density": 5.673874281735208,
"density_atomic": 0.05243694144209912,
"volume": 95.35262474301635,
"volume_molar": 11.484538560758066,
"formula_full": "La2 O3",
"formula_reduced": "La2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.8770987,
"spacegroup": 221
},
{
"id": "jvasp-99506",
"created_at": "2022-09-04T14:36:35.615269Z",
"updated_at": "2022-09-04T14:36:35.615294Z",
"structure_string": "Mo6 C4\n1.0\n3.067373 -0.000000 0.000000\n-1.533685 2.656423 0.000000\n-0.000000 -0.000000 14.508838\nMo C\n6 4\ndirect\n0.000000 0.000000 0.245804 Mo\n0.000000 0.000000 0.754196 Mo\n0.333332 0.666666 0.408451 Mo\n0.666665 0.333333 0.591550 Mo\n0.666665 0.333333 0.916454 Mo\n0.333332 0.666666 0.083546 Mo\n0.666665 0.333333 0.320189 C\n0.333332 0.666666 0.679811 C\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 8.76024819611386,
"density_atomic": 0.08458698515938694,
"volume": 118.22149685506626,
"volume_molar": 7.119464949191065,
"formula_full": "Mo6 C4",
"formula_reduced": "Mo3C2",
"formula_anonymous": "A2B3",
"energy_above_hull": 6.39622954,
"spacegroup": 164
},
{
"id": "jvasp-102306",
"created_at": "2022-09-04T14:36:43.464338Z",
"updated_at": "2022-09-04T14:36:43.464372Z",
"structure_string": "Mg2 Sb3\n1.0\n4.744366 -0.000000 0.000000\n-2.372183 4.108741 0.000000\n0.000000 0.000000 7.252636\nMg Sb\n2 3\ndirect\n0.333334 0.666667 0.162906 Mg\n0.666667 0.333333 0.837094 Mg\n0.333334 0.666667 0.583485 Sb\n0.666667 0.333333 0.416515 Sb\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Mg",
"Sb"
],
"chemical_system": "Mg-Sb",
"density": 4.861286297995896,
"density_atomic": 0.03536610013688121,
"volume": 141.37832502447156,
"volume_molar": 17.028003474207964,
"formula_full": "Mg2 Sb3",
"formula_reduced": "Mg2Sb3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.9278293114285716,
"spacegroup": 164
},
{
"id": "jvasp-27512",
"created_at": "2022-09-04T14:36:37.353978Z",
"updated_at": "2022-09-04T14:36:37.354027Z",
"structure_string": "Dy8 Se12\n1.0\n4.010682 0.000000 0.000000\n-0.000000 10.947503 0.000000\n0.000000 0.000000 11.118662\nDy Se\n8 12\ndirect\n0.250000 0.998675 0.806057 Dy\n0.750000 0.001325 0.193942 Dy\n0.750000 0.498675 0.693942 Dy\n0.250000 0.501325 0.306058 Dy\n0.250000 0.187458 0.486588 Dy\n0.750000 0.812542 0.513412 Dy\n0.750000 0.687458 0.013412 Dy\n0.250000 0.312542 0.986588 Dy\n0.750000 0.125463 0.955104 Se\n0.250000 0.874537 0.044896 Se\n0.250000 0.556205 0.881250 Se\n0.750000 0.443795 0.118750 Se\n0.750000 0.056205 0.618750 Se\n0.750000 0.696208 0.273787 Se\n0.250000 0.196208 0.226213 Se\n0.750000 0.803791 0.773786 Se\n0.750000 0.374537 0.455104 Se\n0.250000 0.303791 0.726213 Se\n0.250000 0.943795 0.381250 Se\n0.250000 0.625463 0.544896 Se\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Dy",
"Se"
],
"chemical_system": "Dy-Se",
"density": 7.644812401865095,
"density_atomic": 0.04096794367457027,
"volume": 488.1865723813337,
"volume_molar": 14.699641280111598,
"formula_full": "Dy8 Se12",
"formula_reduced": "Dy2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.0985006199999998,
"spacegroup": 62
},
{
"id": "jvasp-100643",
"created_at": "2022-09-04T14:36:36.531491Z",
"updated_at": "2022-09-04T14:36:36.531512Z",
"structure_string": "Sc2 Se3\n1.0\n4.932911 -0.013043 -4.604051\n-0.477109 3.621230 -5.673635\n0.011480 0.013043 6.747650\nSc Se\n2 3\ndirect\n0.662190 0.162190 0.500000 Sc\n0.337810 0.837810 0.499999 Sc\n0.500000 0.500000 0.000000 Se\n0.176829 0.176830 0.000000 Se\n0.823170 0.823171 0.000000 Se\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sc",
"Se"
],
"chemical_system": "Sc-Se",
"density": 4.481804040706657,
"density_atomic": 0.04129548663555219,
"volume": 121.07860706732515,
"volume_molar": 14.583048295683257,
"formula_full": "Sc2 Se3",
"formula_reduced": "Sc2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.6448941200000002,
"spacegroup": 71
},
{
"id": "jvasp-102165",
"created_at": "2022-09-04T14:36:37.328720Z",
"updated_at": "2022-09-04T14:36:37.328735Z",
"structure_string": "W4 N6\n1.0\n4.944424 0.001897 0.792613\n-2.639979 4.180651 0.792613\n-0.000571 -0.001036 5.371461\nW N\n4 6\ndirect\n0.330614 0.993546 0.008951 W\n0.677416 0.677417 0.983902 W\n0.993546 0.330615 0.008951 W\n0.492285 0.492286 0.521588 W\n0.092854 0.092854 0.749740 N\n0.411527 0.746475 0.747128 N\n0.746475 0.411527 0.747128 N\n0.263568 0.580278 0.250727 N\n0.904093 0.904094 0.253150 N\n0.580278 0.263568 0.250727 N\n",
"nsites": 10,
"nelements": 2,
"elements": [
"W",
"N"
],
"chemical_system": "N-W",
"density": 12.250566213958871,
"density_atomic": 0.0900349232959127,
"volume": 111.06801265475136,
"volume_molar": 6.68867206140374,
"formula_full": "W4 N6",
"formula_reduced": "W2N3",
"formula_anonymous": "A2B3",
"energy_above_hull": 6.541457950000001,
"spacegroup": 8
},
{
"id": "jvasp-4361",
"created_at": "2022-09-04T14:37:07.522623Z",
"updated_at": "2022-09-04T14:37:07.522646Z",
"structure_string": "As8 O12\n1.0\n0.000000 8.098974 -0.096313\n4.577261 0.000000 0.000000\n0.000000 -6.213702 -8.785930\nAs O\n8 12\ndirect\n0.559442 0.792924 0.877979 As\n0.440557 0.292924 0.622020 As\n0.440557 0.207076 0.122020 As\n0.559442 0.707075 0.377979 As\n0.917777 0.330013 0.804784 As\n0.082223 0.830013 0.695216 As\n0.082223 0.669987 0.195216 As\n0.917777 0.169987 0.304784 As\n0.042551 0.055830 0.213528 O\n0.957449 0.555830 0.286471 O\n0.407208 0.855454 0.182639 O\n0.592791 0.355454 0.317360 O\n0.592791 0.144546 0.817360 O\n0.666001 0.366234 0.627320 O\n0.333998 0.633766 0.372680 O\n0.666001 0.133766 0.127320 O\n0.042551 0.444169 0.713528 O\n0.333998 0.866233 0.872680 O\n0.407209 0.644546 0.682639 O\n0.957449 0.944169 0.786471 O\n",
"nsites": 20,
"nelements": 2,
"elements": [
"As",
"O"
],
"chemical_system": "As-O",
"density": 4.0009720819123995,
"density_atomic": 0.06089326365066472,
"volume": 328.4435551810283,
"volume_molar": 9.8896666050749,
"formula_full": "As8 O12",
"formula_reduced": "As2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.2748968,
"spacegroup": 14
},
{
"id": "jvasp-34449",
"created_at": "2022-09-04T14:37:07.555716Z",
"updated_at": "2022-09-04T14:37:07.555728Z",
"structure_string": "Pr6 O9\n1.0\n3.745361 0.000000 0.000000\n-1.872680 7.173914 -1.259618\n0.000000 0.023594 9.124884\nPr O\n6 9\ndirect\n0.965693 0.931386 0.188984 Pr\n0.034307 0.068613 0.811015 Pr\n0.310087 0.620174 0.861922 Pr\n0.634713 0.269424 0.489494 Pr\n0.365287 0.730574 0.510505 Pr\n0.689912 0.379825 0.138077 Pr\n0.129799 0.259597 0.287259 O\n0.175408 0.350815 0.974023 O\n0.474637 0.949276 0.344606 O\n0.799276 0.598551 0.370996 O\n0.870200 0.740401 0.712741 O\n0.500000 0.000000 0.000000 O\n0.525362 0.050723 0.655393 O\n0.824591 0.649184 0.025976 O\n0.200724 0.401447 0.629003 O\n",
"nsites": 15,
"nelements": 2,
"elements": [
"Pr",
"O"
],
"chemical_system": "O-Pr",
"density": 6.698297813681534,
"density_atomic": 0.06115288231126142,
"volume": 245.28688482174326,
"volume_molar": 9.847680979856303,
"formula_full": "Pr6 O9",
"formula_reduced": "Pr2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.6347866999999998,
"spacegroup": 12
},
{
"id": "jvasp-55519",
"created_at": "2022-09-04T14:37:00.386708Z",
"updated_at": "2022-09-04T14:37:00.386735Z",
"structure_string": "Pb8 O12\n1.0\n0.000000 7.645732 -0.014315\n5.739976 0.000000 0.000000\n0.000000 -3.069208 -7.256972\nPb O\n8 12\ndirect\n0.091354 0.754229 0.116987 Pb\n0.908646 0.254229 0.383013 Pb\n0.908646 0.245772 0.883013 Pb\n0.091354 0.745772 0.616987 Pb\n0.612584 0.741365 0.140539 Pb\n0.387416 0.241364 0.359461 Pb\n0.387416 0.258636 0.859461 Pb\n0.612583 0.758637 0.640539 Pb\n0.073009 0.937204 0.361608 O\n0.926990 0.437203 0.138393 O\n0.809024 0.593883 0.450537 O\n0.190975 0.093883 0.049464 O\n0.190975 0.406117 0.549464 O\n0.627559 0.128178 0.229757 O\n0.372441 0.871823 0.770244 O\n0.627558 0.371822 0.729757 O\n0.073009 0.562797 0.861608 O\n0.372441 0.628178 0.270244 O\n0.809024 0.906118 0.950536 O\n0.926990 0.062797 0.638392 O\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Pb",
"O"
],
"chemical_system": "O-Pb",
"density": 9.636001712673739,
"density_atomic": 0.06274825323430762,
"volume": 318.73397216840766,
"volume_molar": 9.597304226960366,
"formula_full": "Pb8 O12",
"formula_reduced": "Pb2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.4237484279999997,
"spacegroup": 14
},
{
"id": "jvasp-7769",
"created_at": "2022-09-04T14:37:04.373851Z",
"updated_at": "2022-09-04T14:37:04.373873Z",
"structure_string": "Er2 O3\n1.0\n1.811321 -3.137300 0.000000\n1.811321 3.137300 -0.000000\n-0.000000 0.000000 5.785897\nEr O\n2 3\ndirect\n0.333333 0.666667 0.249023 Er\n0.666667 0.333333 0.750977 Er\n0.333333 0.666667 0.645965 O\n0.666667 0.333333 0.354035 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Er",
"O"
],
"chemical_system": "Er-O",
"density": 9.659324688662581,
"density_atomic": 0.07603575082803224,
"volume": 65.75854049640871,
"volume_molar": 7.920143740830672,
"formula_full": "Er2 O3",
"formula_reduced": "Er2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3539180999999998,
"spacegroup": 164
}
]
}