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=1144",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=1142",
"results": [
{
"id": "jvasp-115491",
"created_at": "2022-09-04T14:38:44.021644Z",
"updated_at": "2022-09-04T14:38:44.021666Z",
"structure_string": "Rb1 B1 O2\n1.0\n2.907934 0.000000 0.000000\n0.000000 2.907934 -0.000000\n0.000000 -0.000000 6.187468\nRb B O\n1 1 2\ndirect\n0.499999 0.499999 0.576330 Rb\n0.000000 0.000000 0.109918 B\n0.000000 0.000000 0.313838 O\n0.499999 0.499999 0.009905 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"B",
"O"
],
"chemical_system": "B-O-Rb",
"density": 4.071157150363921,
"density_atomic": 0.07645007834273358,
"volume": 52.321725323388,
"volume_molar": 7.877219867587477,
"formula_full": "Rb1 B1 O2",
"formula_reduced": "RbBO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.841692395833333,
"spacegroup": 99
},
{
"id": "jvasp-9272",
"created_at": "2022-09-04T14:38:34.741032Z",
"updated_at": "2022-09-04T14:38:34.741063Z",
"structure_string": "Mg4 Mn4 O8\n1.0\n3.173096 0.272131 -0.043039\n0.790488 8.352687 -0.127499\n0.841637 0.006363 8.258038\nMg Mn O\n4 4 8\ndirect\n0.706741 0.936050 0.732680 Mg\n0.317530 0.084032 0.239123 Mg\n0.129999 0.282136 0.870792 Mg\n0.894236 0.737964 0.101001 Mg\n0.159213 0.776465 0.406907 Mn\n0.492591 0.623787 0.755024 Mn\n0.531628 0.396304 0.216777 Mn\n0.865005 0.243584 0.564888 Mn\n0.407405 0.247049 0.411779 O\n0.420615 0.634675 0.199893 O\n0.603635 0.385412 0.771897 O\n0.616821 0.773036 0.560021 O\n0.886968 0.939608 0.234236 O\n0.909832 0.745453 0.867721 O\n0.137300 0.080478 0.737563 O\n0.114401 0.274632 0.104076 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"O"
],
"chemical_system": "Mg-Mn-O",
"density": 3.3992182470956966,
"density_atomic": 0.07360744786296897,
"volume": 217.36930792365388,
"volume_molar": 8.18142855762517,
"formula_full": "Mg4 Mn4 O8",
"formula_reduced": "MgMnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5489408228448276,
"spacegroup": 2
},
{
"id": "jvasp-118517",
"created_at": "2022-09-04T14:38:34.541993Z",
"updated_at": "2022-09-04T14:38:34.542015Z",
"structure_string": "Sr1 Sn1 H2\n1.0\n0.000000 3.253708 3.253708\n3.253708 0.000000 3.253708\n3.253708 3.253708 0.000000\nSr Sn H\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sn\n0.250000 0.250000 0.250000 H\n0.750000 0.750000 0.750000 H\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Sn",
"H"
],
"chemical_system": "H-Sn-Sr",
"density": 5.021902691386491,
"density_atomic": 0.05806230466569051,
"volume": 68.89151271261254,
"volume_molar": 10.371859668117054,
"formula_full": "Sr1 Sn1 H2",
"formula_reduced": "SrSnH2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2562695025,
"spacegroup": 225
},
{
"id": "jvasp-115372",
"created_at": "2022-09-04T14:38:45.636132Z",
"updated_at": "2022-09-04T14:38:45.636159Z",
"structure_string": "Tl1 P1 S2\n1.0\n3.630167 0.000000 0.000000\n0.000000 3.630167 0.000000\n-0.000000 0.000000 7.447552\nTl P S\n1 1 2\ndirect\n0.500000 0.500000 0.564765 Tl\n0.000000 0.000000 0.075748 P\n0.000000 0.000000 0.351887 S\n0.500000 0.500000 0.017600 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"P",
"S"
],
"chemical_system": "P-S-Tl",
"density": 5.0671109015581255,
"density_atomic": 0.040756158082393315,
"volume": 98.14467771750063,
"volume_molar": 14.776026601490608,
"formula_full": "Tl1 P1 S2",
"formula_reduced": "TlPS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.496112025,
"spacegroup": 99
},
{
"id": "jvasp-115619",
"created_at": "2022-09-04T14:38:46.289414Z",
"updated_at": "2022-09-04T14:38:46.289448Z",
"structure_string": "Be1 C1 N2\n1.0\n1.244828 0.718702 4.285709\n-1.244828 0.718702 4.285709\n-0.000000 -1.437403 4.285709\nBe C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.500001 0.500001 0.499998 C\n0.760251 0.760251 0.760246 N\n0.239751 0.239751 0.239749 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"C",
"N"
],
"chemical_system": "Be-C-N",
"density": 3.5394411976221463,
"density_atomic": 0.1738713641559493,
"volume": 23.005513411698466,
"volume_molar": 3.4635610005329003,
"formula_full": "Be1 C1 N2",
"formula_reduced": "BeCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.793345649999999,
"spacegroup": 166
},
{
"id": "jvasp-114146",
"created_at": "2022-09-04T14:38:40.410327Z",
"updated_at": "2022-09-04T14:38:40.410347Z",
"structure_string": "Pb1 C1 O2\n1.0\n4.202093 0.000000 0.000000\n0.000000 4.202093 0.000000\n0.000000 0.000000 4.090159\nPb C O\n1 1 2\ndirect\n0.500000 0.500000 0.673120 Pb\n0.000000 0.000000 0.935615 C\n0.000000 0.000000 0.224043 O\n0.500000 0.500000 0.177223 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pb",
"C",
"O"
],
"chemical_system": "C-O-Pb",
"density": 5.7758199402301535,
"density_atomic": 0.05538453075461074,
"volume": 72.22233258096172,
"volume_molar": 10.87332632045214,
"formula_full": "Pb1 C1 O2",
"formula_reduced": "PbCO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.724226955,
"spacegroup": 99
},
{
"id": "jvasp-116027",
"created_at": "2022-09-04T14:38:40.796427Z",
"updated_at": "2022-09-04T14:38:40.796443Z",
"structure_string": "Zn1 Mo1 F2\n1.0\n2.697618 0.000000 0.000000\n0.000000 2.697618 0.000000\n-0.000000 0.000000 6.680114\nZn Mo F\n1 1 2\ndirect\n0.500000 0.500000 0.587552 Zn\n0.000000 0.000000 0.902401 Mo\n0.000000 0.000000 0.416484 F\n0.500000 0.500000 0.103563 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Mo",
"F"
],
"chemical_system": "F-Mo-Zn",
"density": 6.809440442369199,
"density_atomic": 0.08228396592937864,
"volume": 48.61214399209994,
"volume_molar": 7.318729344145353,
"formula_full": "Zn1 Mo1 F2",
"formula_reduced": "ZnMoF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7357042162499999,
"spacegroup": 99
},
{
"id": "jvasp-113129",
"created_at": "2022-09-04T14:38:44.002109Z",
"updated_at": "2022-09-04T14:38:44.002134Z",
"structure_string": "Mg4 Fe4 O8\n1.0\n2.804717 -0.000748 0.520081\n-1.535234 7.836997 0.466134\n-0.001444 0.089798 7.810013\nMg Fe O\n4 4 8\ndirect\n0.359209 0.027625 0.328739 Mg\n0.636784 0.952287 0.699488 Mg\n0.324568 0.748192 0.117943 Mg\n0.671429 0.231716 0.910264 Mg\n0.368433 0.302568 0.586194 Fe\n0.059106 0.370580 0.272128 Fe\n0.936969 0.609336 0.756045 Fe\n0.627593 0.677366 0.441998 Fe\n0.143408 0.823015 0.556448 O\n0.319642 0.418221 0.799757 O\n0.676437 0.561691 0.228438 O\n0.852651 0.156924 0.471754 O\n0.157792 0.094510 0.800002 O\n0.550148 0.240911 0.160096 O\n0.838214 0.885402 0.228207 O\n0.445925 0.738990 0.868110 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O",
"density": 4.3440988198846995,
"density_atomic": 0.09330737226875777,
"volume": 171.47626828365097,
"volume_molar": 6.454088903772936,
"formula_full": "Mg4 Fe4 O8",
"formula_reduced": "MgFeO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3719128875,
"spacegroup": 12
},
{
"id": "jvasp-37785",
"created_at": "2022-09-04T14:38:34.505052Z",
"updated_at": "2022-09-04T14:38:34.505076Z",
"structure_string": "Hf2 Fe1 Tc1\n1.0\n0.000000 3.195601 3.195601\n3.195601 0.000000 3.195601\n3.195601 3.195601 0.000000\nHf Fe Tc\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.499999 0.499999 0.499999 Hf\n0.250001 0.250001 0.250001 Fe\n0.750000 0.750000 0.750000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Fe",
"Tc"
],
"chemical_system": "Fe-Hf-Tc",
"density": 12.996715141842092,
"density_atomic": 0.06128756269081913,
"volume": 65.26609681280733,
"volume_molar": 9.826040546562828,
"formula_full": "Hf2 Fe1 Tc1",
"formula_reduced": "Hf2FeTc",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.84616575,
"spacegroup": 225
},
{
"id": "jvasp-111305",
"created_at": "2022-09-04T14:38:44.001327Z",
"updated_at": "2022-09-04T14:38:44.001350Z",
"structure_string": "Yb1 Tm1 Zn2\n1.0\n4.312445 -0.000000 2.489791\n1.437482 4.065812 2.489791\n-0.000000 -0.000000 4.979583\nYb Tm Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.499999 Tm\n0.250000 0.250000 0.250000 Zn\n0.750001 0.750000 0.749999 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Tm",
"Zn"
],
"chemical_system": "Tm-Yb-Zn",
"density": 8.99198495431392,
"density_atomic": 0.04581378286701808,
"volume": 87.30996983180034,
"volume_molar": 13.14482320196138,
"formula_full": "Yb1 Tm1 Zn2",
"formula_reduced": "YbTmZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-115046",
"created_at": "2022-09-04T14:38:44.282492Z",
"updated_at": "2022-09-04T14:38:44.282515Z",
"structure_string": "Sr1 Ge1 S2\n1.0\n4.043948 0.000000 0.000000\n-2.021974 3.502162 -0.000000\n-0.000000 -0.000000 6.850417\nSr Ge S\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Ge\n0.333334 0.666667 0.770076 S\n0.666667 0.333333 0.229924 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ge",
"S"
],
"chemical_system": "Ge-S-Sr",
"density": 3.8405532702530705,
"density_atomic": 0.04122884691427422,
"volume": 97.01944874463912,
"volume_molar": 14.606619419945552,
"formula_full": "Sr1 Ge1 S2",
"formula_reduced": "SrGeS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7021430649999998,
"spacegroup": 164
},
{
"id": "jvasp-115301",
"created_at": "2022-09-04T14:38:45.949558Z",
"updated_at": "2022-09-04T14:38:45.949593Z",
"structure_string": "Y1 Pb1 O2\n1.0\n3.271662 0.000000 -0.000000\n0.000000 3.271662 0.000000\n-0.000000 0.000000 6.757303\nY Pb O\n1 1 2\ndirect\n0.499999 0.499999 0.559582 Y\n0.000000 0.000000 0.061185 Pb\n0.000000 0.000000 0.521754 O\n0.499999 0.499999 0.867477 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Pb",
"O"
],
"chemical_system": "O-Pb-Y",
"density": 7.532709689851382,
"density_atomic": 0.0553031334023184,
"volume": 72.3286322838321,
"volume_molar": 10.889330114787931,
"formula_full": "Y1 Pb1 O2",
"formula_reduced": "YPbO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4367858175,
"spacegroup": 99
}
]
}