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=668",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=666",
"results": [
{
"id": "jvasp-31312",
"created_at": "2022-09-04T14:38:33.998785Z",
"updated_at": "2022-09-04T14:38:33.998806Z",
"structure_string": "Rb2 Li14 Pb3 O14\n1.0\n6.574561 0.000000 -3.166436\n-1.825541 6.808078 -3.790420\n0.018112 0.003405 8.446299\nRb Li Pb O\n2 14 3 14\ndirect\n0.231743 0.500000 -0.000000 Rb\n0.768257 0.500000 -0.000000 Rb\n0.138621 0.709924 0.731967 Li\n0.861379 0.977959 0.268034 Li\n0.593345 0.022042 0.731966 Li\n0.500000 0.841469 -0.000000 Li\n0.500000 0.158531 -0.000000 Li\n0.768536 0.413907 0.537072 Li\n0.231464 0.586094 0.462928 Li\n0.231464 0.876836 0.462928 Li\n0.768536 0.123165 0.537072 Li\n0.593345 0.709924 0.731966 Li\n0.861379 0.290077 0.268034 Li\n0.406655 0.977959 0.268034 Li\n0.138621 0.022042 0.731966 Li\n0.406655 0.290077 0.268034 Li\n0.727382 0.727383 0.454764 Pb\n0.000000 0.000000 0.000000 Pb\n0.272618 0.272618 0.545236 Pb\n0.044854 0.751375 0.502749 O\n0.542104 0.248626 0.497251 O\n0.955145 0.248626 0.497251 O\n0.457896 0.751375 0.502749 O\n0.702886 -0.000000 -0.000000 O\n0.297114 -0.000000 -0.000000 O\n0.873081 0.682779 0.746163 O\n0.126919 0.317222 0.253837 O\n0.126919 0.936615 0.253837 O\n0.873081 0.063386 0.746163 O\n0.627899 0.408358 0.255797 O\n0.372101 0.591642 0.744203 O\n0.372101 0.152561 0.744203 O\n0.627899 0.847440 0.255797 O\n",
"nsites": 33,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Pb",
"O"
],
"chemical_system": "Li-O-Pb-Rb",
"density": 4.885306437502458,
"density_atomic": 0.08717419897489999,
"volume": 378.5523743040262,
"volume_molar": 6.9081687366395546,
"formula_full": "Rb2 Li14 Pb3 O14",
"formula_reduced": "Rb2Li14Pb3O14",
"formula_anonymous": "A2B3C14D14",
"energy_above_hull": 1.6014991351515149,
"spacegroup": 71
},
{
"id": "jvasp-41385",
"created_at": "2022-09-04T14:38:33.996085Z",
"updated_at": "2022-09-04T14:38:33.996108Z",
"structure_string": "Fe1 Ge1 Ru2\n1.0\n0.000000 2.999462 2.999462\n2.999462 0.000000 2.999462\n2.999462 2.999462 0.000000\nFe Ge Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Fe\n0.750000 0.750000 0.750000 Ge\n0.500002 0.500002 0.500002 Ru\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Fe",
"Ge",
"Ru"
],
"chemical_system": "Fe-Ge-Ru",
"density": 10.172429728295965,
"density_atomic": 0.07411394022373012,
"volume": 53.97095320968055,
"volume_molar": 8.125516929501753,
"formula_full": "Fe1 Ge1 Ru2",
"formula_reduced": "FeGeRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.2844356124999994,
"spacegroup": 225
},
{
"id": "jvasp-21485",
"created_at": "2022-09-04T14:38:33.995744Z",
"updated_at": "2022-09-04T14:38:33.995771Z",
"structure_string": "Sm4 F12\n1.0\n4.411761 -0.000000 0.000000\n0.000000 6.666662 0.000000\n0.000000 0.000000 7.059944\nSm F\n4 12\ndirect\n0.934743 0.631754 0.750000 Sm\n0.434743 0.868245 0.250000 Sm\n0.565257 0.131754 0.750000 Sm\n0.065257 0.368245 0.250000 Sm\n0.076595 0.981073 0.750000 F\n0.576595 0.518927 0.250000 F\n0.423405 0.481073 0.750000 F\n0.923405 0.018927 0.250000 F\n0.391588 0.165539 0.064446 F\n0.891587 0.334461 0.935553 F\n0.108412 0.665539 0.435554 F\n0.608412 0.834460 0.564446 F\n0.608412 0.834460 0.935553 F\n0.108412 0.665539 0.064446 F\n0.891587 0.334461 0.564446 F\n0.391588 0.165539 0.435554 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sm",
"F"
],
"chemical_system": "F-Sm",
"density": 6.63288350141079,
"density_atomic": 0.07705455422323043,
"volume": 207.64509199089383,
"volume_molar": 7.815424825576945,
"formula_full": "Sm4 F12",
"formula_reduced": "SmF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-20840",
"created_at": "2022-09-04T14:38:33.994014Z",
"updated_at": "2022-09-04T14:38:33.994036Z",
"structure_string": "Sm4 Te8 O22\n1.0\n5.139819 -0.000000 0.848620\n2.455017 6.267761 1.120179\n0.011621 -0.050536 15.919036\nSm Te O\n4 8 22\ndirect\n0.636990 0.700395 0.536814 Sm\n0.125801 0.200396 0.036814 Sm\n0.874200 0.799604 0.963186 Sm\n0.363011 0.299604 0.463186 Sm\n0.649622 0.043343 0.202545 Te\n0.895511 0.456656 0.297455 Te\n0.350379 0.956656 0.797455 Te\n0.104490 0.543343 0.702545 Te\n0.347167 0.617857 0.128727 Te\n0.652834 0.382143 0.871273 Te\n0.906250 0.117856 0.628727 Te\n0.093751 0.882143 0.371273 Te\n0.166975 0.528698 0.055721 O\n0.187849 0.129752 0.369907 O\n0.687508 0.370248 0.130093 O\n0.833026 0.471301 0.944279 O\n0.248606 0.028697 0.555722 O\n0.362291 0.249999 0.750000 O\n0.114575 0.048006 0.901178 O\n0.936240 0.548007 0.401178 O\n0.885426 0.951993 0.098822 O\n0.312493 0.629751 0.869907 O\n0.812152 0.870248 0.630094 O\n0.590216 0.370695 0.328191 O\n0.289104 0.129304 0.171809 O\n0.409785 0.629304 0.671809 O\n0.710897 0.870695 0.828192 O\n0.454146 0.813916 0.046024 O\n0.314088 0.686083 0.453976 O\n0.545854 0.186083 0.953977 O\n0.685913 0.313916 0.546024 O\n0.637709 0.750000 0.250000 O\n0.063760 0.451993 0.598823 O\n0.751395 0.971302 0.444279 O\n",
"nsites": 34,
"nelements": 3,
"elements": [
"Sm",
"Te",
"O"
],
"chemical_system": "O-Sm-Te",
"density": 6.390932637702978,
"density_atomic": 0.06628221550521322,
"volume": 512.9581101181784,
"volume_molar": 9.085605715044855,
"formula_full": "Sm4 Te8 O22",
"formula_reduced": "Sm2Te4O11",
"formula_anonymous": "A2B4C11",
"energy_above_hull": 2.3309574892156864,
"spacegroup": 15
},
{
"id": "jvasp-57657",
"created_at": "2022-09-04T14:38:33.986190Z",
"updated_at": "2022-09-04T14:38:33.986217Z",
"structure_string": "Ti4 Cr8\n1.0\n2.434163 -4.216095 -0.000000\n2.434163 4.216095 -0.000000\n0.000000 0.000000 7.786369\nTi Cr\n4 8\ndirect\n0.333333 0.666666 0.560478 Ti\n0.666666 0.333333 0.060478 Ti\n0.666666 0.333333 0.439522 Ti\n0.333333 0.666666 0.939522 Ti\n0.170144 0.340290 0.250000 Cr\n0.829855 0.659709 0.750000 Cr\n0.829855 0.170144 0.750000 Cr\n0.659709 0.829855 0.250000 Cr\n0.170144 0.829855 0.250000 Cr\n0.340290 0.170144 0.750000 Cr\n0.000000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ti",
"Cr"
],
"chemical_system": "Cr-Ti",
"density": 6.3113922849952,
"density_atomic": 0.07508552543070277,
"volume": 159.81775357055906,
"volume_molar": 8.020375066240828,
"formula_full": "Ti4 Cr8",
"formula_reduced": "TiCr2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.932757711111111,
"spacegroup": 194
},
{
"id": "jvasp-118481",
"created_at": "2022-09-04T14:38:33.985247Z",
"updated_at": "2022-09-04T14:38:33.985268Z",
"structure_string": "Sb2 H2 O2\n1.0\n1.903043 1.098722 6.558234\n-1.903043 1.098722 6.558234\n-0.000000 -2.197445 6.558234\nSb H O\n2 2 2\ndirect\n0.240575 0.240575 0.240575 Sb\n0.759425 0.759425 0.759425 Sb\n0.612140 0.612140 0.612140 H\n0.387860 0.387860 0.387860 H\n0.869444 0.869444 0.869444 O\n0.130556 0.130556 0.130556 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sb",
"H",
"O"
],
"chemical_system": "H-O-Sb",
"density": 5.601336246724214,
"density_atomic": 0.07292501679470191,
"volume": 82.27629233039693,
"volume_molar": 8.257990227075977,
"formula_full": "Sb2 H2 O2",
"formula_reduced": "SbHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8173365333333336,
"spacegroup": 166
},
{
"id": "jvasp-34887",
"created_at": "2022-09-04T14:38:33.984984Z",
"updated_at": "2022-09-04T14:38:33.985013Z",
"structure_string": "Ta8 O4\n1.0\n6.135941 -0.000000 -2.169383\n-3.067970 5.313881 -2.169383\n0.000000 0.000000 6.508148\nTa O\n8 4\ndirect\n0.572948 0.572948 0.572949 Ta\n0.427052 0.000000 0.000000 Ta\n-0.000000 0.427052 0.000000 Ta\n-0.000000 -0.000000 0.427052 Ta\n0.500000 0.500000 0.000000 Ta\n0.500000 0.000000 0.500000 Ta\n-0.000000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Ta\n-0.000000 -0.000000 0.709927 O\n-0.000000 0.709926 0.000000 O\n0.709926 0.000000 0.000000 O\n0.290073 0.290073 0.290074 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ta",
"O"
],
"chemical_system": "O-Ta",
"density": 11.828508827448404,
"density_atomic": 0.056549767796242816,
"volume": 212.20246285073665,
"volume_molar": 10.649275840881726,
"formula_full": "Ta8 O4",
"formula_reduced": "Ta2O",
"formula_anonymous": "AB2",
"energy_above_hull": 4.7973673,
"spacegroup": 217
},
{
"id": "jvasp-21717",
"created_at": "2022-09-04T14:38:33.984958Z",
"updated_at": "2022-09-04T14:38:33.984998Z",
"structure_string": "Rb1 F1\n1.0\n3.454309 0.000000 1.994346\n1.151436 3.256753 1.994346\n-0.000000 -0.000000 3.988693\nRb F\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.499999 0.500000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"F"
],
"chemical_system": "F-Rb",
"density": 3.8658793062529764,
"density_atomic": 0.04457110268839931,
"volume": 44.87212295334456,
"volume_molar": 13.511312031253393,
"formula_full": "Rb1 F1",
"formula_reduced": "RbF",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-51668",
"created_at": "2022-09-04T14:38:33.981571Z",
"updated_at": "2022-09-04T14:38:33.981596Z",
"structure_string": "Ba2 P4 H8 O8\n1.0\n3.148633 7.614510 0.000000\n-3.148633 7.614510 0.000000\n0.000000 0.000000 6.188214\nBa P H O\n2 4 8 8\ndirect\n0.250000 0.250000 0.750000 Ba\n0.750000 0.750000 0.250000 Ba\n0.601804 0.601804 0.750000 P\n0.101804 0.101804 0.250000 P\n0.398196 0.398196 0.250000 P\n0.898196 0.898196 0.750000 P\n0.165487 0.922157 0.379885 H\n0.422157 0.665486 0.879884 H\n0.077843 0.834513 0.879884 H\n0.334514 0.577843 0.379885 H\n0.577843 0.334514 0.120115 H\n0.922157 0.165487 0.120115 H\n0.665486 0.422157 0.620115 H\n0.834513 0.077843 0.620115 H\n0.504526 0.803105 0.604015 O\n0.803105 0.504526 0.895984 O\n0.004526 0.303105 0.395985 O\n0.495474 0.196895 0.395985 O\n0.696895 0.995474 0.895984 O\n0.196895 0.495474 0.104015 O\n0.995474 0.696895 0.604015 O\n0.303105 0.004526 0.104015 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Ba",
"P",
"H",
"O"
],
"chemical_system": "Ba-H-O-P",
"density": 2.9917482003558225,
"density_atomic": 0.07414183950267707,
"volume": 296.728542852051,
"volume_molar": 8.12245932983974,
"formula_full": "Ba2 P4 H8 O8",
"formula_reduced": "BaP2(HO)4",
"formula_anonymous": "AB2C4D4",
"energy_above_hull": 2.677831906363636,
"spacegroup": 68
},
{
"id": "jvasp-55806",
"created_at": "2022-09-04T14:38:33.979343Z",
"updated_at": "2022-09-04T14:38:33.979366Z",
"structure_string": "K2 Mn2 P2 H4 O10\n1.0\n4.861874 0.000000 0.000000\n0.000000 5.703418 0.000000\n0.000000 0.000000 8.317321\nK Mn P H O\n2 2 2 4 10\ndirect\n0.628104 0.500000 0.458423 K\n0.128105 0.000000 0.541577 K\n0.522970 0.500000 0.019992 Mn\n0.022970 0.000000 0.980008 Mn\n0.083397 0.500000 0.778574 P\n0.583397 0.000000 0.221426 P\n0.073178 0.361382 0.202152 H\n0.573177 0.138618 0.797848 H\n0.073178 0.638618 0.202152 H\n0.573177 0.861382 0.797848 H\n0.725027 0.781519 0.138394 O\n0.194448 0.500000 0.214205 O\n0.694448 0.000000 0.785795 O\n0.272435 0.000000 0.184868 O\n0.772435 0.500000 0.815132 O\n0.635233 0.000000 0.402433 O\n0.135233 0.500000 0.597567 O\n0.725027 0.218482 0.138394 O\n0.225027 0.281519 0.861606 O\n0.225027 0.718482 0.861606 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"K",
"Mn",
"P",
"H",
"O"
],
"chemical_system": "H-K-Mn-O-P",
"density": 2.9810914510577717,
"density_atomic": 0.08671767615306686,
"volume": 230.63348658810526,
"volume_molar": 6.9445366010157095,
"formula_full": "K2 Mn2 P2 H4 O10",
"formula_reduced": "KMnPH2O5",
"formula_anonymous": "ABCD2E5",
"energy_above_hull": 2.630113824137931,
"spacegroup": 31
},
{
"id": "jvasp-20783",
"created_at": "2022-09-04T14:38:33.976445Z",
"updated_at": "2022-09-04T14:38:33.976459Z",
"structure_string": "Y3 Co9\n1.0\n4.719545 0.010595 7.082388\n2.151455 4.200650 7.082388\n0.017287 0.010595 8.510818\nY Co\n3 9\ndirect\n0.860794 0.860795 0.860791 Y\n0.139207 0.139207 0.139207 Y\n0.000000 0.000000 0.000000 Y\n0.422344 0.422345 0.916059 Co\n0.422345 0.916061 0.422342 Co\n0.916061 0.422345 0.422342 Co\n0.500001 0.500001 0.499999 Co\n0.332110 0.332110 0.332109 Co\n0.667891 0.667892 0.667889 Co\n0.577657 0.083941 0.577655 Co\n0.577657 0.577657 0.083939 Co\n0.083940 0.577657 0.577656 Co\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Y",
"Co"
],
"chemical_system": "Co-Y",
"density": 7.886872790743177,
"density_atomic": 0.07150152290785168,
"volume": 167.82859318206582,
"volume_molar": 8.422395097459805,
"formula_full": "Y3 Co9",
"formula_reduced": "YCo3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.1386470375,
"spacegroup": 166
},
{
"id": "jvasp-26862",
"created_at": "2022-09-04T14:38:33.974086Z",
"updated_at": "2022-09-04T14:38:33.974115Z",
"structure_string": "Ti20 Si16\n1.0\n6.730288 0.000000 -0.000000\n0.000000 6.730288 0.000000\n-0.000000 -0.000000 12.216544\nTi Si\n20 16\ndirect\n0.995433 0.149672 0.621631 Ti\n0.829530 0.829530 0.500000 Ti\n0.670471 0.329530 0.750000 Ti\n0.170470 0.170470 0.000000 Ti\n0.655217 0.996896 0.281401 Ti\n0.344784 0.003104 0.781401 Ti\n0.996896 0.655217 0.718599 Ti\n0.496896 0.844784 0.031401 Ti\n0.503104 0.155217 0.531401 Ti\n0.844784 0.496896 0.968599 Ti\n0.329530 0.670471 0.250000 Ti\n0.003104 0.344784 0.218599 Ti\n0.850328 0.004567 0.878369 Ti\n0.149672 0.995433 0.378369 Ti\n0.004567 0.850328 0.121631 Ti\n0.504567 0.649672 0.628369 Ti\n0.495433 0.350328 0.128369 Ti\n0.649672 0.504567 0.371631 Ti\n0.350328 0.495433 0.871631 Ti\n0.155217 0.503104 0.468599 Ti\n0.705427 0.642006 0.171435 Si\n0.205427 0.857994 0.578564 Si\n0.794573 0.142006 0.078565 Si\n0.857994 0.205427 0.421435 Si\n0.142006 0.794573 0.921435 Si\n0.294573 0.357994 0.671435 Si\n0.698470 0.956569 0.686470 Si\n0.543431 0.198470 0.936470 Si\n0.956569 0.698470 0.313529 Si\n0.456569 0.801530 0.436470 Si\n0.801530 0.456569 0.563529 Si\n0.198470 0.543431 0.063529 Si\n0.043431 0.301530 0.813529 Si\n0.357994 0.294573 0.328565 Si\n0.301530 0.043431 0.186470 Si\n0.642006 0.705427 0.828564 Si\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Ti",
"Si"
],
"chemical_system": "Si-Ti",
"density": 4.221214231702037,
"density_atomic": 0.06505592251181855,
"volume": 553.3700639393742,
"volume_molar": 9.256867826147532,
"formula_full": "Ti20 Si16",
"formula_reduced": "Ti5Si4",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.083012896296297,
"spacegroup": 92
}
]
}