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=-chemical_system&page=1298",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1296",
"results": [
{
"id": "jvasp-7139",
"created_at": "2022-09-04T14:38:33.531039Z",
"updated_at": "2022-09-04T14:38:33.531071Z",
"structure_string": "H1 Pb1 I3\n1.0\n7.205114 1.791171 -1.098955\n2.166138 7.223698 1.831192\n-2.286832 2.702577 5.242301\nH Pb I\n1 1 3\ndirect\n0.112530 0.090564 0.112456 H\n0.349357 0.566705 0.219944 Pb\n0.311190 0.660512 -0.345147 I\n0.702747 -0.115110 0.768769 I\n0.017440 0.306570 0.724023 I\n",
"nsites": 5,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 5.292861690900444,
"density_atomic": 0.02706164255789774,
"volume": 184.76335977399077,
"volume_molar": 22.25341919698988,
"formula_full": "H1 Pb1 I3",
"formula_reduced": "HPbI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.3400059289999999,
"spacegroup": 1
},
{
"id": "jvasp-118428",
"created_at": "2022-09-04T14:38:52.919036Z",
"updated_at": "2022-09-04T14:38:52.919061Z",
"structure_string": "H3 Pb2 I1\n1.0\n4.229000 0.000000 -0.000000\n-2.114500 3.662421 0.000000\n-0.000000 0.000000 7.578396\nH Pb I\n3 2 1\ndirect\n0.000000 0.000000 0.500000 H\n0.666666 0.333333 0.622189 H\n0.333333 0.666666 0.377812 H\n0.666666 0.333333 0.327966 Pb\n0.333333 0.666666 0.672035 Pb\n0.000000 0.000000 0.000000 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 7.700638883285637,
"density_atomic": 0.0511173115545047,
"volume": 117.37706498125196,
"volume_molar": 11.781020121879433,
"formula_full": "H3 Pb2 I1",
"formula_reduced": "H3Pb2I",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4906263191666669,
"spacegroup": 164
},
{
"id": "jvasp-118426",
"created_at": "2022-09-04T14:38:33.635364Z",
"updated_at": "2022-09-04T14:38:33.635384Z",
"structure_string": "H1 Pb1 I1\n1.0\n3.230659 -0.000000 -0.000000\n-0.000000 3.230659 0.000000\n0.000000 0.000000 8.834833\nH Pb I\n1 1 1\ndirect\n0.000000 0.000000 0.258200 H\n0.000000 0.000000 0.046226 Pb\n0.000000 0.000000 0.599528 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 6.0347463899687055,
"density_atomic": 0.032534240278227045,
"volume": 92.21054416345773,
"volume_molar": 18.51016255028463,
"formula_full": "H1 Pb1 I1",
"formula_reduced": "HPbI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8790356983333336,
"spacegroup": 99
},
{
"id": "jvasp-92265",
"created_at": "2022-09-04T14:36:03.981944Z",
"updated_at": "2022-09-04T14:36:03.981970Z",
"structure_string": "H1 Pb1 I3\n1.0\n-2.407519 0.718790 3.507713\n-6.144052 -0.929910 1.167293\n-0.390924 -8.910660 1.864487\nH Pb I\n1 1 3\ndirect\n0.236188 -0.067067 -0.060154 H\n0.491065 0.487032 0.460161 Pb\n0.089634 0.359378 0.723345 I\n0.255779 0.668478 0.037076 I\n0.407382 0.058914 0.330333 I\n",
"nsites": 5,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 5.500076958353981,
"density_atomic": 0.028121104495096562,
"volume": 177.80240462716688,
"volume_molar": 21.415022162625483,
"formula_full": "H1 Pb1 I3",
"formula_reduced": "HPbI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.3361199289999999,
"spacegroup": 1
},
{
"id": "jvasp-118427",
"created_at": "2022-09-04T14:38:52.913145Z",
"updated_at": "2022-09-04T14:38:52.913166Z",
"structure_string": "H1 Pb1 I2\n1.0\n4.619938 0.000000 0.000000\n0.000000 4.619938 0.000000\n-0.000000 0.000000 6.360578\nH Pb I\n1 1 2\ndirect\n0.500000 0.500000 0.537221 H\n0.000000 0.000000 0.953778 Pb\n0.000000 0.000000 0.489327 I\n0.500000 0.500000 0.029676 I\n",
"nsites": 4,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 5.651165979228894,
"density_atomic": 0.029463959842160232,
"volume": 135.75907723972546,
"volume_molar": 20.439006814633473,
"formula_full": "H1 Pb1 I2",
"formula_reduced": "HPbI2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5883608425,
"spacegroup": 99
},
{
"id": "jvasp-118429",
"created_at": "2022-09-04T14:38:51.550455Z",
"updated_at": "2022-09-04T14:38:51.550471Z",
"structure_string": "H2 Pb2 I2\n1.0\n4.219577 -0.000000 0.000000\n0.000000 4.219577 -0.000000\n-0.000000 0.000000 8.612918\nH Pb I\n2 2 2\ndirect\n0.500001 0.500001 0.000000 H\n0.000000 0.000000 0.000000 H\n0.500001 0.000000 0.854654 Pb\n0.000000 0.500001 0.145346 Pb\n0.000000 0.500001 0.669363 I\n0.500001 0.000000 0.330637 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 7.257406659036524,
"density_atomic": 0.039125788688383255,
"volume": 153.35154130149064,
"volume_molar": 15.391742791342171,
"formula_full": "H2 Pb2 I2",
"formula_reduced": "HPbI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6875590316666671,
"spacegroup": 129
},
{
"id": "jvasp-118425",
"created_at": "2022-09-04T14:38:33.580445Z",
"updated_at": "2022-09-04T14:38:33.580481Z",
"structure_string": "H1 Pb1 I1\n1.0\n5.380114 -0.000000 0.000000\n-2.690057 4.659316 -0.000000\n0.000000 0.000000 3.725713\nH Pb I\n1 1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.666665 0.333334 0.000000 Pb\n0.333332 0.666667 0.000000 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 5.958220446240988,
"density_atomic": 0.03212167721759964,
"volume": 93.39487411187494,
"volume_molar": 18.74790260547303,
"formula_full": "H1 Pb1 I1",
"formula_reduced": "HPbI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9212123650000004,
"spacegroup": 187
},
{
"id": "jvasp-12599",
"created_at": "2022-09-04T14:37:32.448535Z",
"updated_at": "2022-09-04T14:37:32.448558Z",
"structure_string": "P2 H8 I2\n1.0\n6.291127 0.000000 0.000000\n0.000000 6.291127 -0.000000\n0.000000 0.000000 4.608252\nP H I\n2 8 2\ndirect\n0.000000 0.000000 0.000000 P\n0.500000 0.500000 0.000000 P\n0.000000 0.182594 0.180216 H\n0.682595 0.500000 0.180216 H\n0.317406 0.500000 0.180216 H\n0.000000 0.817406 0.180216 H\n0.500000 0.682595 0.819784 H\n0.500000 0.317406 0.819784 H\n0.182594 0.000000 0.819784 H\n0.817406 0.000000 0.819784 H\n0.500000 0.000000 0.394488 I\n0.000000 0.500000 0.605511 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"P",
"H",
"I"
],
"chemical_system": "H-I-P",
"density": 2.9482181759437625,
"density_atomic": 0.06579427730263636,
"volume": 182.38668303632485,
"volume_molar": 9.152985649952106,
"formula_full": "P2 H8 I2",
"formula_reduced": "PH4I",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.377436962500001,
"spacegroup": 129
},
{
"id": "jvasp-51762",
"created_at": "2022-09-04T14:37:03.421335Z",
"updated_at": "2022-09-04T14:37:03.421362Z",
"structure_string": "Sr4 H4 I4 O4\n1.0\n4.245796 -0.000000 0.000000\n-0.000000 7.710893 0.000000\n0.000000 0.000000 10.748293\nSr H I O\n4 4 4 4\ndirect\n0.750001 0.320864 0.419355 Sr\n0.750001 0.820863 0.080645 Sr\n0.250000 0.679136 0.580645 Sr\n0.250000 0.179136 0.919354 Sr\n0.750001 0.221968 0.099325 H\n0.750001 0.721968 0.400675 H\n0.250000 0.778031 0.900675 H\n0.250000 0.278032 0.599325 H\n0.250000 0.473832 0.179513 I\n0.250000 0.973832 0.320487 I\n0.750001 0.526168 0.820486 I\n0.750001 0.026168 0.679513 I\n0.750001 0.134426 0.033507 O\n0.750001 0.634425 0.466493 O\n0.250000 0.865574 0.966493 O\n0.250000 0.365574 0.533507 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sr",
"H",
"I",
"O"
],
"chemical_system": "H-I-O-Sr",
"density": 4.370352411992661,
"density_atomic": 0.04546913429290006,
"volume": 351.88706028428555,
"volume_molar": 13.244458804091083,
"formula_full": "Sr4 H4 I4 O4",
"formula_reduced": "SrHIO",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.5331865212500001,
"spacegroup": 62
},
{
"id": "jvasp-52898",
"created_at": "2022-09-04T14:36:08.622935Z",
"updated_at": "2022-09-04T14:36:08.622963Z",
"structure_string": "H4 Pb4 I4 O4\n1.0\n4.228995 0.000000 0.000000\n-0.000000 7.827369 0.000000\n0.000000 0.000000 10.558936\nH Pb I O\n4 4 4 4\ndirect\n0.750001 0.194211 0.109787 H\n0.750001 0.694211 0.390213 H\n0.250000 0.805789 0.890213 H\n0.250000 0.305789 0.609788 H\n0.750001 0.316383 0.418523 Pb\n0.750001 0.816383 0.081477 Pb\n0.250000 0.683617 0.581477 Pb\n0.250000 0.183617 0.918524 Pb\n0.250000 0.452171 0.179307 I\n0.250000 0.952171 0.320693 I\n0.750001 0.547829 0.820693 I\n0.750001 0.047829 0.679307 I\n0.750001 0.118870 0.035440 O\n0.750001 0.618870 0.464560 O\n0.250000 0.881131 0.964560 O\n0.250000 0.381130 0.535440 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"H",
"Pb",
"I",
"O"
],
"chemical_system": "H-I-O-Pb",
"density": 6.672389485138566,
"density_atomic": 0.04577694917061826,
"volume": 349.5208896592334,
"volume_molar": 13.155399975552074,
"formula_full": "H4 Pb4 I4 O4",
"formula_reduced": "HPbIO",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.97689264875,
"spacegroup": 62
},
{
"id": "jvasp-54751",
"created_at": "2022-09-04T14:38:32.202116Z",
"updated_at": "2022-09-04T14:38:32.202150Z",
"structure_string": "H4 I4 O12\n1.0\n5.473272 0.000000 0.000000\n0.000000 5.840325 0.000000\n0.000000 0.000000 7.676923\nH I O\n4 4 12\ndirect\n0.760090 0.825853 0.366686 H\n0.739909 0.174147 0.866686 H\n0.260091 0.674146 0.633313 H\n0.239909 0.325853 0.133313 H\n0.790348 0.407232 0.338721 I\n0.709651 0.592767 0.838721 I\n0.290349 0.092767 0.661279 I\n0.209651 0.907232 0.161279 I\n0.903639 0.337007 0.554614 O\n0.596360 0.662993 0.054614 O\n0.340496 0.197228 0.080925 O\n0.159504 0.802772 0.580925 O\n0.840496 0.302772 0.919075 O\n0.575118 0.977080 0.757505 O\n0.075118 0.522919 0.242495 O\n0.424881 0.477080 0.742495 O\n0.096360 0.837006 0.945385 O\n0.924881 0.022919 0.257505 O\n0.659504 0.697227 0.419075 O\n0.403640 0.162993 0.445385 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"H",
"I",
"O"
],
"chemical_system": "H-I-O",
"density": 4.761347644263316,
"density_atomic": 0.08150021687423245,
"volume": 245.39811999351022,
"volume_molar": 7.389110104201445,
"formula_full": "H4 I4 O12",
"formula_reduced": "HIO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9143233550000005,
"spacegroup": 19
},
{
"id": "jvasp-118422",
"created_at": "2022-09-04T14:38:51.340756Z",
"updated_at": "2022-09-04T14:38:51.340777Z",
"structure_string": "H3 I1 O1\n1.0\n3.606572 0.000000 0.000000\n0.000000 3.606572 -0.000000\n0.000000 0.000000 3.606572\nH I O\n3 1 1\ndirect\n0.499999 0.000000 0.000000 H\n0.000000 0.000000 0.499999 H\n0.000000 0.499999 0.000000 H\n0.499999 0.499999 0.499999 I\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"H",
"I",
"O"
],
"chemical_system": "H-I-O",
"density": 5.1653884272247215,
"density_atomic": 0.10658256907778123,
"volume": 46.91198610863966,
"volume_molar": 5.650211673547854,
"formula_full": "H3 I1 O1",
"formula_reduced": "H3IO",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.286415955,
"spacegroup": 221
}
]
}