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=spacegroup&page=254",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=252",
"results": [
{
"id": "jvasp-117003",
"created_at": "2022-09-04T14:38:47.741490Z",
"updated_at": "2022-09-04T14:38:47.741513Z",
"structure_string": "Sr1 Pr3 Fe4 O12\n1.0\n7.659663 -0.000000 0.000000\n0.000000 5.474863 0.004945\n-0.000000 -0.011676 5.412356\nSr Pr Fe O\n1 3 4 12\ndirect\n0.500000 0.496058 0.510387 Sr\n0.500000 0.004698 0.015033 Pr\n-0.000000 0.505266 0.485008 Pr\n-0.000000 0.000774 0.985904 Pr\n0.251888 0.498919 -0.000562 Fe\n0.747818 0.000727 0.500409 Fe\n0.748111 0.498919 -0.000562 Fe\n0.252181 0.000727 0.500409 Fe\n0.500000 0.954126 0.492626 O\n0.500000 0.559810 0.001894 O\n0.272163 0.257203 0.257744 O\n0.723176 0.229064 0.770352 O\n0.783937 0.737536 0.737132 O\n0.727837 0.257203 0.257744 O\n0.216063 0.737536 0.737132 O\n0.785208 0.763571 0.236057 O\n-0.000000 0.443922 -0.000697 O\n0.276824 0.229064 0.770352 O\n0.214791 0.763571 0.236057 O\n-0.000000 0.061292 0.507592 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Pr",
"Fe",
"O"
],
"chemical_system": "Fe-O-Pr-Sr",
"density": 6.7726187819684025,
"density_atomic": 0.08811703513292958,
"volume": 226.97086857074638,
"volume_molar": 6.834252594762473,
"formula_full": "Sr1 Pr3 Fe4 O12",
"formula_reduced": "SrPr3(FeO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.855920493,
"spacegroup": 6
},
{
"id": "jvasp-116906",
"created_at": "2022-09-04T14:38:47.742625Z",
"updated_at": "2022-09-04T14:38:47.742656Z",
"structure_string": "Li4 V2 Fe2 P4 O16\n1.0\n4.687853 -0.009043 0.003367\n0.009010 10.191387 -0.001666\n0.003931 -0.000766 5.963939\nLi V Fe P O\n4 2 2 4 16\ndirect\n0.002107 0.002179 -0.001042 Li\n0.001831 0.002420 0.500957 Li\n0.499970 0.495899 0.001766 Li\n0.499855 0.495611 0.498018 Li\n0.514178 0.775239 0.250142 V\n0.482869 0.226455 0.750381 V\n0.979615 0.272376 0.249557 Fe\n0.028400 0.720709 0.750185 Fe\n0.078211 0.587619 0.250005 P\n0.916351 0.404755 0.749949 P\n0.584475 0.910349 0.750069 P\n0.418837 0.097465 0.250090 P\n0.778151 0.332297 0.957732 O\n0.778353 0.332054 0.542618 O\n0.721545 0.840573 0.958144 O\n0.720826 0.839566 0.542399 O\n0.278120 0.169308 0.456296 O\n0.278191 0.167696 0.042603 O\n0.789675 0.544845 0.749798 O\n0.295290 0.955914 0.251150 O\n0.751426 0.593131 0.249955 O\n0.243613 0.404129 0.750017 O\n0.257817 0.909839 0.750687 O\n0.746405 0.099856 0.249484 O\n0.220726 0.660901 0.045631 O\n0.712837 0.051657 0.748935 O\n0.199886 0.446174 0.250191 O\n0.220427 0.660984 0.454284 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Li-O-P-V",
"density": 3.6203890368795175,
"density_atomic": 0.0982691126158959,
"volume": 284.9318494351678,
"volume_molar": 6.128213229663238,
"formula_full": "Li4 V2 Fe2 P4 O16",
"formula_reduced": "Li2VFe(PO4)2",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.884499192857142,
"spacegroup": 6
},
{
"id": "jvasp-114020",
"created_at": "2022-09-04T14:38:47.950604Z",
"updated_at": "2022-09-04T14:38:47.950629Z",
"structure_string": "Ba1 Br1 O1\n1.0\n4.628866 0.570681 0.000000\n-1.658944 5.261331 0.000000\n0.000000 0.000000 4.966639\nBa Br O\n1 1 1\ndirect\n0.316646 -0.097989 0.000000 Ba\n0.895602 0.335447 0.000000 Br\n0.787754 0.762541 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Br",
"O"
],
"chemical_system": "Ba-Br-O",
"density": 3.082043123872059,
"density_atomic": 0.023874028677344505,
"volume": 125.65956255413565,
"volume_molar": 25.224652451367664,
"formula_full": "Ba1 Br1 O1",
"formula_reduced": "BaBrO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2247560799999998,
"spacegroup": 6
},
{
"id": "jvasp-115762",
"created_at": "2022-09-04T14:38:47.908057Z",
"updated_at": "2022-09-04T14:38:47.908091Z",
"structure_string": "Na1 C1 O1\n1.0\n3.897023 -0.967862 0.000000\n-2.570556 4.597798 0.000000\n0.000000 0.000000 3.076527\nNa C O\n1 1 1\ndirect\n0.014186 0.337755 0.000000 Na\n0.199727 -0.067341 0.000000 C\n0.786086 0.729586 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"C",
"O"
],
"chemical_system": "C-Na-O",
"density": 1.7840115639857348,
"density_atomic": 0.06319762527537946,
"volume": 47.47013810926754,
"volume_molar": 9.52906178635498,
"formula_full": "Na1 C1 O1",
"formula_reduced": "NaCO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1900975,
"spacegroup": 6
},
{
"id": "jvasp-120656",
"created_at": "2022-09-04T14:38:48.162052Z",
"updated_at": "2022-09-04T14:38:48.162081Z",
"structure_string": "Ca1 Nd3 Mn4 O12\n1.0\n7.697486 -0.000000 0.000000\n0.000000 5.426657 0.027736\n-0.000000 -0.035903 5.497381\nCa Nd Mn O\n1 3 4 12\ndirect\n0.500000 0.490026 0.542844 Ca\n0.500000 0.009615 0.043862 Nd\n-0.000000 0.509498 0.457040 Nd\n-0.000000 0.991950 0.956470 Nd\n0.253551 0.000708 0.500754 Mn\n0.746795 0.499857 0.998569 Mn\n0.746450 0.000708 0.500754 Mn\n0.253206 0.499857 0.998569 Mn\n0.285539 0.208815 0.791089 O\n0.708273 0.286879 0.287222 O\n0.714461 0.208815 0.791089 O\n0.291728 0.286879 0.287222 O\n0.210034 0.786893 0.212789 O\n0.500000 0.920140 0.484974 O\n-0.000000 0.075428 0.510334 O\n-0.000000 0.427615 0.015252 O\n0.205431 0.716927 0.715609 O\n0.500000 0.575584 0.977165 O\n0.794569 0.716927 0.715609 O\n0.789966 0.786893 0.212789 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Nd",
"Mn",
"O"
],
"chemical_system": "Ca-Mn-Nd-O",
"density": 6.396160749530643,
"density_atomic": 0.08709202371263111,
"volume": 229.64215490033865,
"volume_molar": 6.914686906197815,
"formula_full": "Ca1 Nd3 Mn4 O12",
"formula_reduced": "CaNd3Mn4O12",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 3.044712794275862,
"spacegroup": 6
},
{
"id": "jvasp-113680",
"created_at": "2022-09-04T14:38:48.286174Z",
"updated_at": "2022-09-04T14:38:48.286200Z",
"structure_string": "Rb1 Al1 O1\n1.0\n7.524084 1.036977 0.000000\n1.616703 3.831676 0.000000\n0.000000 0.000000 3.943947\nRb Al O\n1 1 1\ndirect\n-0.108313 -0.003202 0.000000 Rb\n0.391167 0.003168 0.000000 Al\n0.136310 0.268293 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Al",
"O"
],
"chemical_system": "Al-O-Rb",
"density": 1.9917010919165783,
"density_atomic": 0.028013442083375133,
"volume": 107.09144528084897,
"volume_molar": 21.497325255770342,
"formula_full": "Rb1 Al1 O1",
"formula_reduced": "RbAlO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5546087666666667,
"spacegroup": 6
},
{
"id": "jvasp-118394",
"created_at": "2022-09-04T14:38:48.403686Z",
"updated_at": "2022-09-04T14:38:48.403718Z",
"structure_string": "Ge1 Pb1 S1\n1.0\n5.731381 1.597531 0.000000\n1.365183 5.498062 0.000000\n0.000000 0.000000 3.134846\nGe Pb S\n1 1 1\ndirect\n-0.055161 -0.029666 0.000000 Ge\n0.478128 -0.099814 0.000000 Pb\n-0.088984 0.386481 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ge",
"Pb",
"S"
],
"chemical_system": "Ge-Pb-S",
"density": 5.632935531303141,
"density_atomic": 0.032627560321157795,
"volume": 91.94680725345586,
"volume_molar": 18.457220523763343,
"formula_full": "Ge1 Pb1 S1",
"formula_reduced": "GePbS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9233622566666666,
"spacegroup": 6
},
{
"id": "jvasp-114075",
"created_at": "2022-09-04T14:38:48.153561Z",
"updated_at": "2022-09-04T14:38:48.153587Z",
"structure_string": "Ba1 Sn1 S1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nBa Sn S\n1 1 1\ndirect\n0.394924 0.000390 0.000000 Ba\n-0.037178 -0.087863 0.000000 Sn\n0.061419 0.355731 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"S"
],
"chemical_system": "Ba-S-Sn",
"density": 2.4910755362826955,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Ba1 Sn1 S1",
"formula_reduced": "BaSnS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7238292233333333,
"spacegroup": 6
},
{
"id": "jvasp-113533",
"created_at": "2022-09-04T14:38:48.158276Z",
"updated_at": "2022-09-04T14:38:48.158296Z",
"structure_string": "C1 S1 O1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nC S O\n1 1 1\ndirect\n0.288923 0.000996 0.000000 C\n-0.106868 -0.080153 0.000000 S\n0.045843 0.267074 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"C",
"S",
"O"
],
"chemical_system": "C-O-S",
"density": 0.5194396843817001,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "C1 S1 O1",
"formula_reduced": "CSO",
"formula_anonymous": "ABC",
"energy_above_hull": 4.184667833333333,
"spacegroup": 6
},
{
"id": "jvasp-118699",
"created_at": "2022-09-04T14:38:48.417955Z",
"updated_at": "2022-09-04T14:38:48.417966Z",
"structure_string": "Mg1 S1 O1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nMg S O\n1 1 1\ndirect\n0.301269 0.004427 0.000000 Mg\n-0.047926 -0.076855 0.000000 S\n0.050298 0.260345 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"S",
"O"
],
"chemical_system": "Mg-O-S",
"density": 0.6257424173225348,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Mg1 S1 O1",
"formula_reduced": "MgSO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.221627516666667,
"spacegroup": 6
},
{
"id": "jvasp-113710",
"created_at": "2022-09-04T14:38:48.501908Z",
"updated_at": "2022-09-04T14:38:48.501934Z",
"structure_string": "Sr1 Pt1 O1\n1.0\n6.477130 -0.000000 0.000000\n-0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nSr Pt O\n1 1 1\ndirect\n-0.036521 0.338048 0.000000 Sr\n0.377092 -0.040772 0.000000 Pt\n-0.122354 -0.054482 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Pt",
"O"
],
"chemical_system": "O-Pt-Sr",
"density": 2.4824492821640454,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Sr1 Pt1 O1",
"formula_reduced": "SrPtO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7429404033333336,
"spacegroup": 6
},
{
"id": "jvasp-115579",
"created_at": "2022-09-04T14:38:48.585119Z",
"updated_at": "2022-09-04T14:38:48.585146Z",
"structure_string": "Ba1 Zn1 F1\n1.0\n4.277223 1.528110 0.000000\n1.939822 6.915116 0.000000\n0.000000 0.000000 4.027519\nBa Zn F\n1 1 1\ndirect\n0.005944 -0.118300 0.000000 Ba\n-0.081374 0.436161 0.000000 Zn\n0.347457 0.056177 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"F"
],
"chemical_system": "Ba-F-Zn",
"density": 3.4351599527236436,
"density_atomic": 0.02798891350690372,
"volume": 107.18529675187365,
"volume_molar": 21.516164814738467,
"formula_full": "Ba1 Zn1 F1",
"formula_reduced": "BaZnF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 6
}
]
}