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=density&page=1077",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1075",
"results": [
{
"id": "jvasp-110822",
"created_at": "2022-09-04T14:38:48.073999Z",
"updated_at": "2022-09-04T14:38:48.074025Z",
"structure_string": "Mg5 Pb1\n1.0\n8.440450 0.006710 0.000000\n-7.783644 3.264373 0.000000\n-0.000000 -0.000000 5.168526\nMg Pb\n5 1\ndirect\n0.999773 0.000227 -0.000000 Mg\n0.335862 0.664137 -0.000000 Mg\n0.662528 0.337471 -0.000000 Mg\n0.449175 0.550825 0.500000 Mg\n0.109381 0.890618 0.500000 Mg\n0.776619 0.223381 0.500000 Pb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Pb"
],
"chemical_system": "Mg-Pb",
"density": 3.8258442921985893,
"density_atomic": 0.04205297350933065,
"volume": 142.67718782522547,
"volume_molar": 14.320368472074435,
"formula_full": "Mg5 Pb1",
"formula_reduced": "Mg5Pb",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0009266666666666,
"spacegroup": 38
},
{
"id": "jvasp-48613",
"created_at": "2022-09-04T14:37:05.318098Z",
"updated_at": "2022-09-04T14:37:05.318118Z",
"structure_string": "Cr4 P4 O16\n1.0\n4.683332 0.000000 0.000000\n-0.000000 6.290719 0.000000\n0.000000 0.000000 8.660091\nCr P O\n4 4 16\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.521944 0.750000 0.177004 P\n0.021944 0.250000 0.322996 P\n0.978056 0.750000 0.677004 P\n0.478056 0.250000 0.822996 P\n0.939228 0.750000 0.859454 O\n0.798841 0.250000 0.881226 O\n0.298841 0.750000 0.618774 O\n0.439228 0.250000 0.640546 O\n0.837016 0.545584 0.622964 O\n0.837016 0.954416 0.622964 O\n0.162983 0.045584 0.377036 O\n0.201159 0.750000 0.118774 O\n0.560771 0.750000 0.359454 O\n0.701159 0.250000 0.381226 O\n0.337016 0.454416 0.877036 O\n0.060771 0.250000 0.140546 O\n0.662983 0.545584 0.122964 O\n0.662983 0.954416 0.122964 O\n0.162983 0.454416 0.377036 O\n0.337016 0.045584 0.877036 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.8260672172379757,
"density_atomic": 0.09406619002806663,
"volume": 255.13949265766047,
"volume_molar": 6.402024742580909,
"formula_full": "Cr4 P4 O16",
"formula_reduced": "CrPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.851949483333334,
"spacegroup": 62
},
{
"id": "jvasp-110999",
"created_at": "2022-09-04T14:38:49.583332Z",
"updated_at": "2022-09-04T14:38:49.583347Z",
"structure_string": "Sr1 Al1 Ga1\n1.0\n4.397941 0.000000 0.000000\n-2.198971 3.808729 0.000000\n0.000000 -0.000000 4.775631\nSr Al Ga\n1 1 1\ndirect\n0.666667 0.333333 -0.000000 Sr\n0.000000 0.000000 0.500000 Al\n0.333333 0.666667 0.500000 Ga\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Al",
"Ga"
],
"chemical_system": "Al-Ga-Sr",
"density": 3.826238336231038,
"density_atomic": 0.03750256915069429,
"volume": 79.99451952065691,
"volume_molar": 16.057941886065457,
"formula_full": "Sr1 Al1 Ga1",
"formula_reduced": "SrAlGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1927946566666666,
"spacegroup": 187
},
{
"id": "jvasp-40475",
"created_at": "2022-09-04T14:37:49.457137Z",
"updated_at": "2022-09-04T14:37:49.457159Z",
"structure_string": "Li5 Si2 Bi1 O8\n1.0\n3.724233 3.892284 -0.038264\n-3.724233 3.892284 0.038264\n-0.072884 0.000000 6.405369\nLi Si Bi O\n5 2 1 8\ndirect\n0.186281 0.830550 0.529845 Li\n0.673576 0.673575 0.750000 Li\n0.324927 0.324927 0.750000 Li\n0.288639 0.288639 0.250000 Li\n0.830551 0.186280 0.970155 Li\n0.177001 0.838780 0.986037 Si\n0.838781 0.177000 0.513963 Si\n0.680528 0.680527 0.250000 Bi\n0.320853 0.699733 0.796208 O\n0.253528 0.699361 0.220243 O\n0.138210 0.209182 0.503760 O\n0.810536 0.868310 0.534367 O\n0.209183 0.138210 0.996240 O\n0.868311 0.810535 0.965633 O\n0.699733 0.320853 0.703793 O\n0.699361 0.253527 0.279758 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Si",
"Bi",
"O"
],
"chemical_system": "Bi-Li-O-Si",
"density": 3.826286793231216,
"density_atomic": 0.08616983146466811,
"volume": 185.6798339748456,
"volume_molar": 6.988688103062191,
"formula_full": "Li5 Si2 Bi1 O8",
"formula_reduced": "Li5Si2BiO8",
"formula_anonymous": "AB2C5D8",
"energy_above_hull": 2.18443309375,
"spacegroup": 5
},
{
"id": "jvasp-70252",
"created_at": "2022-09-04T14:36:02.313813Z",
"updated_at": "2022-09-04T14:36:02.313845Z",
"structure_string": "Na1 Be2 Te1\n1.0\n-2.028831 2.028831 4.444172\n2.028831 -2.028831 4.444172\n2.028831 2.028831 -4.444172\nNa Be Te\n1 2 1\ndirect\n0.250000 0.750000 0.500000 Na\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.750000 0.250000 0.500000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Te"
],
"chemical_system": "Be-Na-Te",
"density": 3.8264890730404044,
"density_atomic": 0.05466601256763792,
"volume": 73.17160722214419,
"volume_molar": 11.016242958179621,
"formula_full": "Na1 Be2 Te1",
"formula_reduced": "NaBe2Te",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1128397416666669,
"spacegroup": 139
},
{
"id": "jvasp-109888",
"created_at": "2022-09-04T14:38:11.428156Z",
"updated_at": "2022-09-04T14:38:11.428179Z",
"structure_string": "Rb2 Lu1 Ag1 Cl6\n1.0\n6.428489 -0.000000 3.711490\n2.142830 6.060837 3.711490\n-0.000000 -0.000000 7.422979\nRb Lu Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Ag\n0.756205 0.243796 0.243795 Cl\n0.243796 0.243796 0.756205 Cl\n0.243795 0.756205 0.756204 Cl\n0.243795 0.756205 0.243795 Cl\n0.756205 0.243796 0.756205 Cl\n0.756205 0.756205 0.243795 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Lu",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-Lu-Rb",
"density": 3.8266805757388305,
"density_atomic": 0.03457643861175291,
"volume": 289.2142858403262,
"volume_molar": 17.416891391333195,
"formula_full": "Rb2 Lu1 Ag1 Cl6",
"formula_reduced": "Rb2LuAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-10693",
"created_at": "2022-09-04T14:36:37.835089Z",
"updated_at": "2022-09-04T14:36:37.835102Z",
"structure_string": "K6 Sb2 O8\n1.0\n0.000000 5.742382 0.000564\n7.363319 0.000000 0.000000\n0.000000 -2.090849 -6.220342\nK Sb O\n6 2 8\ndirect\n0.250000 0.611690 0.000000 K\n0.750000 0.388310 0.000000 K\n0.750000 0.610432 0.500000 K\n0.250000 0.389568 0.500000 K\n0.750000 0.893273 0.000000 K\n0.250000 0.106727 0.000000 K\n0.250000 0.884369 0.500000 Sb\n0.750000 0.115631 0.500000 Sb\n0.005928 0.089399 0.329565 O\n0.494072 0.089399 0.670434 O\n0.432224 0.700001 0.710915 O\n0.067776 0.700001 0.289085 O\n0.567776 0.299999 0.289085 O\n0.932224 0.299999 0.710915 O\n0.994072 0.910601 0.670435 O\n0.505928 0.910601 0.329566 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"Sb",
"O"
],
"chemical_system": "K-O-Sb",
"density": 3.8267610368718863,
"density_atomic": 0.06083511900252268,
"volume": 263.00597849305626,
"volume_molar": 9.899118895041985,
"formula_full": "K6 Sb2 O8",
"formula_reduced": "K3SbO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.0173517625,
"spacegroup": 13
},
{
"id": "jvasp-118709",
"created_at": "2022-09-04T14:38:48.482987Z",
"updated_at": "2022-09-04T14:38:48.483004Z",
"structure_string": "Mg1 Si1 O3\n1.0\n3.518575 -0.000000 -0.000000\n0.000000 3.518575 0.000000\n-0.000000 0.000000 3.518575\nMg Si O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Si\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"Si",
"O"
],
"chemical_system": "Mg-O-Si",
"density": 3.826779949808507,
"density_atomic": 0.11478088431893511,
"volume": 43.561260480506355,
"volume_molar": 5.24664084593269,
"formula_full": "Mg1 Si1 O3",
"formula_reduced": "MgSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.51215763,
"spacegroup": 221
},
{
"id": "jvasp-30494",
"created_at": "2022-09-04T14:38:03.850258Z",
"updated_at": "2022-09-04T14:38:03.850286Z",
"structure_string": "Sn2 Br2 Cl2\n1.0\n6.003549 -0.000000 -0.000000\n-0.000000 6.003549 0.000000\n-0.000000 -0.000000 5.635866\nSn Br Cl\n2 2 2\ndirect\n0.750000 0.750000 0.881619 Sn\n0.250000 0.250000 0.118382 Sn\n0.250000 0.750000 -0.000000 Br\n0.750000 0.250000 0.000000 Br\n0.250000 0.250000 0.561788 Cl\n0.750000 0.750000 0.438213 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sn",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-Sn",
"density": 3.826859379839952,
"density_atomic": 0.02953755018275109,
"volume": 203.13126724720024,
"volume_molar": 20.3880847353303,
"formula_full": "Sn2 Br2 Cl2",
"formula_reduced": "SnBrCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-2068",
"created_at": "2022-09-04T14:36:47.693902Z",
"updated_at": "2022-09-04T14:36:47.693922Z",
"structure_string": "Mg1 Br2\n1.0\n1.922924 -3.330603 0.000000\n1.922924 3.330603 0.000000\n0.000000 0.000000 6.236984\nMg Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.333332 0.666666 0.240904 Br\n0.666666 0.333332 0.759095 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Br"
],
"chemical_system": "Br-Mg",
"density": 3.82687201186562,
"density_atomic": 0.03755187618569576,
"volume": 79.88948368824134,
"volume_molar": 16.036857200477108,
"formula_full": "Mg1 Br2",
"formula_reduced": "MgBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-99060",
"created_at": "2022-09-04T14:35:49.060420Z",
"updated_at": "2022-09-04T14:35:49.060448Z",
"structure_string": "Rb1 In1 Mo2 O8\n1.0\n5.886888 -0.000000 -0.000000\n-2.943444 5.098195 0.000000\n-0.000000 -0.000000 7.520296\nRb In Mo O\n1 1 2 8\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 In\n0.666668 0.333333 0.750773 Mo\n0.333334 0.666668 0.249227 Mo\n0.333592 0.166796 0.825588 O\n0.833204 0.166796 0.825588 O\n0.833205 0.666409 0.825588 O\n0.166797 0.833205 0.174412 O\n0.333334 0.666668 0.479638 O\n0.666668 0.333333 0.520363 O\n0.166797 0.333592 0.174412 O\n0.666410 0.833205 0.174412 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Rb",
"In",
"Mo",
"O"
],
"chemical_system": "In-Mo-O-Rb",
"density": 3.82692308520142,
"density_atomic": 0.05316723746241812,
"volume": 225.70290601392145,
"volume_molar": 11.326788916307379,
"formula_full": "Rb1 In1 Mo2 O8",
"formula_reduced": "RbIn(MoO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.8572924808333333,
"spacegroup": 164
},
{
"id": "jvasp-115725",
"created_at": "2022-09-04T14:38:47.666649Z",
"updated_at": "2022-09-04T14:38:47.666680Z",
"structure_string": "Rb1 Sb1 Br1\n1.0\n3.662635 0.000000 0.000000\n0.000000 3.662635 0.000000\n0.000000 0.000000 9.285775\nRb Sb Br\n1 1 1\ndirect\n0.000000 0.000000 0.626500 Rb\n0.000000 0.000000 0.003765 Sb\n0.000000 0.000000 0.291817 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Sb",
"Br"
],
"chemical_system": "Br-Rb-Sb",
"density": 3.8275859553894294,
"density_atomic": 0.024083290045532994,
"volume": 124.5676979485801,
"volume_molar": 25.00547370651709,
"formula_full": "Rb1 Sb1 Br1",
"formula_reduced": "RbSbBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1859001,
"spacegroup": 99
}
]
}