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=4199",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4197",
"results": [
{
"id": "jvasp-50838",
"created_at": "2022-09-04T14:37:00.856571Z",
"updated_at": "2022-09-04T14:37:00.856593Z",
"structure_string": "Li2 Cr1 S4\n1.0\n-3.392933 0.000227 -0.000338\n-0.000340 -5.903618 -0.032604\n1.696131 2.889576 5.910932\nLi Cr S\n2 1 4\ndirect\n0.407768 0.912604 0.315705 Li\n0.994909 0.433540 0.490036 Li\n0.701290 0.173018 0.902862 Cr\n0.337620 0.238292 0.175481 S\n0.765795 0.622644 0.031868 S\n0.636863 0.723407 0.773900 S\n0.064972 0.107784 0.630254 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"Cr",
"S"
],
"chemical_system": "Cr-Li-S",
"density": 2.73021570473891,
"density_atomic": 0.0592836764104911,
"volume": 118.07634788926904,
"volume_molar": 10.158176963084388,
"formula_full": "Li2 Cr1 S4",
"formula_reduced": "Li2CrS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.1163682,
"spacegroup": 12
},
{
"id": "jvasp-97314",
"created_at": "2022-09-04T14:35:46.291505Z",
"updated_at": "2022-09-04T14:35:46.291532Z",
"structure_string": "Li2 Sc2 P4 O14\n1.0\n4.932943 -0.045526 0.000000\n-2.424768 6.673342 0.000000\n0.000000 0.000000 8.373817\nLi Sc P O\n2 2 4 14\ndirect\n0.813368 0.334109 0.358166 Li\n0.186630 0.665891 0.858167 Li\n0.779280 0.265577 0.000628 Sc\n0.220719 0.734423 0.500628 Sc\n0.593497 0.469178 0.679260 P\n0.193074 0.074637 0.786210 P\n0.806925 0.925362 0.286210 P\n0.406501 0.530821 0.179260 P\n0.388037 0.236136 0.656509 O\n0.925528 0.125550 0.821443 O\n0.373508 0.082012 0.936077 O\n0.242262 0.514330 0.337249 O\n0.626490 0.917987 0.436077 O\n0.757737 0.485670 0.837249 O\n0.074471 0.874449 0.321443 O\n0.128351 0.872685 0.701712 O\n0.871647 0.127314 0.201712 O\n0.397650 0.594839 0.680935 O\n0.203916 0.491286 0.034813 O\n0.796083 0.508713 0.534813 O\n0.611962 0.763863 0.156509 O\n0.602349 0.405160 0.180935 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Sc",
"P",
"O"
],
"chemical_system": "Li-O-P-Sc",
"density": 2.730022710721561,
"density_atomic": 0.08007713537993233,
"volume": 274.73510254355693,
"volume_molar": 7.520424814683337,
"formula_full": "Li2 Sc2 P4 O14",
"formula_reduced": "LiScP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.6219791590909085,
"spacegroup": 4
},
{
"id": "jvasp-92891",
"created_at": "2022-09-04T14:35:43.178587Z",
"updated_at": "2022-09-04T14:35:43.178613Z",
"structure_string": "Mg6 Cr1 Ga1\n1.0\n6.193614 0.009195 0.000000\n-3.088844 5.368424 0.000000\n0.000000 0.000000 4.890712\nMg Cr Ga\n6 1 1\ndirect\n0.169544 0.839121 0.250000 Mg\n0.660878 0.330455 0.250000 Mg\n0.665986 0.834012 0.250000 Mg\n0.330556 0.655865 0.750000 Mg\n0.844134 0.169443 0.750000 Mg\n0.832553 0.667445 0.750000 Mg\n0.171785 0.328215 0.250000 Cr\n0.324561 0.175438 0.750000 Ga\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"Ga"
],
"chemical_system": "Cr-Ga-Mg",
"density": 2.729724037872506,
"density_atomic": 0.049153691483782805,
"volume": 162.75481573219025,
"volume_molar": 12.251655121338901,
"formula_full": "Mg6 Cr1 Ga1",
"formula_reduced": "Mg6CrGa",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-71200",
"created_at": "2022-09-04T14:35:45.024462Z",
"updated_at": "2022-09-04T14:35:45.024487Z",
"structure_string": "K1 Be2 Ge1\n1.0\n3.121159 -4.900913 0.000000\n3.121159 4.900913 0.000000\n0.000000 0.000000 2.580382\nK Be Ge\n1 2 1\ndirect\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.500000 0.000000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-K",
"density": 2.7295557223664924,
"density_atomic": 0.05067025682529156,
"volume": 78.94177473368241,
"volume_molar": 11.884961982261174,
"formula_full": "K1 Be2 Ge1",
"formula_reduced": "KBe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1401215375,
"spacegroup": 65
},
{
"id": "jvasp-100924",
"created_at": "2022-09-04T14:37:10.402409Z",
"updated_at": "2022-09-04T14:37:10.402440Z",
"structure_string": "Na2 Li1 Dy1 Cl6\n1.0\n6.208280 -0.000000 3.584352\n2.069427 5.853222 3.584352\n-0.000000 -0.000000 7.168704\nNa Li Dy Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Dy\n0.743678 0.256322 0.256321 Cl\n0.256322 0.256322 0.743678 Cl\n0.256322 0.743678 0.743677 Cl\n0.256322 0.743678 0.256321 Cl\n0.743678 0.256322 0.743677 Cl\n0.743679 0.743678 0.256321 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Li",
"Dy",
"Cl"
],
"chemical_system": "Cl-Dy-Li-Na",
"density": 2.729144175030644,
"density_atomic": 0.03838778549888714,
"volume": 260.4995279107699,
"volume_molar": 15.687648249922054,
"formula_full": "Na2 Li1 Dy1 Cl6",
"formula_reduced": "Na2LiDyCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-10291",
"created_at": "2022-09-04T14:38:32.558569Z",
"updated_at": "2022-09-04T14:38:32.558601Z",
"structure_string": "Se2 S4 N4 O4\n1.0\n4.269067 0.000000 -1.178541\n-0.247433 6.930048 -0.896286\n0.012051 -0.101061 8.364910\nSe S N O\n2 4 4 4\ndirect\n0.871209 0.250000 0.000000 Se\n0.128793 0.750000 -0.000000 Se\n0.492369 0.375600 0.682259 S\n0.810110 0.124400 0.317742 S\n0.507632 0.624401 0.317741 S\n0.189891 0.875600 0.682258 S\n0.508267 0.303799 0.849556 N\n0.658710 0.196201 0.150444 N\n0.491735 0.696201 0.150443 N\n0.341291 0.803800 0.849556 N\n0.792531 0.406543 0.642339 O\n0.150192 0.093457 0.357662 O\n0.849809 0.906543 0.642338 O\n0.207470 0.593457 0.357661 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Se",
"S",
"N",
"O"
],
"chemical_system": "N-O-S-Se",
"density": 2.729110934966965,
"density_atomic": 0.05664420741869917,
"volume": 247.1567815666598,
"volume_molar": 10.631520917021419,
"formula_full": "Se2 S4 N4 O4",
"formula_reduced": "SeS2(NO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 3.293325266666667,
"spacegroup": 15
},
{
"id": "jvasp-70164",
"created_at": "2022-09-04T14:36:11.324163Z",
"updated_at": "2022-09-04T14:36:11.324180Z",
"structure_string": "Li1 Ti1 Be2\n1.0\n-1.986016 1.986016 2.809244\n1.986016 -1.986016 2.809244\n1.986016 1.986016 -2.809244\nLi Ti Be\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Li\n0.750001 0.250000 0.500001 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ti",
"Be"
],
"chemical_system": "Be-Li-Ti",
"density": 2.7287174283270814,
"density_atomic": 0.09024955144023442,
"volume": 44.32154992647142,
"volume_molar": 6.672765308964464,
"formula_full": "Li1 Ti1 Be2",
"formula_reduced": "LiTiBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.073602633333333,
"spacegroup": 216
},
{
"id": "jvasp-47453",
"created_at": "2022-09-04T14:36:57.362804Z",
"updated_at": "2022-09-04T14:36:57.362829Z",
"structure_string": "Li8 Fe2 O6\n1.0\n5.053819 -0.001445 0.001284\n-2.525320 4.953035 -0.018936\n-0.002181 -2.456704 6.409034\nLi Fe O\n8 2 6\ndirect\n0.267084 0.225035 0.937605 Li\n0.959405 0.224969 0.437714 Li\n0.567366 0.442632 0.639776 Li\n0.085706 0.601473 0.840732 Li\n0.876790 0.442579 0.139759 Li\n0.517213 0.601362 0.340690 Li\n0.024315 0.736100 0.526855 Li\n0.713333 0.736173 0.026883 Li\n0.619382 0.964923 0.747225 Fe\n0.347023 0.964928 0.247273 Fe\n0.662922 0.334625 0.860660 O\n0.673234 0.334585 0.360670 O\n0.295055 0.592276 0.596622 O\n0.917486 0.870157 0.801210 O\n0.298762 0.592319 0.096617 O\n0.954147 0.870107 0.301220 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 2.7286873103236085,
"density_atomic": 0.09988838956211094,
"volume": 160.17877623355963,
"volume_molar": 6.028869607768993,
"formula_full": "Li8 Fe2 O6",
"formula_reduced": "Li4FeO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.729507,
"spacegroup": 9
},
{
"id": "jvasp-59630",
"created_at": "2022-09-04T14:37:05.117553Z",
"updated_at": "2022-09-04T14:37:05.117577Z",
"structure_string": "Rb2 Fe1 Cu1 C6 N6\n1.0\n6.295837 0.000000 3.634903\n2.098612 5.935771 3.634903\n-0.000000 0.000000 7.269806\nRb Fe Cu C N\n2 1 1 6 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Cu\n0.182579 0.817421 0.182579 C\n0.817421 0.182579 0.817421 C\n0.182579 0.817421 0.817421 C\n0.817421 0.817421 0.182578 C\n0.817421 0.182579 0.182578 C\n0.182579 0.182579 0.817421 C\n0.703095 0.703095 0.296905 N\n0.296905 0.703095 0.703095 N\n0.703095 0.296905 0.703095 N\n0.296905 0.703095 0.296905 N\n0.703095 0.296905 0.296905 N\n0.296905 0.296905 0.703095 N\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Rb",
"Fe",
"Cu",
"C",
"N"
],
"chemical_system": "C-Cu-Fe-N-Rb",
"density": 2.7286636591414375,
"density_atomic": 0.05889338920540941,
"volume": 271.6773514968703,
"volume_molar": 10.225495325113435,
"formula_full": "Rb2 Fe1 Cu1 C6 N6",
"formula_reduced": "Rb2FeCu(CN)6",
"formula_anonymous": "ABC2D6E6",
"energy_above_hull": 5.320863465625,
"spacegroup": 225
},
{
"id": "jvasp-99656",
"created_at": "2022-09-04T14:36:09.471464Z",
"updated_at": "2022-09-04T14:36:09.471480Z",
"structure_string": "Mg6 Si1 Ge2\n1.0\n5.818660 0.003610 -5.206316\n-0.583581 4.278855 -6.504874\n0.001130 -0.003610 7.807851\nMg Si Ge\n6 1 2\ndirect\n0.750803 0.500000 0.250802 Mg\n0.415808 0.166224 0.249582 Mg\n0.083358 0.833775 0.249582 Mg\n0.249197 0.499999 0.749197 Mg\n0.916642 0.166224 0.750417 Mg\n0.584192 0.833775 0.750417 Mg\n0.000000 0.000000 0.000000 Si\n0.666676 0.666676 -0.000001 Ge\n0.333324 0.333323 -0.000000 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Ge"
],
"chemical_system": "Ge-Mg-Si",
"density": 2.7281025489167687,
"density_atomic": 0.04632307099151516,
"volume": 194.28763696708492,
"volume_molar": 13.000305530484054,
"formula_full": "Mg6 Si1 Ge2",
"formula_reduced": "Mg6SiGe2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-118566",
"created_at": "2022-09-04T14:38:45.529925Z",
"updated_at": "2022-09-04T14:38:45.529956Z",
"structure_string": "Rb1 I1 N1\n1.0\n5.893023 0.000000 -0.000000\n-2.946511 5.103507 0.000000\n-0.000000 0.000000 4.581868\nRb I N\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Rb\n0.000000 0.000000 0.000000 I\n0.333333 0.666666 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"I",
"N"
],
"chemical_system": "I-N-Rb",
"density": 2.7279458972607142,
"density_atomic": 0.02177067178719699,
"volume": 137.80006558016532,
"volume_molar": 27.661713055366224,
"formula_full": "Rb1 I1 N1",
"formula_reduced": "RbIN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4238931749999997,
"spacegroup": 187
},
{
"id": "jvasp-114521",
"created_at": "2022-09-04T14:38:40.972630Z",
"updated_at": "2022-09-04T14:38:40.972659Z",
"structure_string": "Y1 B1 O1\n1.0\n3.401559 -0.000000 0.000000\n0.000000 3.401559 0.000000\n0.000000 0.000000 6.087804\nY B O\n1 1 1\ndirect\n0.000000 0.000000 0.668839 Y\n0.000000 0.000000 0.234660 B\n0.000000 0.000000 0.028714 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"B",
"O"
],
"chemical_system": "B-O-Y",
"density": 2.727889477099035,
"density_atomic": 0.04258969958279048,
"volume": 70.43956706405676,
"volume_molar": 14.139899597773658,
"formula_full": "Y1 B1 O1",
"formula_reduced": "YBO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.5861338444444444,
"spacegroup": 99
}
]
}