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=3660",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3658",
"results": [
{
"id": "jvasp-114280",
"created_at": "2022-09-04T14:38:40.192063Z",
"updated_at": "2022-09-04T14:38:40.192086Z",
"structure_string": "Ga1 N1 O4\n1.0\n-2.260875 2.260875 3.259277\n2.260875 -2.260875 3.259277\n2.260875 2.260875 -3.259277\nGa N O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ga\n0.250000 0.750002 0.500001 N\n0.545983 0.681403 0.493288 O\n0.188116 0.052695 0.506714 O\n0.318598 0.811887 0.864582 O\n-0.052695 0.454019 0.135421 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ga",
"N",
"O"
],
"chemical_system": "Ga-N-O",
"density": 3.6810819951879936,
"density_atomic": 0.09003614334703686,
"volume": 66.63990456447581,
"volume_molar": 6.688581425337331,
"formula_full": "Ga1 N1 O4",
"formula_reduced": "GaNO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5479982625,
"spacegroup": 82
},
{
"id": "jvasp-117843",
"created_at": "2022-09-04T14:38:29.093295Z",
"updated_at": "2022-09-04T14:38:29.093321Z",
"structure_string": "P2 Br1\n1.0\n3.288155 0.000000 1.012189\n0.000000 2.662541 0.000000\n-0.572849 0.000000 7.134228\nP Br\n2 1\ndirect\n-0.497793 0.000000 -0.592960 P\n0.097725 0.000000 0.192958 P\n0.800068 0.000000 -0.199998 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"P",
"Br"
],
"chemical_system": "Br-P",
"density": 3.6803017589399305,
"density_atomic": 0.046872873722395146,
"volume": 64.00290320938112,
"volume_molar": 12.847816405851628,
"formula_full": "P2 Br1",
"formula_reduced": "P2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 1.774738368333333,
"spacegroup": 65
},
{
"id": "jvasp-112773",
"created_at": "2022-09-04T14:38:42.305294Z",
"updated_at": "2022-09-04T14:38:42.305316Z",
"structure_string": "Ni4 P6 O20\n1.0\n8.256485 -0.000000 0.000000\n0.000000 4.563891 0.640738\n-0.000000 -0.027120 8.864138\nNi P O\n4 6 20\ndirect\n0.930983 0.042011 0.665208 Ni\n0.569016 0.042011 0.665208 Ni\n0.430983 0.957989 0.334792 Ni\n0.069017 0.957989 0.334792 Ni\n0.250000 0.670821 0.818306 P\n0.250000 0.396205 0.538847 P\n0.750000 0.329179 0.181695 P\n0.750000 0.473093 0.847142 P\n0.750000 0.603795 0.461153 P\n0.250000 0.526907 0.152859 P\n0.093167 0.683564 0.182501 O\n0.593166 0.316436 0.817499 O\n0.906833 0.316436 0.817499 O\n0.250000 0.468138 0.978516 O\n0.250000 0.408095 0.716095 O\n0.750000 0.591905 0.283906 O\n0.093140 0.230362 0.508353 O\n0.406833 0.683564 0.182501 O\n0.250000 0.712221 0.455500 O\n0.094644 0.838571 0.797533 O\n0.593140 0.769638 0.491648 O\n0.750000 0.794343 0.761693 O\n0.405356 0.838571 0.797533 O\n0.750000 0.287778 0.544501 O\n0.250000 0.205656 0.238308 O\n0.594643 0.161429 0.202467 O\n0.905356 0.161429 0.202467 O\n0.750000 0.531862 0.021484 O\n0.906859 0.769638 0.491648 O\n0.406859 0.230362 0.508353 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Ni",
"P",
"O"
],
"chemical_system": "Ni-O-P",
"density": 3.6802877714490365,
"density_atomic": 0.08977755665937001,
"volume": 334.15923885993755,
"volume_molar": 6.7078465755633525,
"formula_full": "Ni4 P6 O20",
"formula_reduced": "Ni2P3O10",
"formula_anonymous": "A2B3C10",
"energy_above_hull": 2.78998642,
"spacegroup": 11
},
{
"id": "jvasp-44912",
"created_at": "2022-09-04T14:38:01.272392Z",
"updated_at": "2022-09-04T14:38:01.272408Z",
"structure_string": "Li2 Al2 Fe1 O6\n1.0\n4.888601 0.007493 0.005228\n2.441186 4.235456 -0.005228\n-0.833646 1.440141 4.787995\nLi Al Fe O\n2 2 1 6\ndirect\n0.503024 0.503023 0.500001 Li\n0.845526 0.845525 0.500001 Li\n0.328279 0.328279 -0.000000 Al\n0.664217 0.664216 -0.000000 Al\n-0.000820 -0.000820 0.000000 Fe\n0.069617 0.603450 0.211932 O\n0.258482 0.730229 0.790981 O\n0.603449 0.069616 0.788069 O\n0.408995 0.921227 0.206601 O\n0.730229 0.258481 0.209020 O\n0.921227 0.408993 0.793400 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-Li-O",
"density": 3.6802292710333004,
"density_atomic": 0.11097244076333665,
"volume": 99.12370967363825,
"volume_molar": 5.426699384618392,
"formula_full": "Li2 Al2 Fe1 O6",
"formula_reduced": "Li2Al2FeO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.264307463636363,
"spacegroup": 5
},
{
"id": "jvasp-102129",
"created_at": "2022-09-04T14:36:42.187199Z",
"updated_at": "2022-09-04T14:36:42.187229Z",
"structure_string": "Sr6 Yb2\n1.0\n8.209185 0.000000 -0.000000\n-4.104593 7.109363 0.000000\n-0.000000 0.000000 6.740644\nYb Sr\n2 6\ndirect\n0.333333 0.666667 0.750000 Yb\n0.666667 0.333333 0.250000 Yb\n0.168008 0.336017 0.250000 Sr\n0.663983 0.831991 0.250000 Sr\n0.168009 0.831991 0.250000 Sr\n0.831991 0.663983 0.750000 Sr\n0.336017 0.168008 0.750000 Sr\n0.831991 0.168008 0.750000 Sr\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Yb",
"Sr"
],
"chemical_system": "Sr-Yb",
"density": 3.6798815421159583,
"density_atomic": 0.02033564086662671,
"volume": 393.3979780853125,
"volume_molar": 29.61372498411434,
"formula_full": "Sr6 Yb2",
"formula_reduced": "Sr3Yb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0001749999999999,
"spacegroup": 194
},
{
"id": "jvasp-70137",
"created_at": "2022-09-04T14:35:50.013062Z",
"updated_at": "2022-09-04T14:35:50.013087Z",
"structure_string": "Sr1 Mn1 Be2\n1.0\n-2.339580 2.339580 3.309708\n2.339580 -2.339580 3.309708\n2.339580 2.339580 -3.309708\nSr Mn Be\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Sr\n0.500000 0.500000 -0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Mn",
"Be"
],
"chemical_system": "Be-Mn-Sr",
"density": 3.6797777996373453,
"density_atomic": 0.05519942071014078,
"volume": 72.46452858635078,
"volume_molar": 10.909789781351206,
"formula_full": "Sr1 Mn1 Be2",
"formula_reduced": "SrMnBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0523889378448272,
"spacegroup": 216
},
{
"id": "jvasp-43570",
"created_at": "2022-09-04T14:36:11.336610Z",
"updated_at": "2022-09-04T14:36:11.336628Z",
"structure_string": "Li2 Fe3 F8\n1.0\n5.814753 0.000000 -0.000000\n-2.907377 1.678574 5.138376\n2.907377 -5.035725 0.000000\nLi Fe F\n2 3 8\ndirect\n0.141698 0.425093 0.141698 Li\n0.858302 0.574908 0.858302 Li\n0.000000 -0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 -0.000000 0.500000 Fe\n0.090521 0.759945 0.090523 F\n0.090522 0.759945 0.578900 F\n0.578899 0.759945 0.090523 F\n0.586962 0.760887 0.586963 F\n0.413038 0.239114 0.413038 F\n0.421100 0.240056 0.909477 F\n0.909478 0.240056 0.421100 F\n0.909478 0.240056 0.909477 F\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.679603641474093,
"density_atomic": 0.08640207948495256,
"volume": 150.4593416905438,
"volume_molar": 6.96990257167224,
"formula_full": "Li2 Fe3 F8",
"formula_reduced": "Li2Fe3F8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 0.8147529815384615,
"spacegroup": 166
},
{
"id": "jvasp-89096",
"created_at": "2022-09-04T14:35:55.512452Z",
"updated_at": "2022-09-04T14:35:55.512478Z",
"structure_string": "Na2 Sn4 P6 O24\n1.0\n7.572103 -0.083713 4.850975\n2.610977 7.108203 4.850975\n-0.121355 -0.083713 8.991884\nNa Sn P O\n2 4 6 24\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.499999 Na\n0.644949 0.644950 0.644949 Sn\n0.855050 0.855051 0.855049 Sn\n0.355050 0.355050 0.355050 Sn\n0.144950 0.144950 0.144950 Sn\n0.042963 0.750000 0.457036 P\n0.542963 0.957037 0.249999 P\n0.249999 0.542964 0.957036 P\n0.457036 0.042964 0.749999 P\n0.957036 0.250001 0.542962 P\n0.750000 0.457037 0.042963 P\n0.618359 0.012849 0.790870 O\n0.881639 0.709130 0.487151 O\n0.709129 0.487152 0.881639 O\n0.487152 0.881640 0.709128 O\n0.012848 0.790871 0.618360 O\n0.790871 0.618360 0.012847 O\n0.773021 0.418073 0.562621 O\n0.512848 0.118361 0.290870 O\n0.418072 0.562622 0.773021 O\n0.562621 0.773022 0.418071 O\n0.937377 0.081928 0.726978 O\n0.081927 0.726979 0.937378 O\n0.726978 0.937378 0.081927 O\n0.226978 0.581928 0.437378 O\n0.290871 0.512848 0.118360 O\n0.581927 0.437379 0.226978 O\n0.062622 0.918072 0.273021 O\n0.918072 0.273022 0.062621 O\n0.273021 0.062622 0.918072 O\n0.381640 0.987152 0.209128 O\n0.209129 0.381640 0.987151 O\n0.987151 0.209130 0.381639 O\n0.437378 0.226979 0.581927 O\n0.118360 0.290871 0.512848 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Na",
"Sn",
"P",
"O"
],
"chemical_system": "Na-O-P-Sn",
"density": 3.6795760464892635,
"density_atomic": 0.07314197687840521,
"volume": 492.19342348167805,
"volume_molar": 8.233494659313763,
"formula_full": "Na2 Sn4 P6 O24",
"formula_reduced": "NaSn2(PO4)3",
"formula_anonymous": "AB2C3D12",
"energy_above_hull": 2.5331422722222223,
"spacegroup": 167
},
{
"id": "jvasp-119962",
"created_at": "2022-09-04T14:38:54.044445Z",
"updated_at": "2022-09-04T14:38:54.044468Z",
"structure_string": "Ba2 Se1\n1.0\n4.383440 0.000000 -0.552875\n0.000000 4.330845 0.000000\n-1.132864 0.000000 8.549292\nBa Se\n2 1\ndirect\n-0.165553 0.000000 -0.132436 Ba\n0.098886 0.000000 0.399102 Ba\n0.466667 0.000000 0.133334 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 3.679429448746125,
"density_atomic": 0.018798499548515372,
"volume": 159.5872049392861,
"volume_molar": 32.03522038797827,
"formula_full": "Ba2 Se1",
"formula_reduced": "Ba2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4139686566666666,
"spacegroup": 65
},
{
"id": "jvasp-119388",
"created_at": "2022-09-04T14:38:32.195541Z",
"updated_at": "2022-09-04T14:38:32.195570Z",
"structure_string": "V3 Co1 P4 O16\n1.0\n5.728050 -0.000000 0.000000\n0.000000 4.756598 0.039538\n-0.000000 -0.004449 9.800016\nV Co P O\n3 1 4 16\ndirect\n-0.000000 0.452037 0.770268 V\n0.500000 0.564190 0.227297 V\n0.500000 0.949107 0.730698 V\n-0.000000 0.057085 0.272064 Co\n0.500000 0.130175 0.409468 P\n0.500000 0.383174 0.913343 P\n-0.000000 0.591949 0.088397 P\n-0.000000 0.890446 0.587809 P\n0.790789 0.740121 0.668295 O\n0.500000 0.815224 0.381377 O\n0.500000 0.699193 0.887707 O\n0.213834 0.736223 0.163880 O\n0.786166 0.736223 0.163880 O\n-0.000000 0.673585 0.936653 O\n0.500000 0.313686 0.064640 O\n-0.000000 0.204781 0.616366 O\n0.290895 0.235884 0.834566 O\n-0.000000 0.275722 0.104704 O\n0.209211 0.740121 0.668295 O\n0.706895 0.288216 0.336608 O\n0.293106 0.288216 0.336608 O\n0.500000 0.174784 0.564124 O\n0.709105 0.235884 0.834566 O\n-0.000000 0.823977 0.438388 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"V",
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P-V",
"density": 3.6794021704351376,
"density_atomic": 0.08988341591850627,
"volume": 267.01254903084515,
"volume_molar": 6.699946478958963,
"formula_full": "V3 Co1 P4 O16",
"formula_reduced": "V3Co(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 3.4604958958333336,
"spacegroup": 6
},
{
"id": "jvasp-49813",
"created_at": "2022-09-04T14:37:01.572723Z",
"updated_at": "2022-09-04T14:37:01.572752Z",
"structure_string": "Sc4 O6\n1.0\n5.411171 -0.000000 0.000000\n-2.705586 1.562071 4.909046\n2.705586 -4.686212 0.000000\nSc O\n4 6\ndirect\n0.000000 0.000000 0.000000 Sc\n0.299199 0.897596 0.299199 Sc\n0.500000 0.500000 0.500000 Sc\n0.700801 0.102405 0.700801 Sc\n0.286338 0.781599 0.610919 O\n0.389081 0.218401 0.115659 O\n0.115660 0.218401 0.713662 O\n0.884340 0.781599 0.286338 O\n0.610919 0.781599 0.884341 O\n0.713662 0.218401 0.389081 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sc",
"O"
],
"chemical_system": "O-Sc",
"density": 3.679295212165955,
"density_atomic": 0.0803322087483449,
"volume": 124.4830704372489,
"volume_molar": 7.496545724101076,
"formula_full": "Sc4 O6",
"formula_reduced": "Sc2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.9052402,
"spacegroup": 148
},
{
"id": "jvasp-117054",
"created_at": "2022-09-04T14:38:49.151397Z",
"updated_at": "2022-09-04T14:38:49.151418Z",
"structure_string": "Mg2 Sc1 Mo3 S8\n1.0\n6.436946 0.001930 3.553012\n2.097454 6.085862 3.552491\n0.001901 0.001891 7.352397\nMg Sc Mo S\n2 1 3 8\ndirect\n0.877087 0.877086 0.877087 Mg\n0.122914 0.122917 0.122924 Mg\n0.499987 0.499992 0.500009 Sc\n0.500007 0.500005 -0.000006 Mo\n0.000002 0.499997 0.499997 Mo\n0.500002 -0.000001 0.499999 Mo\n0.739978 0.739980 0.739960 S\n0.254492 0.254497 0.723380 S\n0.254501 0.723375 0.254506 S\n0.723375 0.254502 0.254500 S\n0.745494 0.276627 0.745491 S\n0.276627 0.745496 0.745501 S\n0.260040 0.260027 0.260024 S\n0.745498 0.745490 0.276630 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Mg",
"Sc",
"Mo",
"S"
],
"chemical_system": "Mg-Mo-S-Sc",
"density": 3.6789647515551374,
"density_atomic": 0.04862369268908702,
"volume": 287.9254788302437,
"volume_molar": 12.385198299329485,
"formula_full": "Mg2 Sc1 Mo3 S8",
"formula_reduced": "Mg2ScMo3S8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.930348646428571,
"spacegroup": 166
}
]
}