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_atomic&page=1124",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=1122",
"results": [
{
"id": "jvasp-52516",
"created_at": "2022-09-04T14:38:17.314668Z",
"updated_at": "2022-09-04T14:38:17.314685Z",
"structure_string": "Sb2 O4 F2\n1.0\n1.940611 -4.645563 -0.105064\n3.418359 4.328211 -0.290687\n-0.126070 -2.721856 4.234841\nSb O F\n2 4 2\ndirect\n0.689308 0.150146 0.752785 Sb\n0.252785 0.650146 0.189308 Sb\n0.102210 0.413153 0.818367 O\n0.459049 0.399608 0.126438 O\n0.318368 0.913153 0.602209 O\n0.626438 0.899608 0.959049 O\n0.836312 0.400740 0.457962 F\n0.957961 0.900740 0.336313 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sb",
"O",
"F"
],
"chemical_system": "F-O-Sb",
"density": 5.6229914234055105,
"density_atomic": 0.07840470956576097,
"volume": 102.0346870016794,
"volume_molar": 7.680840594083197,
"formula_full": "Sb2 O4 F2",
"formula_reduced": "SbO2F",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.163520845625,
"spacegroup": 9
},
{
"id": "jvasp-9103",
"created_at": "2022-09-04T14:37:27.887792Z",
"updated_at": "2022-09-04T14:37:27.887822Z",
"structure_string": "N4 O8\n1.0\n0.000000 5.905969 0.035048\n4.612273 0.000000 0.000000\n0.000000 -3.116986 -5.637535\nN O\n4 8\ndirect\n0.164400 0.006218 0.018406 N\n0.835600 0.506217 0.481594 N\n0.835599 0.993782 0.981594 N\n0.164400 0.493782 0.518407 N\n0.290126 0.206587 0.138967 O\n0.709874 0.706586 0.361033 O\n0.709874 0.793413 0.861033 O\n0.290126 0.293413 0.638968 O\n0.205409 0.811314 0.916975 O\n0.794591 0.311315 0.583026 O\n0.794591 0.188685 0.083026 O\n0.205409 0.688685 0.416974 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"N",
"O"
],
"chemical_system": "N-O",
"density": 1.9964145437793024,
"density_atomic": 0.07839947007708813,
"volume": 153.0622590714034,
"volume_molar": 7.681353909763151,
"formula_full": "N4 O8",
"formula_reduced": "NO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.889666750000001,
"spacegroup": 14
},
{
"id": "jvasp-58146",
"created_at": "2022-09-04T14:37:45.692077Z",
"updated_at": "2022-09-04T14:37:45.692100Z",
"structure_string": "Ca4 Ag2 W2 O12\n1.0\n0.000000 5.587999 -0.030514\n5.966800 0.000000 0.000000\n0.000000 -5.474811 -7.621218\nCa Ag W O\n4 2 2 12\ndirect\n0.268522 0.068529 0.253043 Ca\n0.731478 0.568528 0.246957 Ca\n0.731478 0.931471 0.746957 Ca\n0.268522 0.431471 0.753043 Ca\n0.500000 0.000000 -0.000000 Ag\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.878961 0.946088 0.260234 O\n0.121039 0.446088 0.239765 O\n0.340056 0.337481 0.051277 O\n0.659943 0.837481 0.448722 O\n0.659944 0.662519 0.948722 O\n0.220601 0.776275 0.068431 O\n0.779399 0.223725 0.931569 O\n0.220601 0.723725 0.568431 O\n0.121039 0.053912 0.739766 O\n0.779399 0.276275 0.431568 O\n0.340057 0.162519 0.551277 O\n0.878961 0.553912 0.760234 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Ag",
"W",
"O"
],
"chemical_system": "Ag-Ca-O-W",
"density": 6.090782584808061,
"density_atomic": 0.07839845902165399,
"volume": 255.10705503122088,
"volume_molar": 7.681452971335393,
"formula_full": "Ca4 Ag2 W2 O12",
"formula_reduced": "Ca2AgWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.3044029100000003,
"spacegroup": 14
},
{
"id": "jvasp-44097",
"created_at": "2022-09-04T14:36:14.636174Z",
"updated_at": "2022-09-04T14:36:14.636202Z",
"structure_string": "Zn4 Se4 O16\n1.0\n4.943205 0.000000 0.000000\n0.000000 6.767342 0.000000\n0.000000 0.000000 9.151264\nZn Se O\n4 4 16\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n0.527876 0.750000 0.180957 Se\n0.027876 0.250000 0.319043 Se\n0.972123 0.750000 0.680957 Se\n0.472123 0.250000 0.819042 Se\n0.327721 0.458444 0.875017 O\n0.930400 0.750000 0.866036 O\n0.430401 0.250000 0.633963 O\n0.827720 0.541555 0.624983 O\n0.296516 0.750000 0.625396 O\n0.827720 0.958444 0.624983 O\n0.172279 0.458444 0.375017 O\n0.069599 0.250000 0.133963 O\n0.703483 0.250000 0.374603 O\n0.569598 0.750000 0.366037 O\n0.796515 0.250000 0.874603 O\n0.672278 0.541555 0.124983 O\n0.203484 0.750000 0.125396 O\n0.672278 0.958444 0.124983 O\n0.172279 0.041556 0.375017 O\n0.327721 0.041556 0.875017 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Zn",
"Se",
"O"
],
"chemical_system": "O-Se-Zn",
"density": 4.520946454781676,
"density_atomic": 0.07839771612684626,
"volume": 306.13136690319374,
"volume_molar": 7.681525760592658,
"formula_full": "Zn4 Se4 O16",
"formula_reduced": "ZnSeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5885196277777784,
"spacegroup": 62
},
{
"id": "jvasp-57317",
"created_at": "2022-09-04T14:38:12.783811Z",
"updated_at": "2022-09-04T14:38:12.783837Z",
"structure_string": "Ba2 Tb4 Mn4 O14\n1.0\n5.516159 0.002468 0.000015\n0.003124 5.601981 -0.000163\n0.001696 2.800567 9.906744\nTb Ba Mn O\n4 2 4 14\ndirect\n0.734436 0.541741 0.365659 Tb\n0.265565 0.458259 0.634341 Tb\n0.265574 0.092600 0.365659 Tb\n0.734426 0.907401 0.634341 Tb\n0.747020 0.742450 0.000003 Ba\n0.252980 0.257550 -0.000003 Ba\n0.753613 0.349200 0.793458 Mn\n0.246384 0.857349 0.793459 Mn\n0.246388 0.650801 0.206543 Mn\n0.753616 0.142652 0.206542 Mn\n0.000000 0.393512 0.212968 O\n-0.000000 0.606488 0.787032 O\n0.726978 0.530367 0.580492 O\n0.759587 0.222846 -0.000004 O\n0.273023 0.469634 0.419509 O\n0.500003 0.399186 0.201625 O\n0.499998 0.600815 0.798376 O\n0.000000 0.875672 0.248649 O\n0.273026 0.889139 0.580489 O\n0.726974 0.110861 0.419512 O\n0.240413 0.777153 0.000005 O\n0.500005 0.882370 0.235251 O\n-0.000000 0.124328 0.751351 O\n0.499996 0.117630 0.764750 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Tb",
"Ba",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-O-Tb",
"density": 7.3449147704542295,
"density_atomic": 0.07839681693005228,
"volume": 306.13487817258493,
"volume_molar": 7.681613866253159,
"formula_full": "Ba2 Tb4 Mn4 O14",
"formula_reduced": "BaTb2Mn2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.602708479396552,
"spacegroup": 12
},
{
"id": "jvasp-20996",
"created_at": "2022-09-04T14:37:36.615141Z",
"updated_at": "2022-09-04T14:37:36.615166Z",
"structure_string": "Ca2 S2 O8\n1.0\n4.688967 -0.009037 0.000000\n-0.525639 4.659421 -0.000000\n-0.000000 -0.000000 7.007626\nCa S O\n2 2 8\ndirect\n0.351575 0.351575 0.750000 Ca\n0.648425 0.648425 0.250000 Ca\n0.848199 0.848198 0.750000 S\n0.151801 0.151801 0.250000 S\n0.159705 0.818299 0.750000 O\n0.840296 0.181700 0.250000 O\n0.818300 0.159704 0.750000 O\n0.181700 0.840295 0.250000 O\n0.294587 0.294587 0.080841 O\n0.705413 0.705413 0.580842 O\n0.294587 0.294587 0.419159 O\n0.705413 0.705413 0.919159 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"S",
"O"
],
"chemical_system": "Ca-O-S",
"density": 2.953800396289326,
"density_atomic": 0.07839631279520727,
"volume": 153.06842340082116,
"volume_molar": 7.681663263591857,
"formula_full": "Ca2 S2 O8",
"formula_reduced": "CaSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6640840700000004,
"spacegroup": 63
},
{
"id": "jvasp-11647",
"created_at": "2022-09-04T14:37:07.359321Z",
"updated_at": "2022-09-04T14:37:07.359350Z",
"structure_string": "Y2 Mn4 O8\n1.0\n5.431845 -0.127336 -2.928370\n-1.521069 5.317118 -2.740642\n-0.207000 -0.048008 6.372217\nY Mn O\n2 4 8\ndirect\n-0.000000 0.500001 0.000001 Y\n0.000001 -0.000000 0.500000 Y\n0.380948 0.630947 0.750001 Mn\n0.619053 0.369053 0.250000 Mn\n0.500001 -0.000001 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.698600 0.759409 0.473122 O\n0.786288 0.225480 0.026881 O\n0.216368 0.215739 0.981652 O\n0.301400 0.240592 0.526880 O\n0.265913 0.765284 0.481651 O\n0.213712 0.774520 0.973122 O\n0.734086 0.234714 0.518348 O\n0.783632 0.784261 0.018349 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 4.886873111607859,
"density_atomic": 0.07839501673217152,
"volume": 178.5827796660795,
"volume_molar": 7.6817902604371175,
"formula_full": "Y2 Mn4 O8",
"formula_reduced": "YMn2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.0883234189655173,
"spacegroup": 15
},
{
"id": "jvasp-15243",
"created_at": "2022-09-04T14:36:45.748427Z",
"updated_at": "2022-09-04T14:36:45.748462Z",
"structure_string": "Ce3 B2 N4\n1.0\n3.367293 -0.000000 -0.963937\n-0.868109 5.350813 -3.032541\n0.001516 0.004501 6.368695\nCe B N\n3 2 4\ndirect\n0.197973 0.697972 0.395945 Ce\n0.802027 0.302027 0.604054 Ce\n0.000000 0.000000 0.000000 Ce\n0.500000 0.358281 -0.000000 B\n0.500001 0.641719 0.999999 B\n0.621897 0.360549 0.243792 N\n0.621896 0.883243 0.243792 N\n0.378104 0.116756 0.756206 N\n0.378103 0.639450 0.756206 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ce",
"B",
"N"
],
"chemical_system": "B-Ce-N",
"density": 7.202889817463721,
"density_atomic": 0.07839234054731796,
"volume": 114.80713469152718,
"volume_molar": 7.6820525040517325,
"formula_full": "Ce3 B2 N4",
"formula_reduced": "Ce3(BN2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.577101629629629,
"spacegroup": 71
},
{
"id": "jvasp-10775",
"created_at": "2022-09-04T14:38:15.180558Z",
"updated_at": "2022-09-04T14:38:15.180584Z",
"structure_string": "Ba2 Zn2 C2 O6 F4\n1.0\n2.448658 -4.241199 -0.000000\n2.448657 4.241199 0.000000\n0.000000 -0.000000 9.826677\nBa Zn C O F\n2 2 2 6 4\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666668 0.750000 Zn\n0.666668 0.333333 0.250000 Zn\n0.666668 0.333333 0.750000 C\n0.333333 0.666668 0.250000 C\n0.275167 0.896811 0.250000 O\n0.378356 0.275167 0.750000 O\n0.621645 0.724834 0.250000 O\n0.724834 0.103190 0.750000 O\n0.103190 0.378356 0.250000 O\n0.896811 0.621645 0.750000 O\n0.666668 0.333333 0.457387 F\n0.333333 0.666668 0.957387 F\n0.666668 0.333333 0.042613 F\n0.333333 0.666668 0.542613 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ba",
"Zn",
"C",
"O",
"F"
],
"chemical_system": "Ba-C-F-O-Zn",
"density": 4.893497627033984,
"density_atomic": 0.0783910735405965,
"volume": 204.10487160523522,
"volume_molar": 7.682176666302835,
"formula_full": "Ba2 Zn2 C2 O6 F4",
"formula_reduced": "BaZnCO3F2",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 1.310382179375,
"spacegroup": 176
},
{
"id": "jvasp-52278",
"created_at": "2022-09-04T14:36:58.276247Z",
"updated_at": "2022-09-04T14:36:58.276272Z",
"structure_string": "Y2 U2 O8\n1.0\n-5.337476 2.677689 2.677689\n0.000000 -0.000000 5.355377\n0.000000 5.355377 -0.000000\nY U O\n2 2 8\ndirect\n0.500000 0.750000 0.250000 Y\n0.000000 0.000000 0.000000 Y\n0.500000 0.250000 0.750000 U\n0.000000 0.500000 0.500000 U\n0.750001 0.375000 0.386244 O\n0.750001 0.875000 0.863756 O\n0.750001 0.875000 0.386244 O\n0.750001 0.375000 0.863756 O\n0.250000 0.136244 0.625000 O\n0.250000 0.613756 0.125000 O\n0.250000 0.613756 0.625000 O\n0.250000 0.136244 0.125000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"U",
"O"
],
"chemical_system": "O-U-Y",
"density": 8.481344051911616,
"density_atomic": 0.07839082095775018,
"volume": 153.07914693823102,
"volume_molar": 7.6822014190229195,
"formula_full": "Y2 U2 O8",
"formula_reduced": "YUO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.801074241666667,
"spacegroup": 141
},
{
"id": "jvasp-48200",
"created_at": "2022-09-04T14:37:58.414192Z",
"updated_at": "2022-09-04T14:37:58.414211Z",
"structure_string": "K2 Mn4 O8\n1.0\n0.000000 2.914189 -0.085175\n12.489280 0.000000 0.000000\n0.000000 -0.143297 -4.902727\nK Mn O\n2 4 8\ndirect\n-0.000002 0.250000 0.325235 K\n0.000001 0.750000 0.674766 K\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500015 0.418490 0.164426 O\n0.500015 0.081510 0.164426 O\n-0.000013 0.580733 0.335763 O\n-0.000013 0.919267 0.335763 O\n0.499985 0.918490 0.835574 O\n0.499985 0.581510 0.835574 O\n0.000012 0.419267 0.664238 O\n0.000012 0.080733 0.664238 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"K",
"Mn",
"O"
],
"chemical_system": "K-Mn-O",
"density": 3.960389578773602,
"density_atomic": 0.07839066752974257,
"volume": 178.59268763961214,
"volume_molar": 7.682216454803261,
"formula_full": "K2 Mn4 O8",
"formula_reduced": "KMn2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.53073521182266,
"spacegroup": 51
},
{
"id": "jvasp-38653",
"created_at": "2022-09-04T14:37:57.517534Z",
"updated_at": "2022-09-04T14:37:57.517556Z",
"structure_string": "Na1 Ni3\n1.0\n-1.879619 1.879619 3.610749\n1.879619 -1.879619 3.610749\n1.879619 1.879619 -3.610749\nNa Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.749998 0.249999 0.499999 Ni\n0.249999 0.749998 0.499999 Ni\n0.500000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Ni"
],
"chemical_system": "Na-Ni",
"density": 6.478252974340168,
"density_atomic": 0.07839043014865574,
"volume": 51.026636700609984,
"volume_molar": 7.682239718011383,
"formula_full": "Na1 Ni3",
"formula_reduced": "NaNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.7106040500000002,
"spacegroup": 139
}
]
}