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=-created_at&page=4489",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=4487",
"results": [
{
"id": "jvasp-88181",
"created_at": "2022-09-04T14:35:45.853120Z",
"updated_at": "2022-09-04T14:35:45.853139Z",
"structure_string": "Pr16 Te12 N8\n1.0\n7.446863 0.000000 0.000000\n-0.000000 11.476020 0.000000\n0.000000 0.000000 11.841514\nPr Te N\n16 12 8\ndirect\n0.852708 0.610225 0.550412 Pr\n0.647291 0.110225 0.449587 Pr\n0.852708 0.610225 0.949587 Pr\n0.908001 0.339447 0.750000 Pr\n0.352708 0.889775 0.949587 Pr\n0.647291 0.110225 0.050412 Pr\n0.591998 0.839447 0.250000 Pr\n0.726474 0.469751 0.250000 Pr\n0.352708 0.889775 0.550412 Pr\n0.147292 0.389775 0.050412 Pr\n0.408001 0.160553 0.750000 Pr\n0.273525 0.530249 0.750000 Pr\n0.226475 0.030249 0.250000 Pr\n0.091999 0.660553 0.250000 Pr\n0.147292 0.389775 0.449587 Pr\n0.773525 0.969751 0.750000 Pr\n0.434110 0.635154 0.421407 Te\n0.434110 0.635154 0.078593 Te\n0.065889 0.135154 0.578593 Te\n0.934110 0.864846 0.421407 Te\n0.934110 0.864846 0.078593 Te\n0.565889 0.364846 0.921407 Te\n0.081553 0.772909 0.750000 Te\n0.418447 0.272909 0.250000 Te\n0.065889 0.135154 0.921407 Te\n0.565889 0.364846 0.578593 Te\n0.918447 0.227091 0.250000 Te\n0.581553 0.727091 0.750000 Te\n0.553306 0.033392 0.621893 N\n0.053306 0.466608 0.621893 N\n0.553306 0.033392 0.878106 N\n0.446693 0.966608 0.378106 N\n0.946693 0.533392 0.378106 N\n0.946693 0.533392 0.121894 N\n0.446693 0.966608 0.121894 N\n0.053306 0.466608 0.878106 N\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Pr",
"Te",
"N"
],
"chemical_system": "N-Pr-Te",
"density": 6.395788314888894,
"density_atomic": 0.035573828526894405,
"volume": 1011.9799158750484,
"volume_molar": 16.928570832479167,
"formula_full": "Pr16 Te12 N8",
"formula_reduced": "Pr4Te3N2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.4283910222222223,
"spacegroup": 62
},
{
"id": "jvasp-86880",
"created_at": "2022-09-04T14:35:45.848665Z",
"updated_at": "2022-09-04T14:35:45.848692Z",
"structure_string": "Er3 Ag3 Ge3\n1.0\n7.114458 -0.000000 0.000000\n-3.557229 6.161302 -0.000000\n0.000000 -0.000000 4.157024\nEr Ag Ge\n3 3 3\ndirect\n0.585459 0.000000 0.000000 Er\n0.414541 0.414541 0.000000 Er\n-0.000000 0.585458 0.000000 Er\n0.746612 0.746612 0.499999 Ag\n0.253388 0.000000 0.499999 Ag\n-0.000000 0.253388 0.499999 Ag\n0.000000 0.000000 0.000000 Ge\n0.666667 0.333333 0.499999 Ge\n0.333333 0.666667 0.499999 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Er",
"Ag",
"Ge"
],
"chemical_system": "Ag-Er-Ge",
"density": 9.507407804036056,
"density_atomic": 0.049390754572380936,
"volume": 182.2203381568249,
"volume_molar": 12.19285028572443,
"formula_full": "Er3 Ag3 Ge3",
"formula_reduced": "ErAgGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3436544033333332,
"spacegroup": 189
},
{
"id": "jvasp-85665",
"created_at": "2022-09-04T14:35:45.848452Z",
"updated_at": "2022-09-04T14:35:45.848488Z",
"structure_string": "Ba2 Mg1 H6\n1.0\n5.717813 0.000016 0.000046\n-2.858894 4.951832 0.000009\n0.000035 0.000029 4.529616\nBa Mg H\n2 1 6\ndirect\n0.666667 0.333333 0.267215 Ba\n0.333335 0.666668 0.732787 Ba\n0.000000 0.000000 0.000000 Mg\n0.829307 0.658612 0.773261 H\n0.829307 0.170695 0.773260 H\n0.341389 0.170694 0.773258 H\n0.170695 0.341389 0.226741 H\n0.170695 0.829306 0.226742 H\n0.658613 0.829306 0.226744 H\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"H"
],
"chemical_system": "Ba-H-Mg",
"density": 3.9491211225874094,
"density_atomic": 0.0701753475204877,
"volume": 128.25016644730474,
"volume_molar": 8.581561720434426,
"formula_full": "Ba2 Mg1 H6",
"formula_reduced": "Ba2MgH6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.7910056655555555,
"spacegroup": 164
},
{
"id": "jvasp-93268",
"created_at": "2022-09-04T14:35:45.847174Z",
"updated_at": "2022-09-04T14:35:45.847194Z",
"structure_string": "Mn1 In1 F3\n1.0\n-0.005325 -4.258756 -0.047264\n-4.258852 0.005222 -0.021316\n0.021333 0.045976 -4.259034\nMn In F\n1 1 3\ndirect\n0.489208 0.499193 0.496341 Mn\n0.994025 0.996027 0.989690 In\n0.484409 0.000011 0.502998 F\n0.987970 0.502366 0.502939 F\n0.484390 0.502395 0.998030 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"In",
"F"
],
"chemical_system": "F-In-Mn",
"density": 4.873587901335514,
"density_atomic": 0.06471724359362817,
"volume": 77.25916189193636,
"volume_molar": 9.305310958257373,
"formula_full": "Mn1 In1 F3",
"formula_reduced": "MnInF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.268789611775862,
"spacegroup": 221
},
{
"id": "jvasp-91834",
"created_at": "2022-09-04T14:35:45.846977Z",
"updated_at": "2022-09-04T14:35:45.847001Z",
"structure_string": "Rb1 Mg6 Mo1\n1.0\n6.461058 -0.000126 0.000000\n-3.230638 5.595376 0.000000\n0.000000 0.000000 5.127954\nRb Mg Mo\n1 6 1\ndirect\n0.083343 0.416657 0.250000 Rb\n0.117630 0.933795 0.250000 Mg\n0.566206 0.382370 0.250000 Mg\n0.566204 0.933797 0.250000 Mg\n0.435484 0.592776 0.749999 Mg\n0.907224 0.064515 0.749999 Mg\n0.907246 0.592754 0.749999 Mg\n0.416662 0.083337 0.749999 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo-Rb",
"density": 2.9311660084765596,
"density_atomic": 0.04315368041240544,
"volume": 185.38395621292662,
"volume_molar": 13.95510348699901,
"formula_full": "Rb1 Mg6 Mo1",
"formula_reduced": "RbMg6Mo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0434687749999999,
"spacegroup": 187
},
{
"id": "jvasp-91884",
"created_at": "2022-09-04T14:35:45.842021Z",
"updated_at": "2022-09-04T14:35:45.842041Z",
"structure_string": "K1 Mg7\n1.0\n6.822339 0.000000 -0.000000\n-3.411169 5.908317 0.000000\n0.000000 -0.000000 5.299386\nK Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 K\n0.173384 0.836692 0.250000 Mg\n0.663308 0.326616 0.250000 Mg\n0.663308 0.836692 0.250000 Mg\n0.345137 0.154864 0.750001 Mg\n0.345137 0.690274 0.750001 Mg\n0.809726 0.154864 0.750001 Mg\n0.833333 0.666667 0.750001 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Mg"
],
"chemical_system": "K-Mg",
"density": 1.626511971029099,
"density_atomic": 0.03745133892452969,
"volume": 213.61052047087693,
"volume_molar": 16.07990777615603,
"formula_full": "K1 Mg7",
"formula_reduced": "KMg7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-15783",
"created_at": "2022-09-04T14:35:45.835339Z",
"updated_at": "2022-09-04T14:35:45.835359Z",
"structure_string": "Ca2 Ga2 N2\n1.0\n3.580103 0.000000 0.000000\n0.000000 3.580103 -0.000000\n0.000000 0.000000 7.527258\nCa Ga N\n2 2 2\ndirect\n0.000000 0.500000 0.648585 Ca\n0.500000 0.000000 0.351415 Ca\n0.500000 0.000000 0.918819 Ga\n0.000000 0.500000 0.081181 Ga\n0.500000 0.000000 0.671164 N\n0.000000 0.500000 0.328837 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"N"
],
"chemical_system": "Ca-Ga-N",
"density": 4.261857297389975,
"density_atomic": 0.06219040791352652,
"volume": 96.47790071328652,
"volume_molar": 9.683391638745263,
"formula_full": "Ca2 Ga2 N2",
"formula_reduced": "CaGaN",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9688953316666662,
"spacegroup": 129
},
{
"id": "jvasp-89494",
"created_at": "2022-09-04T14:35:45.835212Z",
"updated_at": "2022-09-04T14:35:45.835238Z",
"structure_string": "Tm6 Mn6 O18\n1.0\n6.077632 0.000000 0.000000\n-3.038817 5.263384 0.000000\n0.000000 0.000000 11.415452\nTm Mn O\n6 6 18\ndirect\n0.666666 0.333333 0.727558 Tm\n0.000000 0.000000 0.773282 Tm\n0.333332 0.666667 0.227558 Tm\n0.666666 0.333333 0.227558 Tm\n0.000000 0.000000 0.273282 Tm\n0.333332 0.666667 0.727558 Tm\n0.333502 0.333503 0.497198 Mn\n0.666497 -0.000000 0.497198 Mn\n0.333503 -0.000000 0.997198 Mn\n-0.000000 0.333503 0.997198 Mn\n0.666496 0.666497 0.997198 Mn\n-0.000001 0.666497 0.497198 Mn\n0.304821 0.304821 0.661983 O\n0.638631 -0.000000 0.332772 O\n-0.000001 0.695178 0.661983 O\n0.333332 0.666667 0.017925 O\n0.304822 -0.000000 0.161983 O\n0.000000 0.000000 0.972890 O\n0.695177 0.695178 0.161983 O\n-0.000001 0.638631 0.332772 O\n0.361368 -0.000000 0.832772 O\n-0.000000 0.304821 0.161983 O\n0.333332 0.666667 0.517924 O\n-0.000000 0.361368 0.832772 O\n0.695178 -0.000000 0.661983 O\n0.000000 0.000000 0.472890 O\n0.638631 0.638631 0.832772 O\n0.666666 0.333333 0.517924 O\n0.361368 0.361368 0.332772 O\n0.666666 0.333333 0.017925 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Tm",
"Mn",
"O"
],
"chemical_system": "Mn-O-Tm",
"density": 7.41770903200749,
"density_atomic": 0.08215399485558227,
"volume": 365.16787835742764,
"volume_molar": 7.330307881663289,
"formula_full": "Tm6 Mn6 O18",
"formula_reduced": "TmMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.148274398275862,
"spacegroup": 185
},
{
"id": "jvasp-86315",
"created_at": "2022-09-04T14:35:45.833561Z",
"updated_at": "2022-09-04T14:35:45.833587Z",
"structure_string": "La1 Pd3\n1.0\n4.230231 0.000000 0.000000\n0.000000 4.230231 -0.000000\n0.000000 0.000000 4.230231\nLa Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Pd"
],
"chemical_system": "La-Pd",
"density": 10.050304083923637,
"density_atomic": 0.05284060005229719,
"volume": 75.6993674568634,
"volume_molar": 11.396806156704868,
"formula_full": "La1 Pd3",
"formula_reduced": "LaPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5073130250000002,
"spacegroup": 221
},
{
"id": "jvasp-71969",
"created_at": "2022-09-04T14:35:45.832143Z",
"updated_at": "2022-09-04T14:35:45.832161Z",
"structure_string": "Na2 Ta1 Be1\n1.0\n-1.838226 1.838226 5.405770\n1.838226 -1.838226 5.405770\n1.838226 1.838226 -5.405770\nNa Ta Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.250000 0.750001 0.500001 Ta\n0.750001 0.250000 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ta",
"Be"
],
"chemical_system": "Be-Na-Ta",
"density": 5.362095853135898,
"density_atomic": 0.054745021065921655,
"volume": 73.06600531185052,
"volume_molar": 11.000344218971787,
"formula_full": "Na2 Ta1 Be1",
"formula_reduced": "Na2TaBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.011195825,
"spacegroup": 139
},
{
"id": "jvasp-93497",
"created_at": "2022-09-04T14:35:45.828490Z",
"updated_at": "2022-09-04T14:35:45.828513Z",
"structure_string": "La1 B2 Pt2 C1\n1.0\n3.698321 -0.000000 -1.256805\n-0.427102 3.673576 -1.256805\n-0.006443 -0.007236 6.050848\nLa B Pt C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 La\n0.362644 0.362643 0.725288 B\n0.637357 0.637357 0.274711 B\n0.250001 0.750000 0.500000 Pt\n0.750000 0.250000 0.499999 Pt\n0.500000 0.500001 -0.000001 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"B",
"Pt",
"C"
],
"chemical_system": "B-C-La-Pt",
"density": 11.37565463826699,
"density_atomic": 0.07304607322055648,
"volume": 82.13993902017846,
"volume_molar": 8.24430457995552,
"formula_full": "La1 B2 Pt2 C1",
"formula_reduced": "LaB2Pt2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.977075494444444,
"spacegroup": 139
},
{
"id": "jvasp-85378",
"created_at": "2022-09-04T14:35:45.825659Z",
"updated_at": "2022-09-04T14:35:45.825675Z",
"structure_string": "Eu4 Br2 O4\n1.0\n3.968206 -0.000000 0.965087\n1.667052 6.190878 1.786180\n0.128485 0.464092 8.112391\nEu Br O\n4 2 4\ndirect\n0.654638 0.245175 0.445551 Eu\n0.963428 0.263703 0.809445 Eu\n0.036574 0.736297 0.190555 Eu\n0.345364 0.754825 0.554449 Eu\n0.297074 0.269555 0.136297 Br\n0.702928 0.730445 0.863703 Br\n0.847272 0.885267 0.420192 O\n0.152730 0.114733 0.579808 O\n0.466396 0.372284 0.694926 O\n0.533605 0.627716 0.305074 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Eu",
"Br",
"O"
],
"chemical_system": "Br-Eu-O",
"density": 7.046525484757755,
"density_atomic": 0.05102456137544781,
"volume": 195.98404631875655,
"volume_molar": 11.802435136459119,
"formula_full": "Eu4 Br2 O4",
"formula_reduced": "Eu2BrO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.0452742209999994,
"spacegroup": 12
}
]
}