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=-nelements&page=507",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=505",
"results": [
{
"id": "jvasp-106452",
"created_at": "2022-09-04T14:36:30.894401Z",
"updated_at": "2022-09-04T14:36:30.894420Z",
"structure_string": "Rb2 Ag1 Bi1 F6\n1.0\n5.687352 -0.000000 3.283594\n1.895784 5.362086 3.283594\n-0.000000 -0.000000 6.567188\nRb Ag Bi F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.756804 0.243196 0.243195 F\n0.243195 0.243196 0.756804 F\n0.243195 0.756805 0.756804 F\n0.243195 0.756805 0.243195 F\n0.756804 0.243196 0.756804 F\n0.756803 0.756805 0.243195 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Bi",
"F"
],
"chemical_system": "Ag-Bi-F-Rb",
"density": 4.9895299246093465,
"density_atomic": 0.04993173620808216,
"volume": 200.273428472959,
"volume_molar": 12.060747767519512,
"formula_full": "Rb2 Ag1 Bi1 F6",
"formula_reduced": "Rb2AgBiF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-42268",
"created_at": "2022-09-04T14:36:18.426890Z",
"updated_at": "2022-09-04T14:36:18.426904Z",
"structure_string": "Li4 Mn4 Si4 O16\n1.0\n4.778685 0.000000 0.000000\n0.000000 6.201839 0.000000\n0.000000 0.000000 9.991484\nLi Mn Si O\n4 4 4 16\ndirect\n0.056126 0.006586 0.219081 Li\n0.443873 0.006586 0.719081 Li\n0.556126 0.506586 0.280919 Li\n0.943873 0.506586 0.780919 Li\n0.000002 0.256522 0.499996 Mn\n0.499997 0.256522 -0.000004 Mn\n0.500002 0.756522 0.000004 Mn\n-0.000002 0.756522 0.500004 Mn\n0.906305 0.006521 0.905884 Si\n0.593694 0.006521 0.405884 Si\n0.406305 0.506521 0.594115 Si\n0.093694 0.506521 0.094116 Si\n0.754978 0.229428 0.850288 O\n0.742905 0.506520 0.594594 O\n0.757094 0.506520 0.094594 O\n0.745021 0.229428 0.350288 O\n0.745004 0.783600 0.350304 O\n0.759655 0.006526 0.558870 O\n0.240344 0.506526 0.441129 O\n0.245004 0.283599 0.149696 O\n0.254978 0.729428 0.649711 O\n0.242905 0.006519 0.905406 O\n0.257094 0.006519 0.405406 O\n0.245021 0.729428 0.149712 O\n0.754995 0.783600 0.850304 O\n0.259655 0.506526 0.941129 O\n0.254995 0.283599 0.649696 O\n0.740344 0.006526 0.058871 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.453537316811955,
"density_atomic": 0.0945581882758199,
"volume": 296.11396443347536,
"volume_molar": 6.368714195785794,
"formula_full": "Li4 Mn4 Si4 O16",
"formula_reduced": "LiMnSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.5528185487684727,
"spacegroup": 62
},
{
"id": "jvasp-49954",
"created_at": "2022-09-04T14:36:08.903784Z",
"updated_at": "2022-09-04T14:36:08.903804Z",
"structure_string": "Ca2 As2 H10 O12\n1.0\n6.219237 -0.000000 0.039075\n-3.109618 8.637894 -0.019538\n-2.706029 0.000000 5.291554\nCa As H O\n2 2 10 12\ndirect\n0.224396 0.684516 0.222449 Ca\n0.539880 0.315483 0.722449 Ca\n0.509321 0.624744 0.909596 As\n0.884577 0.375255 0.409596 As\n0.923902 0.868399 0.230212 H\n0.237039 0.284184 0.221050 H\n0.702252 0.650996 0.323257 H\n0.221440 0.787363 0.710293 H\n0.051254 0.349003 0.823258 H\n0.055503 0.131601 0.730212 H\n0.434078 0.212636 0.210293 H\n0.173130 0.009525 0.266395 H\n-0.047145 0.715815 0.721050 H\n0.163604 -0.009525 0.766394 H\n0.896680 0.266170 0.697393 O\n0.775451 0.509605 0.460753 O\n0.323594 0.205069 0.297907 O\n0.630510 0.733830 0.197393 O\n0.437374 0.748530 0.663487 O\n0.188764 0.439878 0.438651 O\n0.265847 0.490395 0.960753 O\n0.097062 0.895331 0.243409 O\n0.118524 0.794930 0.797906 O\n0.748885 0.560121 0.938650 O\n0.201731 0.104668 0.743408 O\n0.688845 0.251470 0.163487 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Ca",
"As",
"H",
"O"
],
"chemical_system": "As-Ca-H-O",
"density": 2.5158413761525047,
"density_atomic": 0.09117000649862846,
"volume": 285.1815086839019,
"volume_molar": 6.6053968747831515,
"formula_full": "Ca2 As2 H10 O12",
"formula_reduced": "CaAsH5O6",
"formula_anonymous": "ABC5D6",
"energy_above_hull": 2.649421782307692,
"spacegroup": 9
},
{
"id": "jvasp-100274",
"created_at": "2022-09-04T14:36:37.343584Z",
"updated_at": "2022-09-04T14:36:37.343604Z",
"structure_string": "Ba2 Mg1 Mo1 O6\n1.0\n4.990867 -0.000000 2.881479\n1.663623 4.705436 2.881479\n-0.000000 0.000000 5.762958\nBa Mg Mo O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750001 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mo\n0.761456 0.238545 0.238545 O\n0.238544 0.761456 0.761456 O\n0.238544 0.761456 0.238545 O\n0.761456 0.238545 0.761456 O\n0.238544 0.238545 0.761456 O\n0.761455 0.761456 0.238545 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Mg",
"Mo",
"O"
],
"chemical_system": "Ba-Mg-Mo-O",
"density": 6.023053738290178,
"density_atomic": 0.07388881099631892,
"volume": 135.33848853648752,
"volume_molar": 8.150274282123744,
"formula_full": "Ba2 Mg1 Mo1 O6",
"formula_reduced": "Ba2MgMoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.999057789,
"spacegroup": 225
},
{
"id": "jvasp-85389",
"created_at": "2022-09-04T14:36:12.485486Z",
"updated_at": "2022-09-04T14:36:12.485499Z",
"structure_string": "Cd1 Pd1 C6 N6\n1.0\n6.746639 0.000015 3.895170\n2.248887 6.360804 3.895182\n-0.000006 0.000010 7.790352\nCd Pd C N\n1 1 6 6\ndirect\n0.000000 0.000000 0.000000 Cd\n0.499998 0.499999 0.499999 Pd\n0.317459 0.682542 0.317457 C\n0.317457 0.682542 0.682543 C\n0.682544 0.317456 0.317457 C\n0.317457 0.317458 0.682543 C\n0.682544 0.682542 0.317457 C\n0.682545 0.317456 0.682544 C\n0.787822 0.787819 0.212178 N\n0.787820 0.212180 0.787820 N\n0.212179 0.787821 0.787821 N\n0.787820 0.212180 0.212181 N\n0.212179 0.787819 0.212179 N\n0.212179 0.212178 0.787821 N\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cd",
"Pd",
"C",
"N"
],
"chemical_system": "C-Cd-N-Pd",
"density": 1.8622987543384895,
"density_atomic": 0.041876641510896546,
"volume": 334.3152529640448,
"volume_molar": 14.380667939746322,
"formula_full": "Cd1 Pd1 C6 N6",
"formula_reduced": "CdPd(CN)6",
"formula_anonymous": "ABC6D6",
"energy_above_hull": 5.940072496428571,
"spacegroup": 225
},
{
"id": "jvasp-91495",
"created_at": "2022-09-04T14:36:18.488686Z",
"updated_at": "2022-09-04T14:36:18.488721Z",
"structure_string": "Na8 Li12 Fe4 O16\n1.0\n6.554113 0.000000 0.000000\n0.000000 7.941422 -0.000000\n0.000000 -0.000000 8.270408\nNa Li Fe O\n8 12 4 16\ndirect\n0.758230 0.000000 0.500000 Na\n0.000000 0.256464 0.750227 Na\n0.000000 0.743535 0.249773 Na\n0.500000 0.756464 0.749773 Na\n0.500000 0.243536 0.250227 Na\n0.741769 0.500000 0.000000 Na\n0.258230 0.500000 0.000000 Na\n0.241769 0.000000 0.500000 Na\n0.756136 0.511989 0.647672 Li\n0.743863 0.988010 0.147672 Li\n0.743863 0.011989 0.852328 Li\n0.243863 0.511989 0.647672 Li\n0.243863 0.488010 0.352328 Li\n0.500000 0.232877 0.911563 Li\n0.756136 0.488010 0.352328 Li\n0.256137 0.988010 0.147672 Li\n0.000000 0.267122 0.411563 Li\n0.000000 0.732877 0.588437 Li\n0.256137 0.011989 0.852328 Li\n0.500000 0.767122 0.088437 Li\n0.000000 0.773101 0.878924 Fe\n0.000000 0.226899 0.121077 Fe\n0.500000 0.273101 0.621077 Fe\n0.500000 0.726899 0.378923 Fe\n0.246477 0.804501 0.991493 O\n0.000000 0.558380 0.775532 O\n0.000000 0.441620 0.224469 O\n0.500000 0.058380 0.724469 O\n0.500000 0.941620 0.275531 O\n0.246477 0.195498 0.008508 O\n0.753522 0.804501 0.991493 O\n0.746477 0.304502 0.508508 O\n0.500000 0.547912 0.222892 O\n0.500000 0.452088 0.777108 O\n0.000000 0.047912 0.277108 O\n0.000000 0.952088 0.722892 O\n0.253523 0.304502 0.508508 O\n0.253523 0.695498 0.491493 O\n0.753522 0.195498 0.008508 O\n0.746477 0.695498 0.491493 O\n",
"nsites": 40,
"nelements": 4,
"elements": [
"Na",
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Na-O",
"density": 2.8799612012264055,
"density_atomic": 0.09292249386684295,
"volume": 430.46627716771803,
"volume_molar": 6.480821283842929,
"formula_full": "Na8 Li12 Fe4 O16",
"formula_reduced": "Na2Li3FeO4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.4639927499999998,
"spacegroup": 58
},
{
"id": "jvasp-58362",
"created_at": "2022-09-04T14:36:39.261664Z",
"updated_at": "2022-09-04T14:36:39.261689Z",
"structure_string": "Nd1 Al3 B4 O12\n1.0\n5.773030 -0.003831 -1.467945\n-1.887029 5.455916 -1.467945\n-0.002730 -0.003831 5.956739\nNd Al B O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.556147 0.443854 Al\n0.443854 0.000000 0.556146 Al\n0.556146 0.443854 -0.000001 Al\n0.058501 0.500001 0.941499 B\n0.500000 0.500001 0.499999 B\n0.941499 0.058501 0.499999 B\n0.500000 0.941500 0.058500 B\n0.774153 0.027788 0.620819 O\n0.620819 0.774154 0.027786 O\n0.027788 0.620820 0.774153 O\n0.351603 0.648398 0.499999 O\n0.648397 0.500001 0.351602 O\n0.089938 0.910063 0.499999 O\n0.500000 0.089938 0.910062 O\n0.910062 0.500001 0.089937 O\n0.972213 0.225848 0.379180 O\n0.379181 0.972213 0.225846 O\n0.225847 0.379181 0.972212 O\n0.500000 0.351604 0.648396 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Nd",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Nd-O",
"density": 4.07733646067368,
"density_atomic": 0.10665962354620344,
"volume": 187.51238130271744,
"volume_molar": 5.646129772238784,
"formula_full": "Nd1 Al3 B4 O12",
"formula_reduced": "NdAl3(BO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 3.2317641116666667,
"spacegroup": 155
},
{
"id": "jvasp-103371",
"created_at": "2022-09-04T14:36:36.762353Z",
"updated_at": "2022-09-04T14:36:36.762378Z",
"structure_string": "Ba2 Tb1 Ta1 O6\n1.0\n5.224975 -0.000000 3.016641\n1.741659 4.926153 3.016641\n-0.000000 -0.000000 6.033281\nTb Ba Ta O\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 Tb\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Ta\n0.764527 0.235472 0.235473 O\n0.235473 0.764527 0.764527 O\n0.235473 0.764527 0.235472 O\n0.764527 0.235472 0.764528 O\n0.235472 0.235472 0.764527 O\n0.764527 0.764527 0.235473 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tb",
"Ba",
"Ta",
"O"
],
"chemical_system": "Ba-O-Ta-Tb",
"density": 7.597696781060093,
"density_atomic": 0.0643953241683947,
"volume": 155.29077816038097,
"volume_molar": 9.35182924811748,
"formula_full": "Ba2 Tb1 Ta1 O6",
"formula_reduced": "Ba2TbTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.307333054,
"spacegroup": 225
},
{
"id": "jvasp-97724",
"created_at": "2022-09-04T14:36:17.635274Z",
"updated_at": "2022-09-04T14:36:17.635294Z",
"structure_string": "K2 Eu2 P8 O24\n1.0\n7.251574 0.002924 0.000000\n-0.279939 7.989213 0.000000\n0.000000 0.000000 8.395713\nK Eu P O\n2 2 8 24\ndirect\n0.274581 0.722440 0.552857 K\n0.725418 0.277559 0.052857 K\n0.766424 0.756776 0.747731 Eu\n0.233575 0.243223 0.247732 Eu\n0.003663 0.379872 0.600598 P\n0.996336 0.620127 0.100599 P\n0.897550 0.899404 0.329864 P\n0.622740 0.402160 0.489278 P\n0.377259 0.597839 0.989278 P\n0.439419 0.102496 0.626252 P\n0.560580 0.897503 0.126252 P\n0.102449 0.100595 0.829864 P\n0.457605 0.715910 0.132407 O\n0.040611 0.922223 0.801328 O\n0.959388 0.077776 0.301328 O\n0.682507 0.874938 0.285194 O\n0.921804 0.823401 0.490789 O\n0.422831 0.029888 0.154630 O\n0.176759 0.388772 0.502758 O\n0.969610 0.526913 0.706134 O\n0.542394 0.284089 0.632407 O\n0.030389 0.473086 0.206134 O\n0.078196 0.176598 0.990788 O\n0.317830 0.073583 0.483697 O\n0.682169 0.926417 0.983697 O\n0.613814 0.580044 0.542697 O\n0.823240 0.611227 0.002758 O\n0.386185 0.419955 0.042697 O\n0.833112 0.346054 0.482154 O\n0.990467 0.208687 0.701254 O\n0.463181 0.649982 0.834375 O\n0.536818 0.350017 0.334376 O\n0.317492 0.125061 0.785193 O\n0.577168 0.970111 0.654630 O\n0.166887 0.653945 0.982153 O\n0.009533 0.791312 0.201254 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"K",
"Eu",
"P",
"O"
],
"chemical_system": "Eu-K-O-P",
"density": 3.461340659303689,
"density_atomic": 0.07401206087923795,
"volume": 486.4072094781894,
"volume_molar": 8.136701894879064,
"formula_full": "K2 Eu2 P8 O24",
"formula_reduced": "KEu(PO3)4",
"formula_anonymous": "ABC4D12",
"energy_above_hull": 2.743180666666667,
"spacegroup": 4
},
{
"id": "jvasp-97032",
"created_at": "2022-09-04T14:36:36.365544Z",
"updated_at": "2022-09-04T14:36:36.365565Z",
"structure_string": "La2 Fe2 P2 O2\n1.0\n3.938188 0.000000 -0.000000\n0.000000 3.938188 -0.000000\n-0.000000 0.000000 8.457737\nLa Fe P O\n2 2 2 2\ndirect\n0.250000 0.250000 0.152165 La\n0.750000 0.750000 0.847835 La\n0.750000 0.250000 0.500000 Fe\n0.250000 0.750000 0.500000 Fe\n0.250000 0.250000 0.625513 P\n0.750000 0.750000 0.374488 P\n0.750000 0.250000 0.000000 O\n0.250000 0.750000 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-La-O-P",
"density": 6.119996008502287,
"density_atomic": 0.060987793575061615,
"volume": 131.1737895576413,
"volume_molar": 9.874337809234177,
"formula_full": "La2 Fe2 P2 O2",
"formula_reduced": "LaFePO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.146824875,
"spacegroup": 129
},
{
"id": "jvasp-48811",
"created_at": "2022-09-04T14:36:18.616453Z",
"updated_at": "2022-09-04T14:36:18.616480Z",
"structure_string": "Li3 Cr1 Co3 O8\n1.0\n5.672886 -0.001441 -0.038822\n2.835196 4.913585 -0.038822\n2.803557 1.618635 4.698699\nLi Cr Co O\n3 1 3 8\ndirect\n0.000001 0.499999 0.500000 Li\n0.500001 -0.000001 0.500000 Li\n0.500001 0.499999 0.500001 Li\n0.000000 0.000000 0.000000 Cr\n0.000001 0.499999 0.000000 Co\n0.500000 -0.000000 0.000000 Co\n0.500001 0.499999 0.000000 Co\n0.267176 0.267175 0.208626 O\n0.267130 0.757766 0.216008 O\n0.241893 0.241891 0.776081 O\n0.242234 0.732870 0.783993 O\n0.757768 0.267128 0.216008 O\n0.758109 0.758107 0.223920 O\n0.732872 0.242232 0.783993 O\n0.732826 0.732823 0.791375 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Co",
"O"
],
"chemical_system": "Co-Cr-Li-O",
"density": 4.760963748605988,
"density_atomic": 0.11389091475252823,
"volume": 131.7049742957396,
"volume_molar": 5.287639293340839,
"formula_full": "Li3 Cr1 Co3 O8",
"formula_reduced": "Li3CrCo3O8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 2.8668912066666667,
"spacegroup": 12
},
{
"id": "jvasp-103855",
"created_at": "2022-09-04T14:36:37.772519Z",
"updated_at": "2022-09-04T14:36:37.772547Z",
"structure_string": "H10 C14 N2 O4\n1.0\n3.542320 -0.090350 0.292810\n-0.139170 7.615961 3.000743\n-0.193452 -0.082865 10.284317\nH C N O\n10 14 2 4\ndirect\n0.683043 0.763915 0.633073 H\n0.730008 0.088810 0.978238 H\n0.248617 0.702506 0.810716 H\n0.248611 0.202508 0.310714 H\n0.307818 0.525765 0.656080 H\n0.730013 0.588810 0.478238 H\n0.959401 0.556271 0.293192 H\n0.959382 0.056273 0.793190 H\n0.683046 0.263913 0.133074 H\n0.307823 0.025765 0.156080 H\n0.069908 0.211626 0.593599 C\n0.846574 0.222500 0.942562 C\n0.846578 0.722500 0.442562 C\n0.817850 0.318879 0.028037 C\n0.817849 0.818881 0.528036 C\n0.069917 0.711623 0.093601 C\n0.027427 0.296149 0.808171 C\n0.965490 0.990353 0.481021 C\n0.965496 0.490351 0.981023 C\n0.171820 0.468424 0.760674 C\n0.171823 0.968424 0.260674 C\n0.138531 0.567948 0.847018 C\n0.138528 0.067949 0.347017 C\n0.027433 0.796149 0.308171 C\n0.045212 0.181540 0.733392 N\n0.045225 0.681538 0.233394 N\n0.199353 0.341056 0.496278 O\n0.905793 0.063295 0.583667 O\n0.905808 0.563291 0.083670 O\n0.199355 0.841054 0.996278 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.6101873988692001,
"density_atomic": 0.10764618109355588,
"volume": 278.690796972415,
"volume_molar": 5.59438402628155,
"formula_full": "H10 C14 N2 O4",
"formula_reduced": "H5C7NO2",
"formula_anonymous": "AB2C5D7",
"energy_above_hull": 5.37410935,
"spacegroup": 1
}
]
}