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=613",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=611",
"results": [
{
"id": "jvasp-121316",
"created_at": "2022-09-04T14:38:50.141975Z",
"updated_at": "2022-09-04T14:38:50.142002Z",
"structure_string": "Li7 Mn4 Co1 O12\n1.0\n4.888965 -0.106016 0.427162\n0.798979 4.733614 1.428726\n0.075873 0.134440 8.579456\nLi Mn Co O\n7 4 1 12\ndirect\n0.247131 0.413390 0.080559 Li\n0.752647 0.581809 0.904819 Li\n0.244034 0.750164 0.744144 Li\n0.242949 0.088324 0.425469 Li\n0.751794 0.250034 0.253170 Li\n0.760404 0.920184 0.589094 Li\n0.000356 0.333365 0.667314 Li\n-0.000054 0.005353 0.992089 Mn\n0.500274 0.495298 0.506845 Mn\n0.000012 0.665064 0.336905 Mn\n0.499990 0.830848 0.168749 Mn\n0.499958 0.166636 0.831629 Co\n0.128752 0.022316 0.202135 O\n0.630165 0.183449 0.038322 O\n0.132760 0.343949 0.881660 O\n0.137963 0.703291 0.527140 O\n0.626207 0.856035 0.371226 O\n0.607416 0.523479 0.704568 O\n0.369732 0.811700 0.964793 O\n0.868018 0.963490 0.805321 O\n0.392629 0.145573 0.627355 O\n0.373942 0.476561 0.296327 O\n0.870721 0.646402 0.128809 O\n0.862186 0.323266 0.451571 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.350049447454472,
"density_atomic": 0.12107853030390821,
"volume": 198.2184615204676,
"volume_molar": 4.973747818778748,
"formula_full": "Li7 Mn4 Co1 O12",
"formula_reduced": "Li7Mn4CoO12",
"formula_anonymous": "AB4C7D12",
"energy_above_hull": 2.786429661063218,
"spacegroup": 1
},
{
"id": "jvasp-122481",
"created_at": "2022-09-04T14:38:54.181859Z",
"updated_at": "2022-09-04T14:38:54.181889Z",
"structure_string": "Ho4 Fe2 Sb2 O14\n1.0\n6.243329 -0.008221 -3.511007\n-2.076540 5.818675 -3.624555\n0.010373 0.008221 7.162836\nHo Fe Sb O\n4 2 2 14\ndirect\n0.500000 0.000000 -0.000000 Ho\n0.500000 0.500000 0.499999 Ho\n0.500000 -0.000000 0.500000 Ho\n0.000000 0.000000 0.000000 Ho\n-0.000000 0.500000 -0.000001 Fe\n-0.000000 -0.000000 0.500000 Fe\n-0.000000 0.499999 0.499999 Sb\n0.500000 0.500000 -0.000001 Sb\n0.669575 0.415985 0.831557 O\n0.084428 0.838017 0.668441 O\n0.669576 0.838018 0.253589 O\n0.084429 0.415985 0.246409 O\n0.661580 0.411584 0.249999 O\n0.078001 0.828001 0.249999 O\n0.915571 0.584014 0.753590 O\n0.915571 0.161982 0.331557 O\n0.330424 0.161982 0.746410 O\n0.625265 0.875265 0.749999 O\n0.338420 0.588415 0.749999 O\n0.921998 0.171999 0.750000 O\n0.330424 0.584014 0.168442 O\n0.374734 0.124734 0.250000 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Ho",
"Fe",
"Sb",
"O"
],
"chemical_system": "Fe-Ho-O-Sb",
"density": 7.896011157030883,
"density_atomic": 0.08443782991765124,
"volume": 260.5467243942164,
"volume_molar": 7.132041131176805,
"formula_full": "Ho4 Fe2 Sb2 O14",
"formula_reduced": "Ho2FeSbO7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.482497021212121,
"spacegroup": 74
},
{
"id": "jvasp-119481",
"created_at": "2022-09-04T14:38:50.680559Z",
"updated_at": "2022-09-04T14:38:50.680570Z",
"structure_string": "Sr4 Fe1 Mo1 O8\n1.0\n6.972037 -0.102758 0.000000\n-4.816454 5.041987 0.000000\n-0.000000 -0.000000 5.379414\nSr Fe Mo O\n4 1 1 8\ndirect\n0.351085 0.648916 -0.000000 Sr\n0.854067 0.145933 0.500000 Sr\n0.145935 0.854067 0.500000 Sr\n0.648917 0.351084 -0.000000 Sr\n0.000000 0.000000 0.000000 Fe\n0.500001 0.500000 0.500000 Mo\n0.160921 0.839081 -0.000000 O\n0.659486 0.340514 0.500000 O\n0.340515 0.659486 0.500000 O\n0.839080 0.160920 -0.000000 O\n0.248354 0.248354 0.248606 O\n0.751647 0.751646 0.751393 O\n0.248354 0.248354 0.751393 O\n0.751647 0.751646 0.248606 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sr",
"Fe",
"Mo",
"O"
],
"chemical_system": "Fe-Mo-O-Sr",
"density": 5.61345997237106,
"density_atomic": 0.0750913107987735,
"volume": 186.43968058456997,
"volume_molar": 8.019757140926568,
"formula_full": "Sr4 Fe1 Mo1 O8",
"formula_reduced": "Sr4FeMoO8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.140966045714286,
"spacegroup": 65
},
{
"id": "jvasp-119486",
"created_at": "2022-09-04T14:38:49.876700Z",
"updated_at": "2022-09-04T14:38:49.876734Z",
"structure_string": "Sm4 U4 Se6 O8\n1.0\n3.978779 -0.000000 0.000000\n0.000000 7.046214 0.000000\n-0.000000 -0.000000 14.956055\nSm U Se O\n4 4 6 8\ndirect\n-0.000000 0.707429 0.152885 Sm\n-0.000000 0.292570 0.847115 Sm\n-0.000000 0.207429 0.347115 Sm\n-0.000000 0.792570 0.652885 Sm\n0.500000 0.792432 0.424134 U\n0.500000 0.207567 0.575866 U\n0.500000 0.292433 0.075866 U\n0.500000 0.707567 0.924134 U\n0.000000 0.000000 0.000000 Se\n-0.000000 0.500000 0.500000 Se\n0.500000 0.996886 0.777762 Se\n0.500000 0.003113 0.222238 Se\n0.500000 0.496887 0.722238 Se\n0.500000 0.503113 0.277762 Se\n-0.000000 0.887488 0.388861 O\n-0.000000 0.112511 0.611139 O\n-0.000000 0.387489 0.111139 O\n-0.000000 0.612511 0.888861 O\n0.500000 0.638015 0.067220 O\n0.500000 0.361985 0.932780 O\n0.500000 0.138015 0.432780 O\n0.500000 0.861985 0.567220 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sm",
"U",
"Se",
"O"
],
"chemical_system": "O-Se-Sm-U",
"density": 8.535644345006675,
"density_atomic": 0.0524686610073943,
"volume": 419.297911888767,
"volume_molar": 11.477595662582873,
"formula_full": "Sm4 U4 Se6 O8",
"formula_reduced": "Sm2U2Se3O4",
"formula_anonymous": "A2B2C3D4",
"energy_above_hull": 2.911084895454545,
"spacegroup": 55
},
{
"id": "jvasp-120727",
"created_at": "2022-09-04T14:38:53.619593Z",
"updated_at": "2022-09-04T14:38:53.619626Z",
"structure_string": "K1 La2 Ag3 Te8\n1.0\n4.459547 0.000000 0.000000\n0.000000 4.459547 0.000000\n0.000000 0.000000 21.383240\nK La Ag Te\n1 2 3 8\ndirect\n0.000000 0.000000 0.737237 K\n0.000000 0.000000 0.197999 La\n0.500000 0.500000 -0.002231 La\n-0.000000 0.500000 0.584207 Ag\n0.500000 0.000000 0.584207 Ag\n0.500000 0.500000 0.495586 Ag\n0.500000 0.500000 0.670292 Te\n0.500000 0.000000 0.319962 Te\n0.500000 0.000000 0.875577 Te\n-0.000000 0.500000 0.319962 Te\n0.000000 0.000000 0.039902 Te\n0.500000 0.500000 0.154317 Te\n-0.000000 0.500000 0.875577 Te\n0.000000 0.000000 0.487343 Te\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"La",
"Ag",
"Te"
],
"chemical_system": "Ag-K-La-Te",
"density": 6.487028102864186,
"density_atomic": 0.03292100119278719,
"volume": 425.2604566311708,
"volume_molar": 18.29270235353419,
"formula_full": "K1 La2 Ag3 Te8",
"formula_reduced": "KLa2Ag3Te8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 0.7666394223809525,
"spacegroup": 99
},
{
"id": "jvasp-117433",
"created_at": "2022-09-04T14:38:49.880863Z",
"updated_at": "2022-09-04T14:38:49.880885Z",
"structure_string": "Li3 Fe2 Ni1 O6\n1.0\n6.295700 -0.011370 1.453403\n5.664729 2.747146 1.453403\n-0.017642 -0.004035 5.728151\nLi Fe Ni O\n3 2 1 6\ndirect\n0.500000 0.500000 0.499999 Li\n0.165086 0.165086 0.157890 Li\n0.834915 0.834914 0.842109 Li\n0.169824 0.169822 0.661794 Fe\n0.830177 0.830178 0.338205 Fe\n0.499999 0.500001 -0.000000 Ni\n0.669956 0.669955 0.889378 O\n0.328252 0.328251 0.571363 O\n0.330044 0.330045 0.110621 O\n0.986372 0.986374 0.244638 O\n0.013629 0.013626 0.755361 O\n0.671748 0.671748 0.428636 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ni",
"O"
],
"chemical_system": "Fe-Li-Ni-O",
"density": 4.792457436362719,
"density_atomic": 0.12058734780326123,
"volume": 99.51292750528066,
"volume_molar": 4.994007140637298,
"formula_full": "Li3 Fe2 Ni1 O6",
"formula_reduced": "Li3Fe2NiO6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.344200366666666,
"spacegroup": 12
},
{
"id": "jvasp-122023",
"created_at": "2022-09-04T14:38:54.551016Z",
"updated_at": "2022-09-04T14:38:54.551044Z",
"structure_string": "Mn2 V2 P4 O16\n1.0\n4.779385 0.016395 -0.000008\n-0.245145 9.806703 0.000027\n0.000012 -0.000017 5.805997\nMn V P O\n2 2 4 16\ndirect\n0.929474 0.276598 0.250000 Mn\n0.070525 0.723402 0.750001 Mn\n0.436945 0.223515 0.750000 V\n0.563055 0.776484 0.250000 V\n0.396058 0.088063 0.250000 P\n0.603940 0.911937 0.750001 P\n0.876790 0.408207 0.750000 P\n0.123209 0.591791 0.250000 P\n0.717019 0.333424 0.545860 O\n0.717018 0.333424 0.954141 O\n0.743349 0.837480 0.961328 O\n0.743349 0.837481 0.538673 O\n0.256651 0.162518 0.461324 O\n0.256652 0.162518 0.038677 O\n0.831072 0.560948 0.750000 O\n0.287095 0.890689 0.750001 O\n0.811992 0.622202 0.250000 O\n0.188010 0.377797 0.750001 O\n0.282981 0.666574 0.045862 O\n0.712902 0.109310 0.250000 O\n0.321883 0.935559 0.250000 O\n0.678117 0.064441 0.750000 O\n0.168925 0.439051 0.250000 O\n0.282981 0.666574 0.454138 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Mn",
"V",
"P",
"O"
],
"chemical_system": "Mn-O-P-V",
"density": 3.609947378594757,
"density_atomic": 0.08818651008698761,
"volume": 272.1504680968357,
"volume_molar": 6.828868444912642,
"formula_full": "Mn2 V2 P4 O16",
"formula_reduced": "MnV(PO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.255017536781609,
"spacegroup": 11
},
{
"id": "jvasp-119719",
"created_at": "2022-09-04T14:38:53.614407Z",
"updated_at": "2022-09-04T14:38:53.614424Z",
"structure_string": "Li3 Fe2 Si2 O8\n1.0\n4.963404 -0.006880 0.019671\n0.070327 5.402446 0.067525\n0.001736 0.014903 6.176528\nLi Fe Si O\n3 2 2 8\ndirect\n0.511202 0.663008 0.252256 Li\n0.506998 0.668030 0.751249 Li\n-0.000846 0.331930 0.748808 Li\n0.008724 0.827671 0.007778 Fe\n0.499411 0.174662 0.490352 Fe\n0.492282 0.167431 0.995357 Si\n0.004771 0.836160 0.505105 Si\n0.614606 0.877682 0.999458 O\n0.163795 0.148813 0.980843 O\n0.579736 0.316506 0.212860 O\n0.121400 0.705235 0.285180 O\n0.116777 0.119705 0.520051 O\n0.670262 0.839113 0.501312 O\n0.102935 0.677728 0.725665 O\n0.602033 0.315390 0.774190 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.175117882015908,
"density_atomic": 0.09056960555840429,
"volume": 165.6184755086205,
"volume_molar": 6.649185146463502,
"formula_full": "Li3 Fe2 Si2 O8",
"formula_reduced": "Li3Fe2(SiO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.705966413333334,
"spacegroup": 1
},
{
"id": "jvasp-116848",
"created_at": "2022-09-04T14:38:50.747828Z",
"updated_at": "2022-09-04T14:38:50.747853Z",
"structure_string": "Li2 Mn1 Ni3 O8\n1.0\n4.958009 -0.008321 2.804324\n1.631790 4.681793 2.804324\n-0.011733 -0.008321 5.696134\nLi Mn Ni O\n2 1 3 8\ndirect\n0.123424 0.123424 0.123423 Li\n0.876577 0.876576 0.876574 Li\n0.500001 0.500000 0.499999 Mn\n0.500000 0.000000 0.499999 Ni\n0.000000 0.500000 0.499999 Ni\n0.500000 0.500000 -0.000001 Ni\n0.262546 0.262546 0.262545 O\n0.264809 0.264808 0.710047 O\n0.710049 0.264808 0.264807 O\n0.264809 0.710048 0.264807 O\n0.735193 0.289952 0.735190 O\n0.289952 0.735192 0.735190 O\n0.735192 0.735192 0.289950 O\n0.737455 0.737454 0.737452 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Ni",
"O"
],
"chemical_system": "Li-Mn-Ni-O",
"density": 4.672203858205343,
"density_atomic": 0.10563641243875083,
"volume": 132.53005925506375,
"volume_molar": 5.700819084036676,
"formula_full": "Li2 Mn1 Ni3 O8",
"formula_reduced": "Li2MnNi3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.3668951743842364,
"spacegroup": 166
},
{
"id": "jvasp-122012",
"created_at": "2022-09-04T14:38:53.603510Z",
"updated_at": "2022-09-04T14:38:53.603537Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n2.817996 0.071958 0.358569\n1.093191 7.385841 1.222430\n0.023921 -0.020669 11.102129\nLi Mn Co O\n8 2 4 14\ndirect\n0.776959 0.366577 0.079895 Li\n0.942999 0.779316 0.333701 Li\n0.068258 0.219114 0.644556 Li\n0.209015 0.634044 0.947834 Li\n0.357558 0.070259 0.214376 Li\n0.503516 0.498801 0.493556 Li\n0.640907 0.929352 0.789414 Li\n0.577011 0.702663 0.142983 Li\n0.000663 0.993420 0.005629 Mn\n0.286598 0.857431 0.569390 Mn\n0.713268 0.143858 0.429615 Co\n0.856889 0.572691 0.713546 Co\n0.141110 0.433443 0.284094 Co\n0.428131 0.287481 0.856404 Co\n0.884264 0.689363 0.542527 O\n0.403903 0.169075 0.022978 O\n0.545277 0.589560 0.319195 O\n0.686840 0.024617 0.601293 O\n0.833024 0.454650 0.878987 O\n0.962520 0.909590 0.165609 O\n0.117757 0.307218 0.456813 O\n0.259949 0.741976 0.737737 O\n0.179304 0.523519 0.117820 O\n0.311827 0.973672 0.403212 O\n0.452310 0.406973 0.688845 O\n0.598012 0.839445 0.965315 O\n0.736830 0.261097 0.265491 O\n0.025312 0.120795 0.829187 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.509338249570783,
"density_atomic": 0.12163329421183601,
"volume": 230.2001288498799,
"volume_molar": 4.951062781800406,
"formula_full": "Li8 Mn2 Co4 O14",
"formula_reduced": "Li4MnCo2O7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 2.5554138243842366,
"spacegroup": 8
},
{
"id": "jvasp-119289",
"created_at": "2022-09-04T14:38:50.110357Z",
"updated_at": "2022-09-04T14:38:50.110391Z",
"structure_string": "Na3 Mn3 Cr3 F18\n1.0\n9.044779 0.000000 0.000000\n-4.522390 7.833009 0.000000\n-0.000000 -0.000000 4.929299\nNa Mn Cr F\n3 3 3 18\ndirect\n0.367690 -0.000000 -0.000000 Na\n0.000000 0.367690 -0.000000 Na\n0.632310 0.632310 -0.000000 Na\n0.699712 -0.000000 0.500000 Mn\n0.300288 0.300288 0.500000 Mn\n0.000000 0.699712 0.500000 Mn\n0.666667 0.333333 0.502496 Cr\n0.000000 0.000000 0.000000 Cr\n0.333333 0.666667 0.497504 Cr\n0.901110 0.103292 0.774813 F\n0.538940 0.408862 0.717364 F\n0.103292 0.901110 0.225187 F\n0.098890 0.202182 0.225187 F\n0.797818 0.896708 0.225187 F\n0.202182 0.098890 0.774813 F\n0.896708 0.797818 0.774813 F\n0.130078 0.591139 0.282636 F\n0.226008 0.458954 0.710951 F\n0.408862 0.538940 0.282636 F\n0.232947 0.773993 0.710951 F\n0.591139 0.130078 0.717364 F\n0.541046 0.767053 0.710951 F\n0.458954 0.226008 0.289049 F\n0.767053 0.541046 0.289049 F\n0.773993 0.232947 0.289049 F\n0.461060 0.869923 0.282636 F\n0.869923 0.461060 0.717364 F\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Na",
"Mn",
"Cr",
"F"
],
"chemical_system": "Cr-F-Mn-Na",
"density": 3.4793324434202093,
"density_atomic": 0.0773129093730082,
"volume": 349.2301637458019,
"volume_molar": 7.789308161907658,
"formula_full": "Na3 Mn3 Cr3 F18",
"formula_reduced": "NaMnCrF6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 0.672101704042146,
"spacegroup": 150
},
{
"id": "jvasp-121348",
"created_at": "2022-09-04T14:38:54.588611Z",
"updated_at": "2022-09-04T14:38:54.588647Z",
"structure_string": "K1 Ba3 Bi4 O12\n1.0\n6.157646 -0.000000 0.000000\n0.000000 6.208003 0.000000\n-0.000000 -0.000000 8.699477\nK Ba Bi O\n1 3 4 12\ndirect\n0.500000 0.008616 0.500000 K\n-0.000000 0.495978 -0.000000 Ba\n0.500000 0.996179 -0.000000 Ba\n-0.000000 0.493366 0.500000 Ba\n-0.000000 0.998000 0.252200 Bi\n0.500000 0.500767 0.747936 Bi\n-0.000000 0.998000 0.747800 Bi\n0.500000 0.500767 0.252064 Bi\n0.752084 0.746370 0.788451 O\n0.242623 0.258626 0.273963 O\n0.242623 0.258626 0.726037 O\n0.752084 0.746370 0.211549 O\n0.247917 0.746370 0.788451 O\n0.500000 0.560257 0.500000 O\n0.500000 0.440253 -0.000000 O\n-0.000000 0.935321 0.500000 O\n0.247917 0.746370 0.211549 O\n-0.000000 0.052509 -0.000000 O\n0.757377 0.258626 0.273963 O\n0.757377 0.258626 0.726037 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Ba",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-K-O",
"density": 7.385087431229666,
"density_atomic": 0.06014094049371697,
"volume": 332.5521655599888,
"volume_molar": 10.013379755225383,
"formula_full": "K1 Ba3 Bi4 O12",
"formula_reduced": "KBa3(BiO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 1.8582117555,
"spacegroup": 25
}
]
}