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=4595",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4593",
"results": [
{
"id": "jvasp-52419",
"created_at": "2022-09-04T14:37:43.580921Z",
"updated_at": "2022-09-04T14:37:43.580947Z",
"structure_string": "Fe2 P2 H12 N2 O10\n1.0\n4.780007 0.000000 0.000000\n0.000000 5.684895 0.000000\n0.000000 0.000000 8.871192\nFe P H N O\n2 2 12 2 10\ndirect\n0.509689 0.500000 0.023568 Fe\n0.009689 0.000000 0.976432 Fe\n0.071303 0.500000 0.804816 P\n0.571303 0.000000 0.195184 P\n0.570550 0.138921 0.807161 H\n0.570550 0.861080 0.807161 H\n0.070550 0.638921 0.192839 H\n0.127170 0.150726 0.593504 H\n0.127170 0.849275 0.593504 H\n0.070550 0.361080 0.192839 H\n0.627171 0.650726 0.406496 H\n0.955792 0.000000 0.456046 H\n0.455792 0.500000 0.543954 H\n0.318284 0.000000 0.462937 H\n0.818284 0.500000 0.537062 H\n0.627171 0.349275 0.406496 H\n0.632529 0.500000 0.472495 N\n0.132529 0.000000 0.527505 N\n0.716060 0.218135 0.118967 O\n0.716060 0.781866 0.118967 O\n0.216060 0.281865 0.881033 O\n0.216060 0.718136 0.881033 O\n0.755239 0.500000 0.831224 O\n0.131824 0.500000 0.633262 O\n0.255239 0.000000 0.168776 O\n0.192484 0.500000 0.207771 O\n0.631824 0.000000 0.366738 O\n0.692484 0.000000 0.792229 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Fe",
"P",
"H",
"N",
"O"
],
"chemical_system": "Fe-H-N-O-P",
"density": 2.574458862953056,
"density_atomic": 0.1161515667308132,
"volume": 241.06433333690055,
"volume_molar": 5.18472624132277,
"formula_full": "Fe2 P2 H12 N2 O10",
"formula_reduced": "FePH6NO5",
"formula_anonymous": "ABCD5E6",
"energy_above_hull": 3.3628679821428573,
"spacegroup": 31
},
{
"id": "jvasp-45761",
"created_at": "2022-09-04T14:37:59.723807Z",
"updated_at": "2022-09-04T14:37:59.723825Z",
"structure_string": "Na4 Lu2 P2 C2 O14\n1.0\n0.000000 5.120378 0.020282\n6.863245 0.000000 0.000000\n0.000000 -0.132196 -9.246463\nNa Lu P C O\n4 2 2 2 14\ndirect\n0.236865 0.007745 0.213643 Na\n0.236865 0.492255 0.213643 Na\n0.763135 0.507746 0.786357 Na\n0.763135 0.992255 0.786357 Na\n0.782652 0.750001 0.367734 Lu\n0.217347 0.250000 0.632266 Lu\n0.698830 0.250000 0.417881 P\n0.301170 0.750001 0.582118 P\n0.727458 0.750001 0.079021 C\n0.272542 0.250000 0.920979 C\n0.467641 0.250000 0.828995 O\n0.196950 0.934764 0.655685 O\n0.196950 0.565237 0.655685 O\n0.788199 0.250000 0.581011 O\n0.606207 0.750001 0.585088 O\n0.393793 0.250000 0.414912 O\n0.959024 0.750001 0.141930 O\n0.803050 0.434764 0.344315 O\n0.803050 0.065236 0.344315 O\n0.532359 0.750001 0.171005 O\n0.040976 0.250000 0.858070 O\n0.308968 0.250000 0.055845 O\n0.211801 0.750001 0.418988 O\n0.691032 0.750001 0.944155 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Na",
"Lu",
"P",
"C",
"O"
],
"chemical_system": "C-Lu-Na-O-P",
"density": 3.8423755956063523,
"density_atomic": 0.07386329465116254,
"volume": 324.92458010904966,
"volume_molar": 8.153089824169138,
"formula_full": "Na4 Lu2 P2 C2 O14",
"formula_reduced": "Na2LuPCO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.415681979166666,
"spacegroup": 11
},
{
"id": "jvasp-29158",
"created_at": "2022-09-04T14:37:51.960686Z",
"updated_at": "2022-09-04T14:37:51.960707Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.308397 0.000000 -0.000000\n-1.654198 2.865148 0.000005\n-0.000000 0.000074 37.545786\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.666648 0.333294 0.418605 Te\n0.666645 0.333289 0.520700 Te\n0.333310 0.666620 0.093940 Mo\n0.333311 0.666622 0.469657 Mo\n0.666692 0.333382 0.281768 W\n0.666688 0.333375 0.657552 W\n0.666647 0.333291 0.049285 Se\n0.666645 0.333288 0.138694 Se\n0.333353 0.666707 0.322677 S\n0.333352 0.666705 0.698375 S\n0.333358 0.666717 0.240850 S\n0.333352 0.666707 0.616647 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.136731544182218,
"density_atomic": 0.03371750004478461,
"volume": 355.89827193775443,
"volume_molar": 17.860579082082626,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.6087961722222217,
"spacegroup": 156
},
{
"id": "jvasp-28925",
"created_at": "2022-09-04T14:37:43.846893Z",
"updated_at": "2022-09-04T14:37:43.846927Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.315699 0.000000 0.000000\n-1.657849 2.871499 0.000033\n0.000001 0.000385 34.404398\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333376 0.666753 0.715897 Te\n0.333327 0.666654 0.604094 Te\n0.333324 0.666647 0.463476 Mo\n0.666681 0.333363 0.283186 Mo\n0.333310 0.666620 0.096227 W\n0.666686 0.333372 0.660047 W\n0.666672 0.333343 0.047296 Se\n0.666608 0.333216 0.145219 Se\n0.333337 0.666675 0.327610 S\n0.666665 0.333328 0.419073 S\n0.666656 0.333309 0.507875 S\n0.333356 0.666713 0.238748 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.5810384920654865,
"density_atomic": 0.036633930348042215,
"volume": 327.56518031217206,
"volume_molar": 16.438696865955674,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.6160095055555552,
"spacegroup": 156
},
{
"id": "jvasp-45763",
"created_at": "2022-09-04T14:37:59.866550Z",
"updated_at": "2022-09-04T14:37:59.866573Z",
"structure_string": "Na4 Tm2 P2 C2 O14\n1.0\n0.000000 5.070907 0.010006\n6.905600 0.000000 0.000000\n0.000000 -0.180423 -9.303390\nNa Tm P C O\n4 2 2 2 14\ndirect\n0.234786 0.490233 0.211985 Na\n0.234786 0.009767 0.211985 Na\n0.765215 0.509767 0.788014 Na\n0.765215 0.990233 0.788014 Na\n0.778119 0.750000 0.369795 Tm\n0.221883 0.250000 0.630205 Tm\n0.696120 0.250000 0.415624 P\n0.303881 0.750000 0.584376 P\n0.727469 0.750000 0.079991 C\n0.272532 0.250000 0.920008 C\n0.470755 0.250000 0.829859 O\n0.194662 0.933759 0.655429 O\n0.194662 0.566241 0.655429 O\n0.776327 0.250000 0.579640 O\n0.611574 0.750000 0.592100 O\n0.388427 0.250000 0.407899 O\n0.960390 0.750000 0.143769 O\n0.805339 0.433759 0.344570 O\n0.805339 0.066241 0.344570 O\n0.529246 0.750000 0.170140 O\n0.039611 0.250000 0.856231 O\n0.307385 0.250000 0.054274 O\n0.223675 0.750000 0.420360 O\n0.692616 0.750000 0.945726 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Na",
"Tm",
"P",
"C",
"O"
],
"chemical_system": "C-Na-O-P-Tm",
"density": 3.7708974368324992,
"density_atomic": 0.07367150972657119,
"volume": 325.77043811203305,
"volume_molar": 8.17431430732305,
"formula_full": "Na4 Tm2 P2 C2 O14",
"formula_reduced": "Na2TmPCO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.4171976875000003,
"spacegroup": 11
},
{
"id": "jvasp-21594",
"created_at": "2022-09-04T14:37:59.680228Z",
"updated_at": "2022-09-04T14:37:59.680257Z",
"structure_string": "Ba2 Nd2 Cu2 B2 O10\n1.0\n5.547599 -0.000000 0.000000\n-0.000000 5.547599 -0.000000\n-0.000000 -0.000000 7.577454\nBa Nd Cu B O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.510070 Ba\n0.000000 0.000000 0.510070 Ba\n0.500000 0.500000 0.003490 Nd\n0.000000 0.000000 0.003490 Nd\n0.000000 0.500000 0.780683 Cu\n0.500000 0.000000 0.780683 Cu\n0.500000 0.000000 0.266151 B\n0.000000 0.500000 0.266151 B\n0.247650 0.252350 0.797348 O\n0.252350 0.752350 0.797348 O\n0.655437 0.844563 0.178273 O\n0.844563 0.344563 0.178273 O\n0.344563 0.155437 0.178273 O\n0.000000 0.500000 0.449761 O\n0.155437 0.655437 0.178273 O\n0.752350 0.747650 0.797348 O\n0.500000 0.000000 0.449761 O\n0.747650 0.247650 0.797348 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Cu",
"B",
"O"
],
"chemical_system": "B-Ba-Cu-Nd-O",
"density": 6.208053426795045,
"density_atomic": 0.07718609579033879,
"volume": 233.202623033215,
"volume_molar": 7.802105675040216,
"formula_full": "Ba2 Nd2 Cu2 B2 O10",
"formula_reduced": "BaNdCuBO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.0025120003703694,
"spacegroup": 100
},
{
"id": "jvasp-28554",
"created_at": "2022-09-04T14:37:51.194297Z",
"updated_at": "2022-09-04T14:37:51.194318Z",
"structure_string": "Te2 Mo2 W1 Se2 S2\n1.0\n3.354855 -0.000250 -0.000653\n-1.677644 2.905192 0.000642\n-0.005541 0.003229 26.515366\nTe Mo W Se S\n2 2 1 2 2\ndirect\n0.666524 0.332186 0.530272 Te\n0.666608 0.331788 0.673389 Te\n0.332603 0.666304 0.100008 Mo\n0.333354 0.665412 0.601906 Mo\n0.667486 0.335081 0.339048 W\n0.335192 0.668552 0.402129 Se\n0.333344 0.668504 0.275974 Se\n0.666472 0.332946 0.042867 S\n0.665030 0.332423 0.157246 S\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.480943769084113,
"density_atomic": 0.03482691466033787,
"volume": 258.4208244622232,
"volume_molar": 17.291628669186217,
"formula_full": "Te2 Mo2 W1 Se2 S2",
"formula_reduced": "Te2Mo2W(SeS)2",
"formula_anonymous": "AB2C2D2E2",
"energy_above_hull": 3.6668093407407407,
"spacegroup": 156
},
{
"id": "jvasp-36735",
"created_at": "2022-09-04T14:38:00.297274Z",
"updated_at": "2022-09-04T14:38:00.297284Z",
"structure_string": "Rb2 Sr2 Si2 H2 O8\n1.0\n0.000000 5.813139 -0.039090\n7.840167 0.000000 0.000000\n0.000000 -2.868135 -5.106850\nRb Sr Si H O\n2 2 2 2 8\ndirect\n0.359128 0.231445 0.718891 Rb\n0.640871 0.731445 0.281109 Rb\n0.010241 0.486746 0.006376 Sr\n0.989759 0.986746 0.993624 Sr\n0.687779 0.245461 0.374870 Si\n0.312220 0.745461 0.625130 Si\n0.507023 0.004609 0.461548 H\n0.492977 0.504609 0.538452 H\n0.853380 0.237713 0.214855 O\n0.146619 0.737713 0.785145 O\n0.876210 0.240896 0.692914 O\n0.123790 0.740896 0.307087 O\n0.474601 0.403032 0.286840 O\n0.525399 0.903032 0.713160 O\n0.489675 0.067100 0.299940 O\n0.510324 0.567100 0.700060 O\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Rb",
"Sr",
"Si",
"H",
"O"
],
"chemical_system": "H-O-Rb-Si-Sr",
"density": 3.7837848092523254,
"density_atomic": 0.06848473675741251,
"volume": 233.62869973020995,
"volume_molar": 8.793405720944364,
"formula_full": "Rb2 Sr2 Si2 H2 O8",
"formula_reduced": "RbSrSiHO4",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.6986036137499998,
"spacegroup": 4
},
{
"id": "jvasp-28590",
"created_at": "2022-09-04T14:37:40.385461Z",
"updated_at": "2022-09-04T14:37:40.385471Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.350385 0.000035 -0.001331\n-1.675163 2.901332 -0.001441\n-0.013890 -0.025463 34.939309\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.334532 0.667510 0.331951 Te\n0.332210 0.666364 0.222522 Te\n0.333724 0.666438 0.084853 Mo\n0.333088 0.666798 0.476517 Mo\n0.666579 0.333329 0.664304 Mo\n0.666676 0.333581 0.277253 W\n0.333995 0.667512 0.711908 Se\n0.665650 0.332507 0.428840 Se\n0.667099 0.334266 0.524175 Se\n0.332466 0.665719 0.616651 Se\n0.666155 0.331917 0.041490 S\n0.667827 0.334069 0.128283 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.411544611218853,
"density_atomic": 0.03533234558771429,
"volume": 339.63213594776516,
"volume_molar": 17.04427107747415,
"formula_full": "Te2 Mo3 W1 Se4 S2",
"formula_reduced": "Te2Mo3W(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.725487225,
"spacegroup": 156
},
{
"id": "jvasp-40668",
"created_at": "2022-09-04T14:37:58.684554Z",
"updated_at": "2022-09-04T14:37:58.684573Z",
"structure_string": "Li4 V2 H4 O2 F10\n1.0\n5.793814 -0.286755 0.058545\n1.934168 4.835033 0.134413\n0.707636 0.447280 7.653552\nLi V H O F\n4 2 4 2 10\ndirect\n0.703310 0.784445 0.445441 Li\n0.774529 0.667660 0.027625 Li\n0.236341 0.334982 -0.034192 Li\n0.307687 0.218153 0.547984 Li\n0.766147 0.226933 0.750044 V\n0.244779 0.775664 0.243384 V\n0.209468 0.909875 0.812112 H\n0.159748 0.805155 0.634473 H\n0.851202 0.197461 0.358981 H\n0.801455 0.092783 0.181337 H\n0.885303 0.032611 0.293046 O\n0.125649 0.970023 0.700387 O\n0.385823 0.001129 0.356027 F\n0.267964 0.970258 0.015761 F\n0.924873 0.448065 0.849520 F\n0.211242 0.590351 0.474964 F\n0.435666 0.457928 0.801406 F\n0.575229 0.544620 0.191983 F\n0.799660 0.412254 0.518453 F\n0.085998 0.554577 0.143895 F\n0.742961 0.032361 0.977665 F\n0.625164 0.001419 0.637399 F\n",
"nsites": 22,
"nelements": 5,
"elements": [
"Li",
"V",
"H",
"O",
"F"
],
"chemical_system": "F-H-Li-O-V",
"density": 2.707628460394736,
"density_atomic": 0.10086156107576275,
"volume": 218.12075646414567,
"volume_molar": 5.970699536839841,
"formula_full": "Li4 V2 H4 O2 F10",
"formula_reduced": "Li2VH2OF5",
"formula_anonymous": "ABC2D2E5",
"energy_above_hull": 1.1552235556818184,
"spacegroup": 2
},
{
"id": "jvasp-33330",
"created_at": "2022-09-04T14:37:51.299674Z",
"updated_at": "2022-09-04T14:37:51.299714Z",
"structure_string": "Si1 H12 C2 N6 F6\n1.0\n5.768193 3.664037 -2.560732\n-5.768193 3.664037 2.560732\n-0.073272 0.000000 5.885570\nSi H C N F\n1 12 2 6 6\ndirect\n0.000000 0.000000 0.000000 Si\n0.547422 0.010915 0.746421 H\n0.989086 0.452579 0.746421 H\n0.452579 0.989086 0.253579 H\n0.010915 0.547422 0.253579 H\n0.305625 0.012619 0.739956 H\n0.987381 0.694376 0.739956 H\n0.694376 0.987381 0.260044 H\n0.012619 0.305625 0.260044 H\n0.307479 0.452579 0.741433 H\n0.547422 0.692522 0.741433 H\n0.692522 0.547422 0.258567 H\n0.452579 0.307479 0.258567 H\n0.722204 0.277797 0.272660 C\n0.277797 0.722204 0.727340 C\n0.382655 0.617346 0.719804 N\n0.617346 0.382654 0.280197 N\n0.383176 0.933027 0.727986 N\n0.066974 0.616825 0.727986 N\n0.616825 0.066973 0.272014 N\n0.933028 0.383176 0.272014 N\n0.179794 0.152795 0.806900 F\n0.847206 0.820207 0.806900 F\n0.820207 0.847206 0.193100 F\n0.152795 0.179794 0.193100 F\n0.851254 0.148747 0.832559 F\n0.148748 0.851253 0.167441 F\n",
"nsites": 27,
"nelements": 5,
"elements": [
"Si",
"H",
"C",
"N",
"F"
],
"chemical_system": "C-F-H-N-Si",
"density": 1.7600494358031098,
"density_atomic": 0.10913210248298731,
"volume": 247.40657776852646,
"volume_molar": 5.518211986192418,
"formula_full": "Si1 H12 C2 N6 F6",
"formula_reduced": "SiH12C2(NF)6",
"formula_anonymous": "AB2C6D6E12",
"energy_above_hull": 3.572193696111111,
"spacegroup": 12
},
{
"id": "jvasp-40660",
"created_at": "2022-09-04T14:38:00.618735Z",
"updated_at": "2022-09-04T14:38:00.618745Z",
"structure_string": "Li4 Cr2 Fe2 P4 O16\n1.0\n0.000000 4.670468 -0.056569\n5.843353 0.000000 0.000000\n0.000000 -0.189862 -9.918973\nLi Cr Fe P O\n4 2 2 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.490848 0.750000 0.230985 Cr\n0.509153 0.250000 0.769015 Cr\n0.989479 0.250000 0.269646 Fe\n0.010522 0.750000 0.730354 Fe\n0.576981 0.750000 0.905169 P\n0.081855 0.250000 0.593554 P\n0.918146 0.750000 0.406445 P\n0.423020 0.250000 0.094831 P\n0.715559 0.962054 0.832227 O\n0.715559 0.537945 0.832227 O\n0.220593 0.462217 0.668584 O\n0.220593 0.037783 0.668584 O\n0.753013 0.250000 0.595313 O\n0.794484 0.750000 0.550691 O\n0.205517 0.250000 0.449309 O\n0.751003 0.250000 0.094648 O\n0.779408 0.962217 0.331416 O\n0.779408 0.537783 0.331416 O\n0.284442 0.462054 0.167772 O\n0.284442 0.037946 0.167772 O\n0.248998 0.750000 0.905352 O\n0.706138 0.750000 0.050190 O\n0.246987 0.750000 0.404687 O\n0.293863 0.250000 0.949810 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Cr",
"Fe",
"P",
"O"
],
"chemical_system": "Cr-Fe-Li-O-P",
"density": 3.822771747570105,
"density_atomic": 0.10341133005088048,
"volume": 270.7633678652371,
"volume_molar": 5.823482549771852,
"formula_full": "Li4 Cr2 Fe2 P4 O16",
"formula_reduced": "Li2CrFe(PO4)2",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.937041564285714,
"spacegroup": 11
}
]
}