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=-id&page=3524",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=3522",
"results": [
{
"id": "jvasp-119356",
"created_at": "2022-09-04T14:38:31.294292Z",
"updated_at": "2022-09-04T14:38:31.294318Z",
"structure_string": "Li4 Al1 Cr3 O8\n1.0\n5.033085 0.002348 -0.000043\n1.675920 4.754802 -2.905766\n0.000059 -0.000040 5.811508\nLi Al Cr O\n4 1 3 8\ndirect\n0.000002 -0.000002 0.000004 Li\n-0.000003 0.000002 0.500006 Li\n0.503922 -0.001151 0.249389 Li\n0.496075 0.001152 0.750542 Li\n0.000001 0.499999 0.500005 Al\n0.499999 0.500000 0.251838 Cr\n0.000001 0.500000 0.000011 Cr\n0.499999 0.500000 0.748167 Cr\n0.752141 0.277179 0.388592 O\n0.247858 0.722820 0.611413 O\n0.259058 0.725277 0.112639 O\n0.740942 0.274723 0.887361 O\n0.235759 0.277594 0.630809 O\n0.235760 0.277592 0.146798 O\n0.764241 0.722407 0.853217 O\n0.764239 0.722407 0.369207 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Cr",
"O"
],
"chemical_system": "Al-Cr-Li-O",
"density": 4.045006567928168,
"density_atomic": 0.11506352823501255,
"volume": 139.05361886105783,
"volume_molar": 5.233752912304257,
"formula_full": "Li4 Al1 Cr3 O8",
"formula_reduced": "Li4AlCr3O8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.8203433125000004,
"spacegroup": 12
},
{
"id": "jvasp-119354",
"created_at": "2022-09-04T14:38:47.392677Z",
"updated_at": "2022-09-04T14:38:47.392705Z",
"structure_string": "Mn6 O4 F8\n1.0\n5.336534 -0.017237 1.955472\n1.522850 5.114667 1.955472\n-0.009860 -0.007328 7.723273\nMn O F\n6 4 8\ndirect\n0.669535 0.642647 0.842806 Mn\n0.309494 0.350070 0.670077 Mn\n0.649930 0.690506 0.329922 Mn\n0.357353 0.330464 0.157194 Mn\n0.018998 0.981002 0.500000 Mn\n0.013065 0.986935 -0.000000 Mn\n0.314870 0.685130 -0.000000 O\n0.709702 0.290298 -0.000000 O\n0.364093 0.987784 0.325001 O\n0.012216 0.635907 0.674999 O\n0.775800 0.768093 0.037062 F\n0.621180 0.034598 0.671791 F\n0.965400 0.378819 0.328209 F\n0.898632 0.899866 0.302385 F\n0.558227 0.570542 0.625153 F\n0.231906 0.224199 0.962937 F\n0.100133 0.101367 0.697614 F\n0.429458 0.441772 0.374846 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.290642898131739,
"density_atomic": 0.08524344496373457,
"volume": 211.15993150743503,
"volume_molar": 7.064637946720738,
"formula_full": "Mn6 O4 F8",
"formula_reduced": "Mn3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.981284428237548,
"spacegroup": 5
},
{
"id": "jvasp-119353",
"created_at": "2022-09-04T14:38:31.221460Z",
"updated_at": "2022-09-04T14:38:31.221488Z",
"structure_string": "V6 O8 F4\n1.0\n5.206236 -0.059933 1.787260\n1.264297 5.052304 1.788610\n0.071805 0.042519 7.273765\nV O F\n6 8 4\ndirect\n0.678735 0.703503 0.835742 V\n0.334800 0.347126 0.669513 V\n0.640011 0.650797 0.315949 V\n0.303535 0.326147 0.175276 V\n-0.000748 -0.000274 0.499754 V\n0.031850 0.974302 0.004894 V\n0.953284 0.368459 0.333425 O\n0.633658 0.046207 0.668613 O\n0.318289 0.684394 0.998150 O\n0.425088 0.429750 0.364364 O\n0.230420 0.229498 0.964399 O\n0.363727 0.961338 0.332171 O\n0.035122 0.638434 0.669447 O\n0.771899 0.771002 0.035736 O\n0.105558 0.101158 0.699672 F\n0.573275 0.578549 0.631470 F\n0.895739 0.893019 0.304673 F\n0.705775 0.296592 0.996744 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.432593926521599,
"density_atomic": 0.09428002988240218,
"volume": 190.92060134528856,
"volume_molar": 6.387504084917628,
"formula_full": "V6 O8 F4",
"formula_reduced": "V3(O2F)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.650146351666667,
"spacegroup": 1
},
{
"id": "jvasp-119352",
"created_at": "2022-09-04T14:38:31.188794Z",
"updated_at": "2022-09-04T14:38:31.188822Z",
"structure_string": "V4 Ge4 O12\n1.0\n4.965864 0.290625 0.327116\n-0.238915 7.104659 -1.384498\n-0.502965 -0.926740 7.163088\nV Ge O\n4 4 12\ndirect\n0.249981 0.271747 0.271839 V\n0.250003 0.923498 0.923395 V\n0.750020 0.728256 0.728160 V\n0.749999 0.076501 0.076607 V\n0.752693 0.206274 0.578373 Ge\n0.252588 0.421940 0.793916 Ge\n0.747410 0.578061 0.206082 Ge\n0.247304 0.793729 0.421629 Ge\n0.426677 0.667182 0.840745 O\n0.926695 0.159071 0.332958 O\n0.097133 0.522653 0.311465 O\n0.597177 0.688640 0.477123 O\n0.402822 0.311364 0.522877 O\n0.079469 0.176977 0.007020 O\n0.420495 0.006967 0.177007 O\n0.920532 0.823021 -0.007018 O\n0.573322 0.332817 0.159255 O\n0.579504 -0.006967 0.822996 O\n0.902866 0.477349 0.688533 O\n0.073305 0.840931 0.667044 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"Ge",
"O"
],
"chemical_system": "Ge-O-V",
"density": 4.590054726706727,
"density_atomic": 0.08055135796916452,
"volume": 248.28879989405152,
"volume_molar": 7.4761505104672565,
"formula_full": "V4 Ge4 O12",
"formula_reduced": "VGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.24653613,
"spacegroup": 15
},
{
"id": "jvasp-119349",
"created_at": "2022-09-04T14:38:49.220507Z",
"updated_at": "2022-09-04T14:38:49.220535Z",
"structure_string": "Li4 Mn1 P6 O18\n1.0\n6.638374 0.115127 -2.623276\n-2.174226 6.472070 -2.539025\n0.463874 -0.389218 7.555465\nLi Mn P O\n4 1 6 18\ndirect\n0.389827 0.145143 0.572841 Li\n0.482998 0.529387 0.986201 Li\n0.602122 0.845724 0.416360 Li\n0.229902 0.941435 0.099892 Li\n0.796983 0.072282 0.927391 Mn\n0.994491 0.750694 0.323603 P\n0.220155 0.447215 0.247601 P\n0.317916 0.766040 0.672807 P\n0.680652 0.228306 0.330858 P\n0.009325 0.253653 0.676392 P\n0.776516 0.548317 0.749783 P\n0.293977 0.527211 0.500028 O\n0.092407 0.785898 0.566205 O\n0.771391 0.734634 0.260626 O\n0.379445 0.566038 0.212119 O\n0.010378 0.515073 0.195285 O\n0.345685 0.772343 0.878012 O\n0.845048 0.784531 0.864391 O\n0.704816 0.468243 0.497069 O\n0.231943 0.271176 0.741263 O\n0.657419 0.217001 0.123671 O\n0.987558 0.484194 0.804354 O\n0.619016 0.426912 0.785044 O\n0.480700 0.918593 0.665240 O\n0.909966 0.213510 0.435066 O\n0.521903 0.077335 0.339682 O\n0.863326 0.093657 0.689333 O\n0.143466 0.209401 0.129931 O\n0.140644 0.906057 0.308932 O\n",
"nsites": 29,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 2.8394705921186927,
"density_atomic": 0.08910349041203537,
"volume": 325.46424237588474,
"volume_molar": 6.758591310118396,
"formula_full": "Li4 Mn1 P6 O18",
"formula_reduced": "Li4Mn(PO3)6",
"formula_anonymous": "AB4C6D18",
"energy_above_hull": 2.945827697978597,
"spacegroup": 1
},
{
"id": "jvasp-119348",
"created_at": "2022-09-04T14:38:31.147495Z",
"updated_at": "2022-09-04T14:38:31.147525Z",
"structure_string": "Li2 Co2 Ni2 O8\n1.0\n4.913067 -0.007566 -2.829625\n-1.636060 4.638568 -2.819939\n-0.016893 0.007566 5.669631\nLi Co Ni O\n2 2 2 8\ndirect\n0.128882 0.878882 0.250000 Li\n0.871119 0.121118 0.750000 Li\n0.000000 0.500001 0.500000 Co\n0.500000 0.500000 -0.000001 Co\n0.500001 0.500000 0.500000 Ni\n0.500000 -0.000000 -0.000001 Ni\n0.263517 0.292335 0.528818 O\n0.263309 0.736502 0.526807 O\n0.709695 0.736502 0.973193 O\n0.263518 0.734701 0.971182 O\n0.736484 0.265300 0.028817 O\n0.736693 0.263499 0.473193 O\n0.290307 0.263499 0.026806 O\n0.736484 0.707665 0.471182 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"Ni",
"O"
],
"chemical_system": "Co-Li-Ni-O",
"density": 4.852458515929358,
"density_atomic": 0.10847989077496568,
"volume": 129.05617714016756,
"volume_molar": 5.551389033468452,
"formula_full": "Li2 Co2 Ni2 O8",
"formula_reduced": "LiCoNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.183956757142857,
"spacegroup": 74
},
{
"id": "jvasp-119347",
"created_at": "2022-09-04T14:38:50.928483Z",
"updated_at": "2022-09-04T14:38:50.928506Z",
"structure_string": "Fe6 O11 F1\n1.0\n9.782459 -0.006490 0.000000\n1.895236 5.780355 0.000000\n-0.000000 -0.000000 2.851255\nFe O F\n6 11 1\ndirect\n0.016426 0.991793 -0.000000 Fe\n0.997306 0.501352 0.499999 Fe\n0.328336 0.335853 -0.000000 Fe\n0.648865 0.175544 0.499999 Fe\n0.339694 0.830170 0.499999 Fe\n0.667542 0.666204 -0.000000 Fe\n0.797287 0.601330 0.499999 O\n0.538301 0.730833 0.499999 O\n0.665356 0.362029 -0.000000 O\n0.335424 0.636026 -0.000000 O\n0.137274 0.931368 0.499999 O\n0.000157 0.699932 -0.000000 O\n0.199239 0.400407 0.499999 O\n0.665349 0.972570 -0.000000 O\n0.335426 0.028591 -0.000000 O\n0.000173 0.299912 -0.000000 O\n0.458576 0.270728 0.499999 O\n0.869275 0.065364 0.499999 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.458113225819129,
"density_atomic": 0.11161933702274936,
"volume": 161.26238051683987,
"volume_molar": 5.3952486375838395,
"formula_full": "Fe6 O11 F1",
"formula_reduced": "Fe6O11F",
"formula_anonymous": "AB6C11",
"energy_above_hull": 3.197531765694445,
"spacegroup": 38
},
{
"id": "jvasp-119346",
"created_at": "2022-09-04T14:38:48.077116Z",
"updated_at": "2022-09-04T14:38:48.077139Z",
"structure_string": "Li4 Mn2 F8\n1.0\n5.182909 -0.000000 2.992354\n1.727636 4.886494 2.992354\n-0.000000 -0.000000 5.984708\nLi Mn F\n4 2 8\ndirect\n0.625001 0.625000 0.124999 Li\n0.625001 0.625000 0.624999 Li\n0.625000 0.125000 0.625000 Li\n0.125001 0.625000 0.625000 Li\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 Mn\n0.864355 0.864353 0.406936 F\n0.864354 0.406937 0.864353 F\n0.864355 0.864353 0.864353 F\n0.406938 0.864353 0.864353 F\n0.843063 0.385646 0.385645 F\n0.385646 0.385646 0.385646 F\n0.385647 0.843062 0.385645 F\n0.385646 0.385646 0.843063 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.17303379292987,
"density_atomic": 0.09236642112291628,
"volume": 151.57023331422087,
"volume_molar": 6.519837714601996,
"formula_full": "Li4 Mn2 F8",
"formula_reduced": "Li2MnF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.4163854816256155,
"spacegroup": 227
},
{
"id": "jvasp-119345",
"created_at": "2022-09-04T14:38:31.044271Z",
"updated_at": "2022-09-04T14:38:31.044301Z",
"structure_string": "Fe10 O9 F11\n1.0\n15.034761 -0.000000 0.000000\n0.000000 4.679192 0.282081\n-0.000000 0.039223 4.674570\nFe O F\n10 9 11\ndirect\n0.402596 0.011574 0.985456 Fe\n0.597404 0.011574 0.985456 Fe\n0.806096 0.957339 0.012875 Fe\n-0.000000 0.949386 0.990937 Fe\n0.193904 0.957339 0.012875 Fe\n0.500000 0.506606 0.489528 Fe\n0.895573 0.537121 0.509149 Fe\n0.688966 0.511365 0.476564 Fe\n0.104427 0.537121 0.509149 Fe\n0.311034 0.511365 0.476564 Fe\n0.596203 0.308961 0.685597 O\n0.403797 0.308961 0.685597 O\n0.206787 0.688790 0.313503 O\n-0.000000 0.693595 0.319368 O\n0.793213 0.688790 0.313503 O\n0.594072 0.707273 0.285563 O\n0.405928 0.707273 0.285563 O\n0.102372 0.800019 0.816616 O\n0.897627 0.800019 0.816616 O\n0.500000 0.810395 0.783125 F\n0.698991 0.805346 0.798240 F\n0.301009 0.805346 0.798240 F\n0.794537 0.294903 0.712608 F\n-0.000000 0.298155 0.721808 F\n0.205463 0.294903 0.712608 F\n0.500000 0.211327 0.187029 F\n0.897226 0.200624 0.219326 F\n0.701129 0.191946 0.188607 F\n0.298871 0.191946 0.188607 F\n0.102774 0.200624 0.219326 F\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.60449149927922,
"density_atomic": 0.09127081447736742,
"volume": 328.69214733959836,
"volume_molar": 6.5981012599524025,
"formula_full": "Fe10 O9 F11",
"formula_reduced": "Fe10O9F11",
"formula_anonymous": "A9B10C11",
"energy_above_hull": 2.2732286535833333,
"spacegroup": 6
},
{
"id": "jvasp-119343",
"created_at": "2022-09-04T14:38:50.601656Z",
"updated_at": "2022-09-04T14:38:50.601674Z",
"structure_string": "Li4 Cr3 Ni1 O8\n1.0\n4.815296 0.008139 1.468094\n0.881744 4.983345 2.899358\n-0.004094 0.021423 5.832403\nLi Cr Ni O\n4 3 1 8\ndirect\n-0.002063 0.502475 0.502476 Li\n0.002062 0.997526 0.997527 Li\n0.000000 0.992203 0.507797 Li\n0.000002 0.507799 0.992201 Li\n0.499999 0.249998 0.249998 Cr\n0.500000 0.249997 0.750003 Cr\n0.499999 0.750004 0.249997 Cr\n0.500001 0.750000 0.749999 Ni\n0.270499 0.615048 0.615047 O\n0.729500 0.884953 0.884951 O\n0.273564 0.121190 0.121191 O\n0.726439 0.378809 0.378809 O\n0.726736 0.365198 0.885601 O\n0.726736 0.885603 0.365198 O\n0.273266 0.134800 0.614398 O\n0.273265 0.614397 0.134801 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Ni",
"O"
],
"chemical_system": "Cr-Li-Ni-O",
"density": 4.404095674969258,
"density_atomic": 0.11455358880442218,
"volume": 139.67262105875065,
"volume_molar": 5.2570511520871035,
"formula_full": "Li4 Cr3 Ni1 O8",
"formula_reduced": "Li4Cr3NiO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.7916570375000003,
"spacegroup": 12
},
{
"id": "jvasp-119342",
"created_at": "2022-09-04T14:38:50.859401Z",
"updated_at": "2022-09-04T14:38:50.859430Z",
"structure_string": "Li2 Mn1 Cu3 O8\n1.0\n5.052505 0.018464 2.922239\n1.694369 4.759964 2.922239\n0.026070 0.018464 5.836661\nLi Mn Cu O\n2 1 3 8\ndirect\n0.130664 0.130663 0.130664 Li\n0.869338 0.869334 0.869337 Li\n0.500001 0.499999 0.500000 Mn\n0.500001 -0.000001 0.500000 Cu\n0.000000 0.499999 0.500000 Cu\n0.500001 0.499999 0.000000 Cu\n0.267869 0.267867 0.267868 O\n0.274854 0.274852 0.717063 O\n0.717064 0.274852 0.274853 O\n0.274854 0.717061 0.274854 O\n0.725148 0.282936 0.725147 O\n0.282938 0.725145 0.725147 O\n0.725148 0.725145 0.282938 O\n0.732133 0.732130 0.732132 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Cu",
"O"
],
"chemical_system": "Cu-Li-Mn-O",
"density": 4.6072571598292384,
"density_atomic": 0.10025408769266306,
"volume": 139.64517878730413,
"volume_molar": 6.006878022232225,
"formula_full": "Li2 Mn1 Cu3 O8",
"formula_reduced": "Li2MnCu3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.0038026136699507,
"spacegroup": 166
},
{
"id": "jvasp-119340",
"created_at": "2022-09-04T14:38:47.316812Z",
"updated_at": "2022-09-04T14:38:47.316833Z",
"structure_string": "Li6 Mn2 O1 F11\n1.0\n4.793635 -0.018756 1.429154\n-2.699124 4.696473 0.357818\n0.020839 0.029325 8.685617\nLi Mn O F\n6 2 1 11\ndirect\n0.144891 0.341960 0.060050 Li\n0.363016 0.407451 0.689086 Li\n0.633111 0.604285 0.336971 Li\n0.866020 0.145173 0.412078 Li\n0.824564 0.617225 0.930250 Li\n0.637690 0.132251 0.818812 Li\n0.164231 0.897561 0.568607 Mn\n0.335513 0.851887 0.180454 Mn\n0.410587 0.874721 0.374535 O\n0.553305 0.113421 0.614010 F\n0.453602 0.374690 0.874548 F\n0.727998 0.195241 0.043501 F\n0.767575 0.724412 0.530383 F\n0.073734 0.024961 0.218710 F\n0.243533 0.268685 0.470271 F\n0.554114 0.636057 0.135034 F\n0.076386 0.554236 0.705579 F\n0.945273 0.480748 0.278802 F\n0.254541 0.782756 0.980720 F\n0.952662 0.966700 0.768336 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 3.209480827257829,
"density_atomic": 0.1026706178676897,
"volume": 194.7976978747098,
"volume_molar": 5.865495781627276,
"formula_full": "Li6 Mn2 O1 F11",
"formula_reduced": "Li6Mn2OF11",
"formula_anonymous": "AB2C6D11",
"energy_above_hull": 0.7061115545129306,
"spacegroup": 5
}
]
}