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=spacegroup&page=196",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=194",
"results": [
{
"id": "jvasp-44540",
"created_at": "2022-09-04T14:38:31.301465Z",
"updated_at": "2022-09-04T14:38:31.301504Z",
"structure_string": "K2 Hf2 P2 C2 O14\n1.0\n0.000000 5.295937 -0.395681\n6.594829 0.000000 0.000000\n0.000000 0.600395 -9.496324\nK Hf P C O\n2 2 2 2 14\ndirect\n0.918017 0.628084 0.140667 K\n0.081984 0.128084 0.859332 K\n0.266047 0.230466 0.336675 Hf\n0.733955 0.730466 0.663324 Hf\n0.295892 0.733106 0.435285 P\n0.704109 0.233106 0.564714 P\n0.475859 0.244584 0.076359 C\n0.524142 0.744584 0.923640 C\n0.394436 0.753214 0.814069 O\n0.736625 0.420881 0.656051 O\n0.743877 0.044471 0.653377 O\n0.099486 0.737281 0.570502 O\n0.436693 0.230704 0.518054 O\n0.563309 0.730704 0.481945 O\n0.605565 0.253214 0.185930 O\n0.256124 0.544471 0.346622 O\n0.263376 0.920881 0.343948 O\n0.777854 0.742609 0.880341 O\n0.222147 0.242609 0.119659 O\n0.430542 0.736750 0.050008 O\n0.900516 0.237281 0.429497 O\n0.569458 0.236750 -0.050008 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"K",
"Hf",
"P",
"C",
"O"
],
"chemical_system": "C-Hf-K-O-P",
"density": 3.748346848844665,
"density_atomic": 0.06664647025083764,
"volume": 330.10000255375104,
"volume_molar": 9.035948546613856,
"formula_full": "K2 Hf2 P2 C2 O14",
"formula_reduced": "KHfPCO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 3.1214264545454533,
"spacegroup": 4
},
{
"id": "jvasp-44547",
"created_at": "2022-09-04T14:38:31.643123Z",
"updated_at": "2022-09-04T14:38:31.643149Z",
"structure_string": "K2 Sn2 P2 C2 O14\n1.0\n0.000000 5.031248 -0.450114\n6.529754 0.000000 0.000000\n0.000000 0.576698 -9.586142\nK Sn P C O\n2 2 2 2 14\ndirect\n0.914792 0.649640 0.147400 K\n0.085209 0.149641 0.852600 K\n0.268707 0.229500 0.342992 Sn\n0.731294 0.729500 0.657007 Sn\n0.306238 0.732123 0.431608 P\n0.693763 0.232123 0.568392 P\n0.464857 0.241024 0.083212 C\n0.535143 0.741023 0.916788 C\n0.389737 0.743136 0.811071 O\n0.744700 0.416320 0.660524 O\n0.746832 0.045446 0.657721 O\n0.127363 0.734646 0.576174 O\n0.398664 0.230228 0.538270 O\n0.601336 0.730228 0.461729 O\n0.610263 0.243137 0.188928 O\n0.253169 0.545445 0.342278 O\n0.255301 0.916319 0.339476 O\n0.798976 0.739424 0.870105 O\n0.201025 0.239424 0.129894 O\n0.438114 0.740660 0.043087 O\n0.872638 0.234647 0.423825 O\n0.561886 0.240660 -0.043088 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"K",
"Sn",
"P",
"C",
"O"
],
"chemical_system": "C-K-O-P-Sn",
"density": 3.3163264943441657,
"density_atomic": 0.07023442071438518,
"volume": 313.23672604156656,
"volume_molar": 8.574343888290326,
"formula_full": "K2 Sn2 P2 C2 O14",
"formula_reduced": "KSnPCO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 2.61550179090909,
"spacegroup": 4
},
{
"id": "jvasp-119375",
"created_at": "2022-09-04T14:38:31.895468Z",
"updated_at": "2022-09-04T14:38:31.895494Z",
"structure_string": "Li6 Mn2 P4 H2 O16\n1.0\n8.330685 0.000000 0.000000\n-0.000000 4.871343 1.192755\n-0.000000 0.087209 7.525702\nLi Mn P H O\n6 2 4 2 16\ndirect\n0.809753 0.065412 0.692441 Li\n0.655477 0.141391 0.377725 Li\n0.155476 0.858608 0.622275 Li\n0.309752 0.934587 0.307559 Li\n0.831758 0.605765 0.970944 Li\n0.331758 0.394235 0.029056 Li\n0.503220 0.761697 0.737859 Mn\n0.003220 0.238303 0.262141 Mn\n0.365640 0.375251 0.464308 P\n0.865640 0.624749 0.535692 P\n0.631859 0.121712 0.029948 P\n0.131858 0.878287 0.970052 P\n0.487431 0.680955 0.225981 H\n0.987432 0.319044 0.774019 H\n0.335479 0.630006 0.539133 O\n0.835479 0.369994 0.460867 O\n0.426469 0.490716 0.255710 O\n0.035125 0.635961 0.088366 O\n0.280292 0.765278 0.886323 O\n0.926469 0.509284 0.744291 O\n0.682342 0.920147 0.912286 O\n0.495122 0.180521 0.566257 O\n0.714865 0.791023 0.557996 O\n0.995122 0.819479 0.433744 O\n0.528701 0.968073 0.196909 O\n0.182342 0.079853 0.087715 O\n0.780292 0.234721 0.113677 O\n0.214865 0.208977 0.442004 O\n0.028701 0.031927 0.803091 O\n0.535125 0.364039 0.911634 O\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Li",
"Mn",
"P",
"H",
"O"
],
"chemical_system": "H-Li-Mn-O-P",
"density": 2.9085647924642473,
"density_atomic": 0.09850966045806203,
"volume": 304.53866007153414,
"volume_molar": 6.113248926041901,
"formula_full": "Li6 Mn2 P4 H2 O16",
"formula_reduced": "Li3MnP2HO8",
"formula_anonymous": "ABC2D3E8",
"energy_above_hull": 2.679279749425288,
"spacegroup": 4
},
{
"id": "jvasp-24955",
"created_at": "2022-09-04T14:38:31.980058Z",
"updated_at": "2022-09-04T14:38:31.980093Z",
"structure_string": "K2 Li2 Si4 O10\n1.0\n0.000000 5.996842 0.005456\n4.851216 0.000000 0.000000\n0.000000 -0.493190 -8.176626\nK Li Si O\n2 2 4 10\ndirect\n0.031906 0.309970 0.686178 K\n0.968094 0.809971 0.313822 K\n0.128498 0.298773 0.094226 Li\n0.871502 0.798773 0.905774 Li\n0.366580 0.782400 0.937617 Si\n0.558629 0.864522 0.606219 Si\n0.441371 0.364521 0.393781 Si\n0.633419 0.282400 0.062383 Si\n0.480458 0.697207 0.435717 O\n0.403632 0.109126 -0.002034 O\n0.364212 0.787924 0.735989 O\n0.635788 0.287924 0.264011 O\n0.143233 0.653341 0.998473 O\n0.596368 0.609127 0.002033 O\n0.809758 0.803439 0.671963 O\n0.190242 0.303438 0.328037 O\n0.519542 0.197206 0.564283 O\n0.856767 0.153341 0.001527 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Li",
"Si",
"O"
],
"chemical_system": "K-Li-O-Si",
"density": 2.5440248388182676,
"density_atomic": 0.07567440005661087,
"volume": 237.8611523386307,
"volume_molar": 7.957963003994652,
"formula_full": "K2 Li2 Si4 O10",
"formula_reduced": "KLiSi2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.0721658555555558,
"spacegroup": 4
},
{
"id": "jvasp-119385",
"created_at": "2022-09-04T14:38:32.091648Z",
"updated_at": "2022-09-04T14:38:32.091684Z",
"structure_string": "Na2 Cr2 C2 S2 O14\n1.0\n6.279620 -0.000000 0.000000\n0.000000 4.803628 -0.058555\n-0.000000 -0.455336 9.038945\nNa Cr C S O\n2 2 2 2 14\ndirect\n0.608119 0.973030 0.888606 Na\n0.108119 0.026969 0.111394 Na\n0.242195 0.259909 0.664656 Cr\n0.742195 0.740090 0.335344 Cr\n0.234763 0.443043 0.917469 C\n0.734763 0.556956 0.082531 C\n0.743777 0.292797 0.578649 S\n0.243777 0.707203 0.421351 S\n0.748077 0.408386 0.199633 O\n0.427856 0.762872 0.325130 O\n0.056652 0.772037 0.328314 O\n0.745716 0.121213 0.438936 O\n0.238597 0.408291 0.458180 O\n0.738597 0.591709 0.541820 O\n0.248077 0.591614 0.800367 O\n0.556652 0.227962 0.671686 O\n0.927856 0.237128 0.674870 O\n0.745299 0.830508 0.122771 O\n0.245299 0.169492 0.877229 O\n0.711099 0.464635 0.952088 O\n0.245716 0.878787 0.561064 O\n0.211099 0.535364 0.047912 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"Na",
"Cr",
"C",
"S",
"O"
],
"chemical_system": "C-Cr-Na-O-S",
"density": 2.816081409882046,
"density_atomic": 0.08073632349705469,
"volume": 272.49197197841903,
"volume_molar": 7.4590227782909775,
"formula_full": "Na2 Cr2 C2 S2 O14",
"formula_reduced": "NaCrCSO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 3.0269537181818174,
"spacegroup": 4
},
{
"id": "jvasp-42164",
"created_at": "2022-09-04T14:38:32.462972Z",
"updated_at": "2022-09-04T14:38:32.462992Z",
"structure_string": "Fe8 O6 F10\n1.0\n0.000000 6.049648 -0.020510\n4.729136 0.000000 0.000000\n0.000000 -2.964172 -9.526152\nFe O F\n8 6 10\ndirect\n0.303934 0.449488 0.356868 Fe\n0.068716 0.504830 0.871973 Fe\n0.564067 0.531499 0.891512 Fe\n0.828338 0.512557 0.397787 Fe\n0.435933 0.031499 0.108487 Fe\n0.171663 0.012557 0.602213 Fe\n0.931284 0.004829 0.128027 Fe\n0.696066 0.949489 0.643132 Fe\n0.241773 0.187788 0.207242 O\n0.115718 0.298572 0.464870 O\n0.367053 0.315481 0.970123 O\n0.632947 0.815482 0.029877 O\n0.884283 0.798573 0.535129 O\n0.758228 0.687788 0.792758 O\n0.740253 0.218643 0.232904 F\n0.389655 0.786424 0.520222 F\n0.136162 0.789714 0.025737 F\n0.516513 0.700361 0.276168 F\n0.013377 0.704646 0.275666 F\n0.259747 0.718643 0.767096 F\n0.863839 0.289714 0.974263 F\n0.610346 0.286424 0.479778 F\n0.986624 0.204645 0.724333 F\n0.483488 0.200361 0.723832 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.459764547967742,
"density_atomic": 0.08796783810701743,
"volume": 272.8269844576919,
"volume_molar": 6.8458437647106365,
"formula_full": "Fe8 O6 F10",
"formula_reduced": "Fe4O3F5",
"formula_anonymous": "A3B4C5",
"energy_above_hull": 1.9086703260416664,
"spacegroup": 4
},
{
"id": "jvasp-47725",
"created_at": "2022-09-04T14:38:33.289472Z",
"updated_at": "2022-09-04T14:38:33.289500Z",
"structure_string": "Li2 Fe2 P4 H2 O16\n1.0\n0.000000 4.757690 0.011371\n7.998810 0.000000 0.000000\n0.000000 -1.858020 -7.194030\nLi Fe P H O\n2 2 4 2 16\ndirect\n0.856562 0.625515 0.396615 Li\n0.143438 0.125515 0.603385 Li\n0.252087 0.499274 0.764451 Fe\n0.747913 -0.000726 0.235549 Fe\n0.879446 0.648576 0.011504 P\n0.120554 0.148576 0.988496 P\n0.377080 0.847442 0.501151 P\n0.622920 0.347442 0.498849 P\n0.717134 0.985804 0.736695 H\n0.282866 0.485804 0.263305 H\n0.607330 0.827859 0.385193 O\n0.499652 0.446619 0.316210 O\n0.378887 0.048154 0.113312 O\n0.209759 0.325514 0.948400 O\n0.500348 0.946619 0.683790 O\n0.392670 0.327859 0.614807 O\n0.106333 0.665080 0.890561 O\n0.893667 0.165080 0.109439 O\n0.263891 0.677961 0.542395 O\n0.124676 0.963327 0.396479 O\n0.000278 0.553620 0.190830 O\n0.736109 0.177961 0.457606 O\n0.790241 0.825514 0.051600 O\n0.875324 0.463327 0.603521 O\n0.999722 0.053620 0.809170 O\n0.621113 0.548154 0.886688 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Li",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-Li-O-P",
"density": 3.0799007069980275,
"density_atomic": 0.09502715881851383,
"volume": 273.60599141615614,
"volume_molar": 6.337283819567092,
"formula_full": "Li2 Fe2 P4 H2 O16",
"formula_reduced": "LiFeP2HO8",
"formula_anonymous": "ABCD2E8",
"energy_above_hull": 2.8732165,
"spacegroup": 4
},
{
"id": "jvasp-57140",
"created_at": "2022-09-04T14:38:33.533495Z",
"updated_at": "2022-09-04T14:38:33.533510Z",
"structure_string": "Na2 Sb2 P4 S12\n1.0\n0.000000 6.538192 -0.059149\n7.477270 0.000000 0.000000\n0.000000 -0.472030 -9.339188\nNa Sb P S\n2 2 4 12\ndirect\n0.305801 0.548456 0.499060 Na\n0.694199 0.048456 0.500940 Na\n0.189524 0.264027 0.016266 Sb\n0.810475 0.764027 0.983734 Sb\n0.313704 0.830153 0.184883 P\n0.185476 0.048288 0.321626 P\n0.814524 0.548288 0.678374 P\n0.686296 0.330153 0.815118 P\n0.424526 0.239805 0.721680 S\n0.910853 0.134712 0.822072 S\n0.575474 0.739805 0.278320 S\n0.089147 0.634712 0.177929 S\n0.066363 0.628144 0.806756 S\n0.933637 0.128144 0.193245 S\n0.875214 0.441298 0.491824 S\n0.124786 0.941298 0.508176 S\n0.648575 0.447644 0.015239 S\n0.351425 0.947644 0.984761 S\n0.399620 0.244175 0.305444 S\n0.600379 0.744175 0.694557 S\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Na",
"Sb",
"P",
"S"
],
"chemical_system": "Na-P-S-Sb",
"density": 2.901607120888034,
"density_atomic": 0.04378462259379676,
"volume": 456.781372436302,
"volume_molar": 13.754008606786973,
"formula_full": "Na2 Sb2 P4 S12",
"formula_reduced": "NaSb(PS3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.13458761,
"spacegroup": 4
},
{
"id": "jvasp-29974",
"created_at": "2022-09-04T14:38:33.643370Z",
"updated_at": "2022-09-04T14:38:33.643395Z",
"structure_string": "Ag6 S2 I2\n1.0\n4.235606 0.825032 -2.070976\n-1.626587 3.915334 -1.766401\n-2.000862 -3.896795 16.480554\nAg S I\n6 2 2\ndirect\n0.338452 0.814501 0.910018 Ag\n0.612520 0.857152 0.791955 Ag\n0.394616 0.213286 0.433134 Ag\n0.326088 0.563709 0.058607 Ag\n0.648449 0.255202 0.315003 Ag\n0.041603 0.506304 0.166379 Ag\n0.980045 0.121056 0.232872 S\n-0.001528 0.948975 0.992107 S\n0.957513 -0.002036 0.713740 I\n0.052240 0.071836 0.511180 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ag",
"S",
"I"
],
"chemical_system": "Ag-I-S",
"density": 6.6823109551027295,
"density_atomic": 0.04169496424416814,
"volume": 239.83711657454404,
"volume_molar": 14.44332875484433,
"formula_full": "Ag6 S2 I2",
"formula_reduced": "Ag3SI",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1408296109999998,
"spacegroup": 4
},
{
"id": "jvasp-116810",
"created_at": "2022-09-04T14:38:33.734066Z",
"updated_at": "2022-09-04T14:38:33.734096Z",
"structure_string": "Li2 V4 P2 O14\n1.0\n5.095401 -0.000000 -0.962821\n-0.000003 10.368434 -0.000011\n0.139385 -0.000000 4.705839\nLi V P O\n2 4 2 14\ndirect\n0.405191 0.164095 0.038819 Li\n0.594810 0.664095 0.461179 Li\n0.151876 0.612357 0.855591 V\n0.115642 0.834069 0.375367 V\n0.848126 0.112356 0.644410 V\n0.884359 0.334072 0.124635 V\n0.467410 0.398799 0.555041 P\n0.532593 0.898798 0.944963 P\n-0.022107 0.481720 -0.062517 O\n0.585838 0.033975 0.809075 O\n0.741586 0.188090 0.319117 O\n0.334895 0.938115 0.143915 O\n0.576698 0.306696 0.806235 O\n0.665110 0.438115 0.356086 O\n0.414167 0.533976 0.690925 O\n0.423303 0.806695 0.693768 O\n0.022107 -0.018280 0.562517 O\n0.953013 0.705096 0.600491 O\n0.219411 0.336988 0.394823 O\n0.046986 0.205096 0.899510 O\n0.258415 0.688089 0.180883 O\n0.780590 0.836987 0.105179 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"V",
"P",
"O"
],
"chemical_system": "Li-O-P-V",
"density": 3.3448080244867135,
"density_atomic": 0.08799746524161416,
"volume": 250.0072012255662,
"volume_molar": 6.843538894518201,
"formula_full": "Li2 V4 P2 O14",
"formula_reduced": "LiV2PO7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.9937362181818177,
"spacegroup": 4
},
{
"id": "jvasp-27532",
"created_at": "2022-09-04T14:38:33.959086Z",
"updated_at": "2022-09-04T14:38:33.959109Z",
"structure_string": "Li2 In2 P4 O14\n1.0\n0.000000 4.919140 0.065577\n8.482861 0.000000 0.000000\n0.000000 -2.399003 -6.735156\nLi In P O\n2 2 4 14\ndirect\n0.811487 0.390057 0.332505 Li\n0.188513 0.890057 0.667496 Li\n0.221481 0.248629 0.735244 In\n0.778520 0.748629 0.264757 In\n0.593124 0.068028 0.468123 P\n0.406876 0.568028 0.531877 P\n0.811949 0.460687 0.926536 P\n0.188052 0.960687 0.073464 P\n0.650247 0.305748 0.920262 O\n0.349753 0.805748 0.079738 O\n0.131756 0.041890 0.872579 O\n0.868245 0.541890 0.127421 O\n0.087833 0.437152 0.879952 O\n0.912167 0.937152 0.120048 O\n0.233655 0.414304 0.505944 O\n0.394234 0.083916 0.235154 O\n0.766346 0.914304 0.494056 O\n0.608644 0.564268 0.410546 O\n0.213883 0.715020 0.495056 O\n0.786117 0.215020 0.504944 O\n0.605767 0.583916 0.764847 O\n0.391357 0.064268 0.589454 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"In",
"P",
"O"
],
"chemical_system": "In-Li-O-P",
"density": 3.5109265580750466,
"density_atomic": 0.07865214928734417,
"volume": 279.71263594623724,
"volume_molar": 7.656676663722166,
"formula_full": "Li2 In2 P4 O14",
"formula_reduced": "LiInP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.3284441336363635,
"spacegroup": 4
},
{
"id": "jvasp-119542",
"created_at": "2022-09-04T14:38:35.213445Z",
"updated_at": "2022-09-04T14:38:35.213471Z",
"structure_string": "Li4 Cr2 P4 O14\n1.0\n5.302177 0.025123 0.000959\n-2.442950 6.592284 -0.000445\n-0.001562 -0.000005 8.455035\nLi Cr P O\n4 2 4 14\ndirect\n0.241786 0.901621 0.828567 Li\n0.758215 0.098378 0.328567 Li\n0.414910 0.635112 0.652087 Li\n0.585088 0.364886 0.152086 Li\n0.457872 0.267034 0.510560 Cr\n0.542128 0.732965 0.010561 Cr\n0.172524 0.929979 0.215374 P\n0.827475 0.070019 0.715374 P\n0.166481 0.520944 0.310485 P\n0.833519 0.479056 0.810486 P\n0.636050 0.469598 0.675818 O\n0.363949 0.530400 0.175818 O\n0.883558 0.381991 0.277333 O\n0.116441 0.618006 0.777334 O\n0.832554 0.250442 0.837144 O\n0.167446 0.749557 0.337143 O\n0.109453 0.065663 0.699301 O\n0.296879 0.895705 0.057976 O\n0.372134 0.119833 0.296222 O\n0.627867 0.880166 0.796223 O\n0.274997 0.470861 0.467187 O\n0.890548 0.934337 0.199301 O\n0.703120 0.104293 0.557976 O\n0.725004 0.529137 0.967187 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P",
"density": 2.6902931991630625,
"density_atomic": 0.08106694089163366,
"volume": 296.05163012234584,
"volume_molar": 7.428602453434261,
"formula_full": "Li4 Cr2 P4 O14",
"formula_reduced": "Li2CrP2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.759011075,
"spacegroup": 4
}
]
}