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=-density&page=4032",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4030",
"results": [
{
"id": "jvasp-12544",
"created_at": "2022-09-04T14:38:35.723428Z",
"updated_at": "2022-09-04T14:38:35.723447Z",
"structure_string": "K2 Br2 F8\n1.0\n5.540860 -0.000000 -2.691991\n-1.307886 5.384289 -2.691991\n0.015022 0.019108 7.079225\nK Br F\n2 2 8\ndirect\n0.250000 0.250000 0.500000 K\n0.749999 0.750000 0.500000 K\n-0.000000 0.500000 -0.000000 Br\n0.500000 0.000000 0.000000 Br\n0.965160 0.465160 0.246044 F\n0.719116 0.219116 0.753956 F\n0.034839 0.534840 0.753956 F\n0.219116 0.034840 0.753956 F\n0.280883 0.780884 0.246044 F\n0.465160 0.280884 0.246044 F\n0.780883 0.965161 0.246044 F\n0.534839 0.719116 0.753956 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Br",
"F"
],
"chemical_system": "Br-F-K",
"density": 3.058037200884255,
"density_atomic": 0.05666558918584329,
"volume": 211.76873253085225,
"volume_molar": 10.627509298896529,
"formula_full": "K2 Br2 F8",
"formula_reduced": "KBrF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 140
},
{
"id": "jvasp-67988",
"created_at": "2022-09-04T14:36:12.582108Z",
"updated_at": "2022-09-04T14:36:12.582135Z",
"structure_string": "Na2 Be1 Ge1\n1.0\n-2.305334 2.305334 3.260200\n2.305334 -2.305334 3.260200\n2.305334 2.305334 -3.260200\nNa Be Ge\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.749999 0.499999 Na\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Na",
"density": 3.0579879937744328,
"density_atomic": 0.05771491308418569,
"volume": 69.3061773161715,
"volume_molar": 10.434288883387596,
"formula_full": "Na2 Be1 Ge1",
"formula_reduced": "Na2BeGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3476350125,
"spacegroup": 216
},
{
"id": "jvasp-100579",
"created_at": "2022-09-04T14:36:42.223985Z",
"updated_at": "2022-09-04T14:36:42.224007Z",
"structure_string": "K2 Sc1 In1 F6\n1.0\n5.599477 0.000000 3.232859\n1.866492 5.279238 3.232859\n0.000000 0.000000 6.465719\nK Sc In F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 In\n0.221179 0.221179 0.778821 F\n0.221178 0.778822 0.778821 F\n0.778821 0.778822 0.221179 F\n0.221178 0.778822 0.221179 F\n0.778822 0.221179 0.778821 F\n0.778822 0.221179 0.221179 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Sc",
"In",
"F"
],
"chemical_system": "F-In-K-Sc",
"density": 3.0577925819024627,
"density_atomic": 0.05231960628891558,
"volume": 191.13293675756498,
"volume_molar": 11.510294490262345,
"formula_full": "K2 Sc1 In1 F6",
"formula_reduced": "K2ScInF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-23053",
"created_at": "2022-09-04T14:38:31.652203Z",
"updated_at": "2022-09-04T14:38:31.652233Z",
"structure_string": "K12 Ta4 S16\n1.0\n9.271598 -0.000000 0.000000\n-0.000000 9.386347 0.000000\n0.000000 0.000000 10.646914\nK Ta S\n12 4 16\ndirect\n0.556776 0.288793 0.044318 K\n0.134336 0.418283 0.750000 K\n0.865664 0.581717 0.250000 K\n0.365664 0.918283 0.250000 K\n0.443224 0.711208 0.955681 K\n0.943225 0.788793 0.544318 K\n0.056776 0.211207 0.044318 K\n0.556776 0.288793 0.455681 K\n0.443224 0.711208 0.544318 K\n0.056776 0.211207 0.455681 K\n0.943225 0.788793 0.955681 K\n0.634336 0.081717 0.750000 K\n0.786909 0.013422 0.250000 Ta\n0.286909 0.486578 0.250000 Ta\n0.713092 0.513422 0.750000 Ta\n0.213092 0.986578 0.750000 Ta\n0.512545 0.586265 0.250000 S\n0.487455 0.413736 0.750000 S\n0.309049 0.244467 0.250000 S\n0.809049 0.255533 0.250000 S\n0.190951 0.744467 0.750000 S\n0.690951 0.755533 0.750000 S\n0.166443 0.552256 0.427561 S\n0.666443 0.947744 0.072439 S\n0.833557 0.447744 0.927561 S\n0.833557 0.447744 0.572439 S\n0.333557 0.052256 0.927561 S\n0.666443 0.947744 0.427561 S\n0.166443 0.552256 0.072439 S\n0.012545 0.913736 0.250000 S\n0.333557 0.052256 0.572439 S\n0.987456 0.086265 0.750000 S\n",
"nsites": 32,
"nelements": 3,
"elements": [
"K",
"Ta",
"S"
],
"chemical_system": "K-S-Ta",
"density": 3.0574263942734947,
"density_atomic": 0.034536238410482804,
"volume": 926.5629805904692,
"volume_molar": 17.43716466287798,
"formula_full": "K12 Ta4 S16",
"formula_reduced": "K3TaS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.4998204,
"spacegroup": 62
},
{
"id": "jvasp-43938",
"created_at": "2022-09-04T14:37:14.396732Z",
"updated_at": "2022-09-04T14:37:14.396755Z",
"structure_string": "Li8 V4 F16\n1.0\n5.450851 0.000000 0.000000\n0.000000 5.878389 0.000000\n0.000000 0.000000 9.548055\nLi V F\n8 4 16\ndirect\n0.201325 0.053178 0.786160 Li\n0.854152 0.865498 0.918155 Li\n0.354152 0.634502 0.418155 Li\n0.701325 0.446822 0.286160 Li\n0.201325 0.553178 0.713840 Li\n0.854152 0.365498 0.581845 Li\n0.354152 0.134502 0.081845 Li\n0.701325 0.946822 0.213840 Li\n0.164697 0.139326 0.385779 V\n0.664697 0.360674 0.885779 V\n0.164697 0.639326 0.114221 V\n0.664697 0.860674 0.614221 V\n0.698466 0.082343 0.024224 F\n0.984314 0.311939 0.766233 F\n0.484314 0.188061 0.266233 F\n0.198466 0.417657 0.524224 F\n0.027182 0.382661 0.246889 F\n0.825864 0.600649 0.015476 F\n0.325864 0.399352 0.984524 F\n0.027182 0.882661 0.253112 F\n0.698466 0.582343 0.475777 F\n0.984314 0.811939 0.733767 F\n0.484314 0.688061 0.233767 F\n0.198466 0.917657 0.975777 F\n0.527182 0.117339 0.746889 F\n0.825864 0.100648 0.484524 F\n0.527182 0.617339 0.753112 F\n0.325864 0.899352 0.515476 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.057222025768032,
"density_atomic": 0.09152094308581027,
"volume": 305.94090331594515,
"volume_molar": 6.580068514322044,
"formula_full": "Li8 V4 F16",
"formula_reduced": "Li2VF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.4322293328571428,
"spacegroup": 33
},
{
"id": "jvasp-112777",
"created_at": "2022-09-04T14:38:43.261770Z",
"updated_at": "2022-09-04T14:38:43.261790Z",
"structure_string": "Cr2 P4 O14\n1.0\n4.753131 -0.034470 -0.000466\n-1.981992 6.649283 0.000125\n0.000762 0.000079 7.782821\nCr P O\n2 4 14\ndirect\n0.218290 0.727989 0.505432 Cr\n0.781710 0.272011 0.005431 Cr\n0.604492 0.492655 0.687060 P\n0.395507 0.507345 0.187060 P\n0.220339 0.101024 0.772009 P\n0.779662 0.898976 0.272009 P\n0.405841 0.631291 0.687797 O\n0.594158 0.368708 0.187797 O\n0.590565 0.732236 0.139264 O\n0.409436 0.267763 0.639263 O\n0.589774 0.903900 0.431330 O\n0.410226 0.096100 0.931329 O\n0.865973 0.092827 0.169768 O\n0.945650 0.161710 0.818979 O\n0.156785 0.455967 0.050073 O\n0.134031 0.907173 0.669769 O\n0.724988 0.484276 0.867888 O\n0.275010 0.515724 0.367888 O\n0.054349 0.838289 0.318982 O\n0.843215 0.544032 0.550072 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.0571678131056155,
"density_atomic": 0.08148509267610478,
"volume": 245.44366758589857,
"volume_molar": 7.390481574264653,
"formula_full": "Cr2 P4 O14",
"formula_reduced": "CrP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 3.0948962900000003,
"spacegroup": 4
},
{
"id": "jvasp-11396",
"created_at": "2022-09-04T14:38:34.536480Z",
"updated_at": "2022-09-04T14:38:34.536516Z",
"structure_string": "Sr4 Mg4 Si4\n1.0\n4.597113 0.000000 0.000000\n0.000000 7.802468 0.000000\n0.000000 0.000000 8.481038\nSr Mg Si\n4 4 4\ndirect\n0.250000 0.014401 0.184141 Sr\n0.250000 0.514401 0.315859 Sr\n0.749999 0.485599 0.684141 Sr\n0.749999 0.985599 0.815859 Sr\n0.749999 0.355198 0.065163 Mg\n0.250000 0.644802 0.934837 Mg\n0.749999 0.855198 0.434837 Mg\n0.250000 0.144802 0.565163 Mg\n0.749999 0.218843 0.391249 Si\n0.250000 0.281157 0.891249 Si\n0.250000 0.781158 0.608752 Si\n0.749999 0.718843 0.108752 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Si"
],
"chemical_system": "Mg-Si-Sr",
"density": 3.05705682076497,
"density_atomic": 0.03944709823690406,
"volume": 304.2048854375201,
"volume_molar": 15.266371999870168,
"formula_full": "Sr4 Mg4 Si4",
"formula_reduced": "SrMgSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5156258083333332,
"spacegroup": 62
},
{
"id": "jvasp-66740",
"created_at": "2022-09-04T14:36:03.865766Z",
"updated_at": "2022-09-04T14:36:03.865794Z",
"structure_string": "Li1 Be1 V1\n1.0\n-1.269559 1.269559 5.636019\n1.269559 -1.269559 5.636019\n1.269559 1.269559 -5.636019\nLi Be V\n1 1 1\ndirect\n0.349367 0.349367 0.000000 Li\n0.005833 0.005833 0.000000 Be\n0.644802 0.644802 0.000000 V\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"V"
],
"chemical_system": "Be-Li-V",
"density": 3.057049521885581,
"density_atomic": 0.08256253854729934,
"volume": 36.33609204350381,
"volume_molar": 7.2940353651432,
"formula_full": "Li1 Be1 V1",
"formula_reduced": "LiBeV",
"formula_anonymous": "ABC",
"energy_above_hull": 2.104873433333333,
"spacegroup": 107
},
{
"id": "jvasp-88283",
"created_at": "2022-09-04T14:36:04.100034Z",
"updated_at": "2022-09-04T14:36:04.100064Z",
"structure_string": "Na8 Zn4 P8 O28\n1.0\n7.771738 0.000000 0.000000\n0.000000 7.771738 0.000000\n0.000000 0.000000 10.264515\nNa Zn P O\n8 4 8 28\ndirect\n0.356750 0.356750 0.500000 Na\n0.806126 0.193875 0.500000 Na\n0.643251 0.643251 0.500000 Na\n0.143250 0.856750 0.000000 Na\n0.193875 0.806126 0.500000 Na\n0.856750 0.143250 0.000000 Na\n0.693875 0.693875 0.000000 Na\n0.306126 0.306126 0.000000 Na\n0.500000 0.000000 0.750000 Zn\n0.500000 0.000000 0.250000 Zn\n0.000000 0.500000 0.250000 Zn\n0.000000 0.500000 0.750000 Zn\n0.638731 0.361269 0.791122 P\n0.361269 0.638731 0.791122 P\n0.361269 0.638731 0.208878 P\n0.861269 0.861269 0.291122 P\n0.138731 0.138731 0.708877 P\n0.138731 0.138731 0.291122 P\n0.638731 0.361269 0.208878 P\n0.861269 0.861269 0.708877 P\n0.136318 0.136318 0.143971 O\n0.636319 0.363682 0.356028 O\n0.636319 0.363682 0.643971 O\n0.363682 0.636319 0.643971 O\n0.080863 0.307750 0.355858 O\n0.500000 0.500000 0.848670 O\n0.919137 0.692250 0.355858 O\n0.307750 0.080863 0.644142 O\n0.807750 0.419137 0.855858 O\n0.192250 0.580863 0.855858 O\n0.419137 0.807750 0.144142 O\n0.580863 0.192250 0.144142 O\n0.692250 0.919137 0.644142 O\n0.919137 0.692250 0.644142 O\n0.080863 0.307750 0.644142 O\n0.500000 0.500000 0.151330 O\n0.692250 0.919137 0.355858 O\n0.807750 0.419137 0.144142 O\n0.580863 0.192250 0.855858 O\n0.419137 0.807750 0.855858 O\n0.307750 0.080863 0.355858 O\n0.863682 0.863682 0.856028 O\n0.136318 0.136318 0.856028 O\n0.863682 0.863682 0.143971 O\n0.363682 0.636319 0.356028 O\n0.000000 0.000000 0.348670 O\n0.192250 0.580863 0.144142 O\n0.000000 0.000000 0.651330 O\n",
"nsites": 48,
"nelements": 4,
"elements": [
"Na",
"Zn",
"P",
"O"
],
"chemical_system": "Na-O-P-Zn",
"density": 3.0569238750884495,
"density_atomic": 0.07742237705770984,
"volume": 619.9757980076134,
"volume_molar": 7.778294840406616,
"formula_full": "Na8 Zn4 P8 O28",
"formula_reduced": "Na2ZnP2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 1.8289769916666665,
"spacegroup": 136
},
{
"id": "jvasp-112413",
"created_at": "2022-09-04T14:38:40.058557Z",
"updated_at": "2022-09-04T14:38:40.058575Z",
"structure_string": "Na6 Fe2 P2 C2 O14\n1.0\n6.571960 -0.000000 0.000000\n0.000000 5.134813 0.050044\n-0.000000 -0.009149 9.008351\nNa Fe P C O\n6 2 2 2 14\ndirect\n0.499873 0.248403 0.262696 Na\n-0.000127 0.751596 0.737304 Na\n0.500127 0.751596 0.737304 Na\n0.000127 0.248403 0.262696 Na\n0.750000 0.234228 0.917761 Na\n0.250000 0.765771 0.082238 Na\n0.250000 0.221353 0.645180 Fe\n0.750000 0.778646 0.354820 Fe\n0.250000 0.701141 0.412867 P\n0.750000 0.298858 0.587132 P\n0.250000 0.272226 0.941203 C\n0.750000 0.727773 0.058797 C\n0.250000 0.837408 0.564621 O\n0.750000 0.162591 0.435379 O\n0.561387 0.222201 0.683239 O\n0.061387 0.777799 0.316760 O\n0.438613 0.777799 0.316760 O\n0.938613 0.222201 0.683239 O\n0.250000 0.047127 0.875297 O\n0.250000 0.283938 0.084829 O\n0.750000 0.516301 0.139293 O\n0.250000 0.483698 0.860707 O\n0.750000 0.952872 0.124703 O\n0.250000 0.399646 0.437217 O\n0.750000 0.716061 0.915170 O\n0.750000 0.600353 0.562782 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Na",
"Fe",
"P",
"C",
"O"
],
"chemical_system": "C-Fe-Na-O-P",
"density": 3.0566747742998666,
"density_atomic": 0.08552719051996469,
"volume": 303.99689083591255,
"volume_molar": 7.04120025852392,
"formula_full": "Na6 Fe2 P2 C2 O14",
"formula_reduced": "Na3FePCO7",
"formula_anonymous": "ABCD3E7",
"energy_above_hull": 2.41953403846154,
"spacegroup": 11
},
{
"id": "jvasp-59024",
"created_at": "2022-09-04T14:38:05.940862Z",
"updated_at": "2022-09-04T14:38:05.940889Z",
"structure_string": "Ca12 Al4 N12\n1.0\n0.000000 6.875554 -0.004313\n6.113921 0.000000 0.000000\n0.000000 -0.642611 -9.782256\nCa Al N\n12 4 12\ndirect\n0.646186 0.782382 0.694557 Ca\n0.353813 0.282382 0.805443 Ca\n0.353813 0.217618 0.305443 Ca\n0.646186 0.717618 0.194557 Ca\n0.372726 0.793528 0.923549 Ca\n0.627273 0.293528 0.576452 Ca\n0.627273 0.206472 0.076451 Ca\n0.372726 0.706472 0.423548 Ca\n0.075924 0.640989 0.650090 Ca\n0.924075 0.140989 0.849910 Ca\n0.924075 0.359011 0.349910 Ca\n0.075924 0.859011 0.150090 Ca\n0.839853 0.591389 0.939264 Al\n0.160146 0.091390 0.560736 Al\n0.160146 0.408610 0.060736 Al\n0.839853 0.908610 0.439264 Al\n0.339358 0.568418 0.177252 N\n0.660641 0.068418 0.322748 N\n0.660641 0.431582 0.822748 N\n0.339359 0.931582 0.677252 N\n0.740761 0.622731 0.470932 N\n0.259239 0.122731 0.029068 N\n0.259239 0.377269 0.529068 N\n0.740761 0.877269 0.970932 N\n0.104143 0.538111 0.882213 N\n0.895856 0.038111 0.617787 N\n0.895856 0.461889 0.117787 N\n0.104143 0.961889 0.382213 N\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ca",
"Al",
"N"
],
"chemical_system": "Al-Ca-N",
"density": 3.0565223707496734,
"density_atomic": 0.06808847248170043,
"volume": 411.22966897994854,
"volume_molar": 8.844581968876629,
"formula_full": "Ca12 Al4 N12",
"formula_reduced": "Ca3AlN3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.402783401428571,
"spacegroup": 14
},
{
"id": "jvasp-100196",
"created_at": "2022-09-04T14:36:38.028389Z",
"updated_at": "2022-09-04T14:36:38.028419Z",
"structure_string": "Li6 Eu2\n1.0\n6.535972 -0.000000 -0.000000\n-3.267986 5.660319 0.000000\n0.000000 -0.000000 5.074834\nLi Eu\n6 2\ndirect\n0.150325 0.300650 0.250000 Li\n0.699349 0.849675 0.250000 Li\n0.150325 0.849675 0.250000 Li\n0.849674 0.699350 0.749999 Li\n0.300650 0.150326 0.749999 Li\n0.849674 0.150326 0.749999 Li\n0.333333 0.666667 0.749999 Eu\n0.666667 0.333333 0.250000 Eu\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Eu"
],
"chemical_system": "Eu-Li",
"density": 3.056449510193105,
"density_atomic": 0.042610541724960274,
"volume": 187.7469676785119,
"volume_molar": 14.132983332789616,
"formula_full": "Li6 Eu2",
"formula_reduced": "Li3Eu",
"formula_anonymous": "AB3",
"energy_above_hull": 0.952885,
"spacegroup": 194
}
]
}