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_atomic&page=230",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=228",
"results": [
{
"id": "jvasp-99343",
"created_at": "2022-09-04T14:36:49.591805Z",
"updated_at": "2022-09-04T14:36:49.591822Z",
"structure_string": "Na6 Y2 H24 C6 O30\n1.0\n11.271902 -0.000000 0.000000\n-5.635951 9.761753 -0.000000\n0.000000 0.000000 5.835772\nNa Y H C O\n6 2 24 6 30\ndirect\n0.628704 0.638131 0.182521 Na\n0.009427 0.371296 0.182521 Na\n0.361868 -0.009427 0.182521 Na\n0.371296 0.361868 0.682521 Na\n0.638131 0.009427 0.682521 Na\n-0.009427 0.628704 0.682521 Na\n0.333333 0.666667 0.915196 Y\n0.666667 0.333333 0.415196 Y\n-0.023187 0.856996 0.429859 H\n0.023187 0.143003 0.929859 H\n0.775027 0.878537 0.532999 H\n0.504916 0.776091 0.358143 H\n0.495084 0.223909 0.858143 H\n0.121462 0.896489 0.532999 H\n0.880183 0.023187 0.429859 H\n0.728824 0.504916 0.858143 H\n0.776091 0.271175 0.858143 H\n0.878537 0.103510 0.032999 H\n0.224973 0.121462 0.032999 H\n0.856996 0.880183 0.929859 H\n0.143004 0.119817 0.429859 H\n0.896489 0.775027 0.032999 H\n0.271175 0.495084 0.358143 H\n0.223909 0.728824 0.358143 H\n0.413899 0.122809 0.646014 H\n0.586101 0.877190 0.146014 H\n0.708910 0.586101 0.646014 H\n0.291090 0.413899 0.146014 H\n0.103510 0.224973 0.532999 H\n0.119817 -0.023187 0.929859 H\n0.122809 0.708910 0.146014 H\n0.877191 0.291090 0.646014 H\n0.682121 0.116801 0.184292 C\n0.434680 0.317879 0.184292 C\n0.317879 0.883199 0.684292 C\n0.565320 0.682121 0.684292 C\n0.116801 0.434680 0.684292 C\n0.883199 0.565320 0.184292 C\n0.179090 0.021053 0.062011 O\n0.021053 0.841963 0.562011 O\n0.158037 0.179090 0.562011 O\n0.779715 0.267738 0.686459 O\n0.083929 0.493823 0.841294 O\n0.506177 0.590106 0.841294 O\n0.486487 0.238278 0.143007 O\n0.220285 0.732262 0.186459 O\n0.302027 0.972125 0.570901 O\n0.751791 0.513512 0.143007 O\n0.238278 0.751791 0.643007 O\n0.820910 0.978947 0.562011 O\n0.841963 0.820910 0.062011 O\n0.409893 0.916070 0.841294 O\n0.027875 0.329901 0.570901 O\n0.697973 0.027875 0.070901 O\n0.732262 0.511976 0.686459 O\n0.761721 0.248209 0.143007 O\n0.972125 0.670098 0.070901 O\n0.978947 0.158037 0.062011 O\n0.488023 0.220285 0.686459 O\n0.590106 0.083929 0.341294 O\n0.513512 0.761721 0.643007 O\n0.511976 0.779714 0.186459 O\n0.493823 0.409893 0.341294 O\n0.916070 0.506177 0.341294 O\n0.267738 0.488023 0.186459 O\n0.670098 0.697973 0.570901 O\n0.248209 0.486487 0.643007 O\n0.329901 0.302027 0.070901 O\n",
"nsites": 68,
"nelements": 5,
"elements": [
"Na",
"Y",
"H",
"C",
"O"
],
"chemical_system": "C-H-Na-O-Y",
"density": 2.306663929782445,
"density_atomic": 0.1058974683961114,
"volume": 642.1305535430249,
"volume_molar": 5.686765558430608,
"formula_full": "Na6 Y2 H24 C6 O30",
"formula_reduced": "Na3YH12(CO5)3",
"formula_anonymous": "AB3C3D12E15",
"energy_above_hull": 3.219055733823529,
"spacegroup": 173
},
{
"id": "jvasp-117319",
"created_at": "2022-09-04T14:38:26.604712Z",
"updated_at": "2022-09-04T14:38:26.604733Z",
"structure_string": "Li4 V3 Cr3 Fe2 O16\n1.0\n5.729414 -0.000516 0.018714\n-2.848486 4.970661 -0.037331\n-0.000828 0.036475 9.284559\nLi V Cr Fe O\n4 3 3 2 16\ndirect\n0.331846 0.668164 0.108679 Li\n-0.001849 0.001847 0.004236 Li\n0.002027 0.997801 0.504556 Li\n0.665050 0.335047 0.612974 Li\n0.824097 0.651695 0.288050 V\n0.173017 0.827088 0.788648 V\n0.348248 0.175882 0.288076 V\n0.168425 0.343097 0.787997 Cr\n0.828656 0.171302 0.289118 Cr\n0.656989 0.831650 0.787993 Cr\n0.333897 0.666118 0.514571 Fe\n0.667098 0.332938 0.011414 Fe\n0.829674 0.170376 0.899317 O\n0.835424 0.661763 0.896301 O\n0.666167 0.333771 0.407521 O\n0.521346 0.045259 0.155417 O\n0.954750 0.478661 0.155398 O\n0.171199 0.828772 0.394121 O\n0.043065 0.525454 0.653437 O\n0.476755 0.523330 0.657637 O\n0.176869 0.338310 0.397984 O\n0.001639 0.998366 0.193078 O\n0.000867 0.999254 0.692678 O\n0.330113 0.669951 0.903982 O\n0.520322 0.479715 0.151285 O\n0.661646 0.823067 0.397972 O\n0.474628 0.956992 0.653417 O\n0.338310 0.164646 0.896303 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O-V",
"density": 4.4229031596329245,
"density_atomic": 0.10589734422625131,
"volume": 264.4070085476135,
"volume_molar": 5.686772226443757,
"formula_full": "Li4 V3 Cr3 Fe2 O16",
"formula_reduced": "Li4V3Cr3(FeO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.3898164928571424,
"spacegroup": 8
},
{
"id": "jvasp-37218",
"created_at": "2022-09-04T14:37:59.601527Z",
"updated_at": "2022-09-04T14:37:59.601550Z",
"structure_string": "Sm1 Be1 O3\n1.0\n3.614515 0.000000 -0.000000\n0.000000 3.614515 0.000000\n0.000000 0.000000 3.614515\nSm Be O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500001 0.500001 0.500001 Be\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Be",
"O"
],
"chemical_system": "Be-O-Sm",
"density": 7.291984402238153,
"density_atomic": 0.10588145732686678,
"volume": 47.22262165852604,
"volume_molar": 5.687625493677369,
"formula_full": "Sm1 Be1 O3",
"formula_reduced": "SmBeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7055590949999997,
"spacegroup": 221
},
{
"id": "jvasp-60915",
"created_at": "2022-09-04T14:35:57.492777Z",
"updated_at": "2022-09-04T14:35:57.492793Z",
"structure_string": "Ca4 Mg1 B4 H6 C2 O18\n1.0\n4.304910 8.728761 -0.016549\n-4.304910 8.728761 -0.016549\n0.000000 0.899591 4.396837\nCa Mg B H C O\n4 1 4 6 2 18\ndirect\n0.075858 0.610900 0.145538 Ca\n0.389100 0.924142 0.854462 Ca\n0.924142 0.389100 0.854462 Ca\n0.610900 0.075858 0.145538 Ca\n0.000000 0.000000 0.000000 Mg\n0.228260 0.771740 0.500000 B\n0.771740 0.228260 0.500000 B\n0.901144 0.901144 0.614286 B\n0.098856 0.098856 0.385714 B\n0.218387 0.218387 0.318633 H\n0.781613 0.781613 0.681367 H\n0.593853 0.389748 0.211220 H\n0.610252 0.406147 0.788781 H\n0.406147 0.610252 0.788781 H\n0.389748 0.593853 0.211220 H\n0.309545 0.309545 0.746030 C\n0.690455 0.690455 0.253971 C\n0.179788 0.179788 0.186611 O\n0.820212 0.820212 0.813390 O\n0.418795 0.154909 0.649318 O\n0.845091 0.581204 0.350682 O\n0.581204 0.845091 0.350682 O\n0.154909 0.418795 0.649318 O\n0.628315 0.280548 0.326627 O\n0.719452 0.371685 0.673373 O\n0.897827 0.897827 0.303974 O\n0.280548 0.628315 0.326627 O\n0.805816 0.080806 0.718310 O\n0.919194 0.194183 0.281690 O\n0.194183 0.919194 0.281690 O\n0.080806 0.805816 0.718310 O\n0.102173 0.102173 0.696026 O\n0.647933 0.647933 0.048305 O\n0.371685 0.719452 0.673373 O\n0.352067 0.352067 0.951695 O\n",
"nsites": 35,
"nelements": 6,
"elements": [
"Ca",
"Mg",
"B",
"H",
"C",
"O"
],
"chemical_system": "B-C-Ca-H-Mg-O",
"density": 2.7423445957087433,
"density_atomic": 0.10587966840519628,
"volume": 330.56393665738284,
"volume_molar": 5.687721590658524,
"formula_full": "Ca4 Mg1 B4 H6 C2 O18",
"formula_reduced": "Ca4MgB4H6(CO9)2",
"formula_anonymous": "AB2C4D4E6F18",
"energy_above_hull": 3.119450116095238,
"spacegroup": 12
},
{
"id": "jvasp-36617",
"created_at": "2022-09-04T14:37:28.220721Z",
"updated_at": "2022-09-04T14:37:28.220748Z",
"structure_string": "Cd1 Si1 O3\n1.0\n3.614654 -0.000000 0.000000\n-0.000000 3.614654 -0.000000\n0.000000 0.000000 3.614654\nCd Si O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.499999 0.499999 0.499999 Si\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cd",
"Si",
"O"
],
"chemical_system": "Cd-O-Si",
"density": 6.627474172736721,
"density_atomic": 0.10586924291578938,
"volume": 47.22806985572859,
"volume_molar": 5.6882816898862085,
"formula_full": "Cd1 Si1 O3",
"formula_reduced": "CdSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4164297699999997,
"spacegroup": 221
},
{
"id": "jvasp-116",
"created_at": "2022-09-04T14:37:03.925401Z",
"updated_at": "2022-09-04T14:37:03.925427Z",
"structure_string": "Mg1 O1\n1.0\n2.588985 0.000000 1.494751\n0.862995 2.440918 1.494751\n0.000000 0.000000 2.989502\nMg O\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.499998 0.500000 0.500000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.542582600394026,
"density_atomic": 0.10586403013503343,
"volume": 18.89215815276376,
"volume_molar": 5.6885617828062465,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.01485,
"spacegroup": 225
},
{
"id": "jvasp-79451",
"created_at": "2022-09-04T14:37:15.186511Z",
"updated_at": "2022-09-04T14:37:15.186532Z",
"structure_string": "Mn1 H1 O2\n1.0\n-0.700421 2.376961 -1.508519\n-2.131023 -2.381137 0.027000\n-0.712039 2.386217 4.092631\nMn H O\n1 1 2\ndirect\n0.075216 0.053229 0.019451 Mn\n0.581306 0.065530 0.554514 H\n0.651699 0.206370 0.782373 O\n0.487007 0.876673 0.228447 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"H",
"O"
],
"chemical_system": "H-Mn-O",
"density": 3.8649810508935705,
"density_atomic": 0.10586396876748205,
"volume": 37.78433820845633,
"volume_molar": 5.688565080369256,
"formula_full": "Mn1 H1 O2",
"formula_reduced": "MnHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.541481060344827,
"spacegroup": 8
},
{
"id": "jvasp-32186",
"created_at": "2022-09-04T14:38:03.987646Z",
"updated_at": "2022-09-04T14:38:03.987669Z",
"structure_string": "Co2 H18 C6 N12\n1.0\n7.113669 0.002346 -0.952823\n-1.089265 7.029779 -0.952823\n0.002010 0.002346 7.177197\nCo H C N\n2 18 6 12\ndirect\n0.000000 0.000000 0.000000 Co\n0.500001 0.500001 0.500001 Co\n0.592533 0.265369 0.238305 H\n0.199310 0.447710 0.656865 H\n0.734632 0.761696 0.407468 H\n0.407468 0.734632 0.761696 H\n0.761696 0.407468 0.734632 H\n0.265369 0.238305 0.592533 H\n0.552291 0.343136 0.800691 H\n0.238305 0.592533 0.265369 H\n0.447710 0.656865 0.199311 H\n0.567438 0.848400 0.655453 H\n0.655452 0.567438 0.848400 H\n0.151602 0.344549 0.432564 H\n0.432563 0.151602 0.344549 H\n0.344549 0.432564 0.151602 H\n0.800691 0.552291 0.343136 H\n0.343136 0.800691 0.552291 H\n0.656865 0.199311 0.447710 H\n0.848399 0.655452 0.567438 H\n0.235940 0.114072 0.950919 C\n0.885929 0.049082 0.764061 C\n0.950919 0.235941 0.114072 C\n0.114072 0.950919 0.235941 C\n0.049082 0.764061 0.885929 C\n0.764061 0.885929 0.049082 C\n0.448884 0.745143 0.631081 N\n0.745143 0.631081 0.448885 N\n0.631081 0.448885 0.745143 N\n0.811676 0.078038 0.617504 N\n0.078038 0.617504 0.811677 N\n0.617504 0.811677 0.078038 N\n0.368920 0.551117 0.254859 N\n0.921963 0.382498 0.188325 N\n0.382497 0.188325 0.921964 N\n0.254858 0.368920 0.551117 N\n0.188325 0.921963 0.382498 N\n0.551117 0.254859 0.368920 N\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Co",
"H",
"C",
"N"
],
"chemical_system": "C-Co-H-N",
"density": 1.7400583999455963,
"density_atomic": 0.10586020799601241,
"volume": 358.9639650191449,
"volume_molar": 5.688767171350017,
"formula_full": "Co2 H18 C6 N12",
"formula_reduced": "CoH9(CN2)3",
"formula_anonymous": "AB3C6D9",
"energy_above_hull": 5.00114107368421,
"spacegroup": 148
},
{
"id": "jvasp-52957",
"created_at": "2022-09-04T14:37:05.313097Z",
"updated_at": "2022-09-04T14:37:05.313115Z",
"structure_string": "As2 H12 N2 O8\n1.0\n-3.823232 3.823232 3.877755\n3.823232 -3.823232 3.877755\n3.823232 3.823232 -3.877755\nAs H N O\n2 12 2 8\ndirect\n0.749999 0.250000 0.500000 As\n0.000000 0.000000 0.000000 As\n0.874999 0.966420 0.591420 H\n0.375000 0.283579 0.408579 H\n0.716420 0.125000 0.091420 H\n0.594384 0.686567 0.130075 H\n0.193506 0.563432 0.407816 H\n0.033580 0.625000 0.908579 H\n0.155615 0.785689 0.592183 H\n0.535689 0.405615 0.092184 H\n0.436568 0.844384 0.630075 H\n0.313432 0.443506 0.907816 H\n0.214310 0.806494 0.369925 H\n0.556494 0.464310 0.869925 H\n0.250000 0.749999 0.500000 N\n0.499999 0.499999 0.000000 N\n0.717328 0.962904 0.428148 O\n0.710818 0.282671 0.245577 O\n0.712905 0.967328 0.928147 O\n0.037095 0.465241 0.754422 O\n0.039181 0.784758 0.071852 O\n0.534758 0.289181 0.571852 O\n0.032671 0.960818 0.745577 O\n0.215241 0.287094 0.254422 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"As",
"H",
"N",
"O"
],
"chemical_system": "As-H-N-O",
"density": 2.328639582665734,
"density_atomic": 0.10585456184192836,
"volume": 226.72617582451457,
"volume_molar": 5.6890706032989,
"formula_full": "As2 H12 N2 O8",
"formula_reduced": "AsH6NO4",
"formula_anonymous": "ABC4D6",
"energy_above_hull": 3.236884916666667,
"spacegroup": 122
},
{
"id": "jvasp-44466",
"created_at": "2022-09-04T14:38:07.525715Z",
"updated_at": "2022-09-04T14:38:07.525726Z",
"structure_string": "Mn4 Zn4 O12\n1.0\n5.038102 -0.000000 0.000000\n-0.000000 5.119484 0.000000\n0.000000 0.000000 7.325365\nMn Zn O\n4 4 12\ndirect\n0.500000 0.000000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.996233 0.043355 0.250000 Zn\n0.496233 0.456644 0.750000 Zn\n0.503766 0.543355 0.250000 Zn\n0.003766 0.956644 0.750000 Zn\n0.816923 0.812267 0.061313 O\n0.316923 0.687732 0.561313 O\n0.316923 0.687732 0.938687 O\n0.885291 0.559960 0.750000 O\n0.114709 0.440039 0.250000 O\n0.183077 0.187732 0.561313 O\n0.683077 0.312267 0.061313 O\n0.183077 0.187732 0.938687 O\n0.816923 0.812267 0.438687 O\n0.614709 0.059961 0.750000 O\n0.683077 0.312267 0.438687 O\n0.385291 0.940039 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.91817124927003,
"density_atomic": 0.10585407481276232,
"volume": 188.93934915001208,
"volume_molar": 5.6890967784207955,
"formula_full": "Mn4 Zn4 O12",
"formula_reduced": "MnZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7718256282758618,
"spacegroup": 62
},
{
"id": "jvasp-19372",
"created_at": "2022-09-04T14:38:36.751192Z",
"updated_at": "2022-09-04T14:38:36.751216Z",
"structure_string": "Mn4 Zn4 O12\n1.0\n5.038018 0.000000 0.000000\n0.000000 5.119533 0.000000\n0.000000 0.000000 7.325637\nMn Zn O\n4 4 12\ndirect\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.996211 0.043360 0.250000 Zn\n0.496211 0.456639 0.750000 Zn\n0.503790 0.543360 0.250000 Zn\n0.003790 0.956639 0.750000 Zn\n0.183067 0.187731 0.938688 O\n0.683067 0.312269 0.061312 O\n0.316933 0.687731 0.938688 O\n0.816933 0.812269 0.061312 O\n0.183067 0.187731 0.561312 O\n0.385297 0.940066 0.250000 O\n0.114704 0.440066 0.250000 O\n0.614704 0.059933 0.750000 O\n0.316933 0.687731 0.561312 O\n0.885297 0.559933 0.750000 O\n0.683067 0.312269 0.438688 O\n0.816933 0.812269 0.438688 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.917993536872072,
"density_atomic": 0.10585089619884999,
"volume": 188.9450228406974,
"volume_molar": 5.689267617240473,
"formula_full": "Mn4 Zn4 O12",
"formula_reduced": "MnZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7718256282758618,
"spacegroup": 62
},
{
"id": "jvasp-88722",
"created_at": "2022-09-04T14:36:16.442612Z",
"updated_at": "2022-09-04T14:36:16.442625Z",
"structure_string": "Sr2 Al24 O38\n1.0\n5.622457 -0.000000 -0.000000\n-2.811228 4.869190 0.000000\n-0.000000 -0.000000 22.085424\nSr Al O\n2 24 38\ndirect\n0.666667 0.333333 0.250000 Sr\n0.333333 0.666667 0.750000 Sr\n0.000000 0.000000 0.500000 Al\n0.333333 0.666667 0.309347 Al\n0.666667 0.333333 0.809347 Al\n0.666667 0.333333 0.690653 Al\n0.333333 0.666667 0.190653 Al\n0.168151 0.831849 0.608943 Al\n0.168151 0.336301 0.608943 Al\n0.663699 0.831849 0.608943 Al\n0.336301 0.168151 0.108943 Al\n0.000000 0.000000 0.000000 Al\n0.831849 0.663699 0.108943 Al\n0.831849 0.663699 0.391057 Al\n0.663699 0.831849 0.891057 Al\n0.000000 0.000000 0.250000 Al\n0.000000 0.000000 0.750000 Al\n0.168151 0.831849 0.891057 Al\n0.666667 0.333333 0.528455 Al\n0.666667 0.333333 0.971545 Al\n0.333333 0.666667 0.028455 Al\n0.168151 0.336301 0.891057 Al\n0.831849 0.168151 0.391057 Al\n0.336301 0.168151 0.391057 Al\n0.333333 0.666667 0.471545 Al\n0.831849 0.168151 0.108943 Al\n0.666667 0.333333 0.054333 O\n0.845305 0.690609 0.552104 O\n0.363514 0.181757 0.750000 O\n0.818243 0.181757 0.750000 O\n0.181757 0.363514 0.250000 O\n0.333333 0.666667 0.554333 O\n0.502400 0.497600 0.351643 O\n0.000000 0.000000 0.350246 O\n0.502401 0.004800 0.351643 O\n0.995201 0.497600 0.351643 O\n0.004799 0.502400 0.851643 O\n0.497600 0.995200 0.648357 O\n0.497600 0.502400 0.851643 O\n0.497600 0.995200 0.851643 O\n0.502400 0.497600 0.148357 O\n0.995201 0.497600 0.148357 O\n0.004799 0.502400 0.648357 O\n0.497600 0.502400 0.648357 O\n0.502401 0.004800 0.148357 O\n0.154695 0.845304 0.447896 O\n0.154696 0.309391 0.447896 O\n0.333333 0.666667 0.945667 O\n0.690609 0.845304 0.447896 O\n0.309392 0.154696 0.947896 O\n0.845305 0.154696 0.947896 O\n0.845305 0.690609 0.947896 O\n0.154695 0.845304 0.052104 O\n0.690609 0.845304 0.052104 O\n0.309392 0.154696 0.552104 O\n0.845305 0.154696 0.552104 O\n0.154696 0.309391 0.052104 O\n0.818243 0.636486 0.750000 O\n0.181757 0.818243 0.250000 O\n0.000000 0.000000 0.149754 O\n0.000000 0.000000 0.649754 O\n0.000000 0.000000 0.850246 O\n0.636486 0.818243 0.250000 O\n0.666667 0.333333 0.445667 O\n",
"nsites": 64,
"nelements": 3,
"elements": [
"Sr",
"Al",
"O"
],
"chemical_system": "Al-O-Sr",
"density": 3.9294482171366734,
"density_atomic": 0.10585012337262295,
"volume": 604.628487533279,
"volume_molar": 5.689309155361424,
"formula_full": "Sr2 Al24 O38",
"formula_reduced": "SrAl12O19",
"formula_anonymous": "AB12C19",
"energy_above_hull": 2.5348964503125,
"spacegroup": 194
}
]
}