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=581",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=579",
"results": [
{
"id": "jvasp-28435",
"created_at": "2022-09-04T14:37:05.025289Z",
"updated_at": "2022-09-04T14:37:05.025320Z",
"structure_string": "Mn1 Al2 S4\n1.0\n-1.782797 -3.087893 -0.000000\n1.782797 -3.087893 -0.000000\n0.000000 -2.058596 11.935906\nMn Al S\n1 2 4\ndirect\n0.936718 0.936718 0.189843 Mn\n0.700053 0.700053 0.899841 Al\n0.468707 0.468707 0.593878 Al\n0.000149 0.000149 0.999555 S\n0.829451 0.829451 0.511645 S\n0.585747 0.585747 0.242760 S\n0.406374 0.406374 0.780879 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Mn",
"Al",
"S"
],
"chemical_system": "Al-Mn-S",
"density": 2.9966986415884116,
"density_atomic": 0.05326580769918407,
"volume": 131.4163870288449,
"volume_molar": 11.305828297976316,
"formula_full": "Mn1 Al2 S4",
"formula_reduced": "Mn(AlS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.349643263054187,
"spacegroup": 160
},
{
"id": "jvasp-11481",
"created_at": "2022-09-04T14:38:14.919227Z",
"updated_at": "2022-09-04T14:38:14.919255Z",
"structure_string": "Rb2 Li2 Cr2 O8\n1.0\n2.690078 -4.659352 -0.000000\n2.690078 4.659352 -0.000000\n0.000000 0.000000 9.213122\nRb Li Cr O\n2 2 2 8\ndirect\n0.000000 0.000000 0.494469 Rb\n0.000000 0.000000 0.994469 Rb\n0.666667 0.333333 0.680383 Li\n0.333333 0.666667 0.180383 Li\n0.333333 0.666667 0.791531 Cr\n0.666667 0.333333 0.291531 Cr\n0.619683 0.965250 0.734360 O\n0.034751 0.654433 0.734360 O\n0.345567 0.380318 0.734360 O\n0.965250 0.619683 0.234360 O\n0.666667 0.333333 0.471939 O\n0.333333 0.666667 0.971938 O\n0.380318 0.345567 0.234360 O\n0.654433 0.034751 0.234360 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-Rb",
"density": 2.996779614281611,
"density_atomic": 0.06061789119179148,
"volume": 230.9549165229918,
"volume_molar": 9.93459297511076,
"formula_full": "Rb2 Li2 Cr2 O8",
"formula_reduced": "RbLiCrO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.997331628571429,
"spacegroup": 159
},
{
"id": "jvasp-69838",
"created_at": "2022-09-04T14:35:47.563436Z",
"updated_at": "2022-09-04T14:35:47.563465Z",
"structure_string": "Na1 Mn1 Be2\n1.0\n2.846504 -0.000000 0.000000\n0.000000 2.846504 0.000000\n0.000000 0.000000 6.561489\nNa Mn Be\n1 1 2\ndirect\n0.499999 0.499999 0.500000 Na\n0.499999 0.499999 0.000000 Mn\n0.000000 0.000000 0.837383 Be\n0.000000 0.000000 0.162617 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mn",
"Be"
],
"chemical_system": "Be-Mn-Na",
"density": 2.9969392109016777,
"density_atomic": 0.07523743642706693,
"volume": 53.165022493522734,
"volume_molar": 8.004181224114003,
"formula_full": "Na1 Mn1 Be2",
"formula_reduced": "NaMnBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8676946103448275,
"spacegroup": 123
},
{
"id": "jvasp-116899",
"created_at": "2022-09-04T14:38:46.826562Z",
"updated_at": "2022-09-04T14:38:46.826590Z",
"structure_string": "Li4 Fe2 B4 O12\n1.0\n7.688973 0.000000 0.000000\n-0.000000 4.692435 2.539107\n-0.000000 0.062991 5.788025\nLi Fe B O\n4 2 4 12\ndirect\n0.435970 0.608195 0.199274 Li\n0.935970 0.391806 0.300726 Li\n0.064030 0.608195 0.699274 Li\n0.564030 0.391806 0.800725 Li\n0.000000 0.000000 0.000000 Fe\n0.500000 -0.000000 0.500000 Fe\n0.258446 0.120674 0.131590 B\n0.758445 0.879327 0.368409 B\n0.241554 0.120674 0.631590 B\n0.741554 0.879327 0.868409 B\n0.265219 0.877251 0.604705 O\n0.765219 0.122750 0.895294 O\n0.081150 0.224597 0.653920 O\n0.395053 0.273151 0.586264 O\n0.604947 0.726850 0.413735 O\n0.104947 0.273151 0.086264 O\n0.234781 0.877251 0.104705 O\n0.734781 0.122750 0.395294 O\n0.418850 0.224597 0.153920 O\n0.581150 0.775404 0.846079 O\n0.918850 0.775404 0.346079 O\n0.895053 0.726850 0.913735 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-O",
"density": 2.9970237516563216,
"density_atomic": 0.10597190424612674,
"volume": 207.60219566219692,
"volume_molar": 5.682771110740052,
"formula_full": "Li4 Fe2 B4 O12",
"formula_reduced": "Li2Fe(BO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.9102110606060605,
"spacegroup": 14
},
{
"id": "jvasp-34716",
"created_at": "2022-09-04T14:38:31.727142Z",
"updated_at": "2022-09-04T14:38:31.727169Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.828866 -0.138123\n5.669940 0.000000 0.000000\n0.000000 -1.374309 -4.823991\nSi O\n4 8\ndirect\n0.530159 0.500000 0.532778 Si\n0.525847 0.000000 0.536396 Si\n0.972591 0.000000 0.227625 Si\n0.016498 0.500000 0.008708 Si\n0.436523 0.749391 0.660274 O\n0.869919 0.742558 0.093811 O\n0.355889 0.500000 0.198400 O\n0.869919 0.257442 0.093811 O\n0.888464 0.500000 0.663170 O\n0.436523 0.250609 0.660274 O\n0.857369 0.000000 0.512935 O\n0.312404 0.000000 0.228833 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.997197143176241,
"density_atomic": 0.09012109530067622,
"volume": 133.15417394743935,
"volume_molar": 6.682276485775038,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4733585333333337,
"spacegroup": 6
},
{
"id": "jvasp-44457",
"created_at": "2022-09-04T14:38:10.961258Z",
"updated_at": "2022-09-04T14:38:10.961292Z",
"structure_string": "Na6 Mn2 Si2 C2 O14\n1.0\n0.000000 5.213041 -0.046256\n6.414646 0.000000 0.000000\n0.000000 -0.164957 -9.144013\nNa Mn Si C O\n6 2 2 2 14\ndirect\n0.219832 0.750000 0.096357 Na\n0.740556 0.998107 0.260576 Na\n0.740556 0.501894 0.260576 Na\n0.259443 0.498107 0.739424 Na\n0.259443 0.001893 0.739424 Na\n0.780167 0.250000 0.903643 Na\n0.216215 0.250000 0.354720 Mn\n0.783784 0.750000 0.645280 Mn\n0.687249 0.250000 0.572316 Si\n0.312751 0.750000 0.427684 Si\n0.282729 0.250000 0.054260 C\n0.717270 0.750000 0.945740 C\n0.487400 0.750000 0.894328 O\n0.749379 0.047230 0.679458 O\n0.749379 0.452771 0.679458 O\n0.370667 0.250000 0.542056 O\n0.160806 0.750000 0.580847 O\n0.839193 0.250000 0.419153 O\n0.764969 0.750000 0.084606 O\n0.250620 0.547230 0.320542 O\n0.250620 0.952771 0.320542 O\n0.512599 0.250000 0.105672 O\n0.086457 0.250000 0.143782 O\n0.913542 0.750000 0.856218 O\n0.629332 0.750000 0.457944 O\n0.235030 0.250000 0.915394 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Na",
"Mn",
"Si",
"C",
"O"
],
"chemical_system": "C-Mn-Na-O-Si",
"density": 2.99720863419955,
"density_atomic": 0.08501648910973938,
"volume": 305.8230264771246,
"volume_molar": 7.083497358055582,
"formula_full": "Na6 Mn2 Si2 C2 O14",
"formula_reduced": "Na3MnSiCO7",
"formula_anonymous": "ABCD3E7",
"energy_above_hull": 2.497867487798409,
"spacegroup": 11
},
{
"id": "jvasp-12551",
"created_at": "2022-09-04T14:38:13.661966Z",
"updated_at": "2022-09-04T14:38:13.661975Z",
"structure_string": "Y1 H3 C3 O6\n1.0\n5.559706 -0.001939 -2.657770\n-4.215818 3.624529 -2.657770\n-0.000719 -0.001939 6.162311\nY H C O\n1 3 3 6\ndirect\n0.004774 0.004774 0.004774 Y\n0.362804 0.362804 0.846795 H\n0.362804 0.846796 0.362804 H\n0.846796 0.362804 0.362804 H\n0.149623 0.611170 0.611170 C\n0.611170 0.149623 0.611170 C\n0.611170 0.611170 0.149623 C\n0.342414 0.594687 0.594687 O\n0.890431 0.283914 0.890430 O\n0.890431 0.890430 0.283914 O\n0.283914 0.890430 0.890430 O\n0.594687 0.342414 0.594687 O\n0.594687 0.594687 0.342414 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Y",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Y",
"density": 2.99740722201945,
"density_atomic": 0.1047787212940862,
"volume": 124.07099303600425,
"volume_molar": 5.747484494583056,
"formula_full": "Y1 H3 C3 O6",
"formula_reduced": "YH3(CO2)3",
"formula_anonymous": "AB3C3D6",
"energy_above_hull": 3.964215111538461,
"spacegroup": 160
},
{
"id": "jvasp-62546",
"created_at": "2022-09-04T14:36:14.127246Z",
"updated_at": "2022-09-04T14:36:14.127255Z",
"structure_string": "Sr4 B8 S16\n1.0\n0.000000 6.105574 0.038582\n14.199211 0.000000 0.000000\n0.000000 -2.238245 -6.084623\nSr B S\n4 8 16\ndirect\n0.195691 0.897618 0.311731 Sr\n0.304308 0.397618 0.688269 Sr\n0.804308 0.102382 0.688269 Sr\n0.695690 0.602382 0.311731 Sr\n0.068369 0.584334 0.965076 B\n0.431630 0.084334 0.034923 B\n0.568369 0.915666 0.965077 B\n0.931630 0.415666 0.034923 B\n0.181510 0.227680 0.232239 B\n0.681510 0.272320 0.232239 B\n0.818488 0.772320 0.767761 B\n0.318489 0.727680 0.767761 B\n0.827910 0.900711 0.866812 S\n0.059935 0.303705 0.971756 S\n0.440064 0.803705 0.028243 S\n0.327910 0.599289 0.866812 S\n0.172089 0.099289 0.133188 S\n0.672089 0.400711 0.133188 S\n0.502743 0.738021 0.580691 S\n0.851354 0.492314 0.764894 S\n0.497256 0.261979 0.419309 S\n0.002743 0.761979 0.580691 S\n0.148645 0.507686 0.235106 S\n0.351354 0.007686 0.764894 S\n0.559935 0.196295 0.971756 S\n0.648645 0.992314 0.235106 S\n0.997256 0.238021 0.419309 S\n0.940063 0.696295 0.028244 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sr",
"B",
"S"
],
"chemical_system": "B-S-Sr",
"density": 2.997524019751717,
"density_atomic": 0.053204007163160115,
"volume": 526.2761489775145,
"volume_molar": 11.318960884904724,
"formula_full": "Sr4 B8 S16",
"formula_reduced": "Sr(BS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.451264496666667,
"spacegroup": 14
},
{
"id": "jvasp-109318",
"created_at": "2022-09-04T14:38:09.515259Z",
"updated_at": "2022-09-04T14:38:09.515279Z",
"structure_string": "Y2 Mg4\n1.0\n5.191783 -0.000000 2.997477\n1.730594 4.894860 2.997477\n-0.000000 -0.000000 5.994954\nY Mg\n2 4\ndirect\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Y\n0.625000 0.125000 0.625000 Mg\n0.624999 0.625000 0.625001 Mg\n0.124999 0.625000 0.625000 Mg\n0.624999 0.625000 0.125001 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.9977070462438453,
"density_atomic": 0.0393829812257195,
"volume": 152.35007135726008,
"volume_molar": 15.291226241824408,
"formula_full": "Y2 Mg4",
"formula_reduced": "YMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6593317738095237,
"spacegroup": 227
},
{
"id": "jvasp-118793",
"created_at": "2022-09-04T14:38:51.608346Z",
"updated_at": "2022-09-04T14:38:51.608367Z",
"structure_string": "Na1 Se2\n1.0\n5.182123 0.000000 0.000000\n0.000000 3.476058 0.000000\n0.000000 0.000000 5.563227\nNa Se\n1 2\ndirect\n0.466659 0.000000 0.000000 Na\n-0.033330 0.000000 0.788455 Se\n-0.033330 0.000000 0.211546 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 2.9977099186530847,
"density_atomic": 0.029936411669524012,
"volume": 100.21241133098367,
"volume_molar": 20.11644156447342,
"formula_full": "Na1 Se2",
"formula_reduced": "NaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7005650166666666,
"spacegroup": 47
},
{
"id": "jvasp-42243",
"created_at": "2022-09-04T14:35:58.197918Z",
"updated_at": "2022-09-04T14:35:58.197934Z",
"structure_string": "Li4 V2 P4 H2 O16\n1.0\n0.000000 4.839198 -0.001527\n8.021948 0.000000 0.000000\n0.000000 -1.848052 -7.298353\nLi V P H O\n4 2 4 2 16\ndirect\n0.371451 0.634205 0.909090 Li\n0.628550 0.134205 0.090910 Li\n0.860136 0.865062 0.409765 Li\n0.139865 0.365061 0.590235 Li\n0.749037 0.499939 0.253304 V\n0.250964 -0.000061 0.746696 V\n0.884430 0.844797 0.012287 P\n0.115570 0.344796 0.987713 P\n0.382768 0.651816 0.517632 P\n0.617232 0.151816 0.482368 P\n0.775092 0.489633 0.760385 H\n0.224908 0.989633 0.239615 H\n0.888570 0.322107 0.097813 O\n0.111431 0.822107 0.902187 O\n0.987238 0.437486 0.800727 O\n0.863718 0.041710 0.592468 O\n0.736663 0.322299 0.442063 O\n0.012762 0.937486 0.199273 O\n0.607199 0.675482 0.403270 O\n0.263338 0.822299 0.557937 O\n0.766849 0.677970 0.061082 O\n0.639806 0.957762 0.909541 O\n0.505551 0.559834 0.699912 O\n0.392801 0.175482 0.596730 O\n0.233152 0.177970 0.938918 O\n0.360195 0.457762 0.090459 O\n0.494450 0.059834 0.300088 O\n0.136283 0.541710 0.407532 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-V",
"density": 2.997940215866064,
"density_atomic": 0.09882008710914612,
"volume": 283.34320297728726,
"volume_molar": 6.094045184708839,
"formula_full": "Li4 V2 P4 H2 O16",
"formula_reduced": "Li2VP2HO8",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.798295942857143,
"spacegroup": 4
},
{
"id": "jvasp-115032",
"created_at": "2022-09-04T14:38:44.093183Z",
"updated_at": "2022-09-04T14:38:44.093216Z",
"structure_string": "Na1 Ge1 S1\n1.0\n4.827542 -0.000000 0.000000\n-2.413771 4.180774 -0.000000\n-0.000000 -0.000000 3.503729\nNa Ge S\n1 1 1\ndirect\n0.333333 0.666666 0.000000 Na\n0.000000 0.000000 0.000000 Ge\n0.666666 0.333333 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Ge",
"S"
],
"chemical_system": "Ge-Na-S",
"density": 2.998533775116108,
"density_atomic": 0.04242364642362516,
"volume": 70.71527916396504,
"volume_molar": 14.195245500269753,
"formula_full": "Na1 Ge1 S1",
"formula_reduced": "NaGeS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5818983166666667,
"spacegroup": 187
}
]
}