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=4473",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4471",
"results": [
{
"id": "jvasp-15984",
"created_at": "2022-09-04T14:36:18.046667Z",
"updated_at": "2022-09-04T14:36:18.046681Z",
"structure_string": "Mn2 Al1 B2\n1.0\n2.833516 0.000000 0.000000\n0.000000 2.800636 -0.738074\n0.000000 0.008611 5.715247\nMn Al B\n2 1 2\ndirect\n0.500001 0.356106 0.712212 Mn\n0.500001 0.643895 0.287790 Mn\n0.000000 0.000000 0.000000 Al\n0.000000 0.793622 0.587243 B\n0.000000 0.206379 0.412759 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Al",
"B"
],
"chemical_system": "Al-B-Mn",
"density": 5.800064090391065,
"density_atomic": 0.11019966001304411,
"volume": 45.372190798121885,
"volume_molar": 5.464754391517335,
"formula_full": "Mn2 Al1 B2",
"formula_reduced": "Mn2AlB2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.9863164898850574,
"spacegroup": 65
},
{
"id": "jvasp-112324",
"created_at": "2022-09-04T14:38:26.567456Z",
"updated_at": "2022-09-04T14:38:26.567490Z",
"structure_string": "Mg4 Fe4 B4 O16\n1.0\n3.003601 -0.000000 0.000000\n0.000000 9.085249 0.000000\n-0.000000 -0.000000 9.310361\nMg Fe B O\n4 4 4 16\ndirect\n0.250000 0.607734 0.178048 Mg\n0.750000 0.392266 0.821952 Mg\n0.750000 0.892266 0.678048 Mg\n0.250000 0.107734 0.321952 Mg\n0.250000 0.613444 0.555599 Fe\n0.750000 0.386557 0.444401 Fe\n0.750000 0.886557 0.055599 Fe\n0.250000 0.113444 0.944401 Fe\n0.250000 0.169323 0.634481 B\n0.750000 0.830677 0.365519 B\n0.750000 0.330677 0.134481 B\n0.250000 0.669323 0.865518 B\n0.750000 0.477088 0.125528 O\n0.250000 0.522912 0.874472 O\n0.250000 0.505032 0.384106 O\n0.750000 0.494968 0.615894 O\n0.750000 0.994968 0.884106 O\n0.250000 0.005032 0.115894 O\n0.250000 0.241950 0.765799 O\n0.750000 0.247069 0.004856 O\n0.750000 0.258050 0.265799 O\n0.250000 0.741950 0.734201 O\n0.250000 0.252931 0.504856 O\n0.750000 0.747069 0.495144 O\n0.750000 0.977088 0.374472 O\n0.250000 0.752931 -0.004856 O\n0.750000 0.758050 0.234201 O\n0.250000 0.022912 0.625528 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Mg",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Mg-O",
"density": 4.051157961385743,
"density_atomic": 0.11020782612274106,
"volume": 254.0654414942886,
"volume_molar": 5.464349467607681,
"formula_full": "Mg4 Fe4 B4 O16",
"formula_reduced": "MgFeBO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.39191159047619,
"spacegroup": 62
},
{
"id": "jvasp-18394",
"created_at": "2022-09-04T14:38:13.842346Z",
"updated_at": "2022-09-04T14:38:13.842376Z",
"structure_string": "Sc1 H2\n1.0\n2.924182 0.000000 1.688277\n0.974727 2.756945 1.688277\n-0.000000 -0.000000 3.376554\nSc H\n1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750001 0.749999 0.750001 H\n0.250000 0.250000 0.250000 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sc",
"H"
],
"chemical_system": "H-Sc",
"density": 2.8653654851519543,
"density_atomic": 0.11020849036200665,
"volume": 27.22113323706521,
"volume_molar": 5.4643165333440376,
"formula_full": "Sc1 H2",
"formula_reduced": "ScH2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.049268416666667,
"spacegroup": 225
},
{
"id": "jvasp-121994",
"created_at": "2022-09-04T14:38:53.390619Z",
"updated_at": "2022-09-04T14:38:53.390645Z",
"structure_string": "Er1 Al3 B4 O12\n1.0\n5.713598 -0.010657 -1.465674\n-1.886606 5.393147 -1.465674\n-0.007577 -0.010657 5.898588\nEr Al B O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Er\n-0.000001 0.444698 0.555302 Al\n0.444698 0.555302 0.000001 Al\n0.555301 -0.000001 0.444699 Al\n0.500000 0.500000 0.500001 B\n0.500000 0.056254 0.943746 B\n0.056254 0.943746 0.500001 B\n0.943745 0.500000 0.056256 B\n0.369744 0.219256 0.971045 O\n0.780743 0.630255 0.028956 O\n0.028955 0.780743 0.630256 O\n0.630255 0.028955 0.780744 O\n0.091956 0.500000 0.908043 O\n0.648768 0.351231 0.500001 O\n0.500000 0.908043 0.091958 O\n0.351231 0.500000 0.648769 O\n0.971044 0.369744 0.219258 O\n0.500000 0.648768 0.351233 O\n0.908043 0.091956 0.500001 O\n0.219256 0.971045 0.369746 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Er",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Er-O",
"density": 4.423876944449614,
"density_atomic": 0.11021507016336186,
"volume": 181.46338763252433,
"volume_molar": 5.463990315547523,
"formula_full": "Er1 Al3 B4 O12",
"formula_reduced": "ErAl3(BO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 3.2132520366666664,
"spacegroup": 155
},
{
"id": "jvasp-31809",
"created_at": "2022-09-04T14:35:41.521665Z",
"updated_at": "2022-09-04T14:35:41.521682Z",
"structure_string": "Co1 Si1 H12 O6 F6\n1.0\n6.184532 -0.025242 -0.667587\n-0.740832 6.140053 -0.667587\n-0.022471 -0.025242 6.220419\nCo Si H O F\n1 1 12 6 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Si\n0.583756 0.810684 0.936693 H\n0.936693 0.583756 0.810682 H\n0.810683 0.936694 0.583755 H\n0.063307 0.416245 0.189317 H\n0.189319 0.063308 0.416244 H\n0.313834 0.221824 0.821316 H\n0.178686 0.686166 0.778176 H\n0.778177 0.178686 0.686166 H\n0.686167 0.778177 0.178684 H\n0.821316 0.313833 0.221822 H\n0.221824 0.821316 0.313834 H\n0.416245 0.189318 0.063306 H\n0.308694 0.126763 0.937692 O\n0.062308 0.691306 0.873238 O\n0.691307 0.873238 0.062307 O\n0.937693 0.308694 0.126762 O\n0.873238 0.062308 0.691306 O\n0.126763 0.937693 0.308693 O\n0.712757 0.668933 0.431027 F\n0.668934 0.431029 0.712757 F\n0.431028 0.712756 0.668932 F\n0.287244 0.331068 0.568972 F\n0.568971 0.287243 0.331066 F\n0.331067 0.568972 0.287243 F\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Co",
"Si",
"H",
"O",
"F"
],
"chemical_system": "Co-F-H-O-Si",
"density": 2.1759530144707826,
"density_atomic": 0.11022335929192598,
"volume": 235.88466335107006,
"volume_molar": 5.463579407020605,
"formula_full": "Co1 Si1 H12 O6 F6",
"formula_reduced": "CoSiH12(OF)6",
"formula_anonymous": "ABC6D6E12",
"energy_above_hull": 2.443643161346154,
"spacegroup": 148
},
{
"id": "jvasp-44708",
"created_at": "2022-09-04T14:38:05.130531Z",
"updated_at": "2022-09-04T14:38:05.130551Z",
"structure_string": "Li4 Cr2 Cu2 O8\n1.0\n6.031987 -0.591754 0.015835\n-0.223506 6.056821 0.015835\n-2.892950 -2.721910 3.971777\nLi Cr Cu O\n4 2 2 8\ndirect\n-0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.499999 Li\n0.500000 0.000000 -0.000001 Li\n0.499999 0.500000 -0.000001 Li\n-0.000001 0.500000 -0.000001 Cr\n0.500000 0.000000 0.500000 Cr\n0.000000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.264195 0.735809 0.015063 O\n0.271059 0.199265 0.485161 O\n0.264190 0.735803 0.484935 O\n0.800734 0.728940 0.014837 O\n0.199265 0.271060 0.985161 O\n0.735809 0.264196 0.515063 O\n0.728940 0.800734 0.514837 O\n0.735804 0.264191 0.984936 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-Li-O",
"density": 4.425354058360136,
"density_atomic": 0.11022591596079118,
"volume": 145.15642587802503,
"volume_molar": 5.463452680349834,
"formula_full": "Li4 Cr2 Cu2 O8",
"formula_reduced": "Li2CrCuO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.01690898125,
"spacegroup": 74
},
{
"id": "jvasp-48574",
"created_at": "2022-09-04T14:37:05.976394Z",
"updated_at": "2022-09-04T14:37:05.976405Z",
"structure_string": "Li3 Mn1 V3 O8\n1.0\n-2.807310 1.752410 4.748926\n0.000107 -3.309370 4.748926\n2.949731 1.636010 4.667859\nLi Mn V O\n3 1 3 8\ndirect\n0.500003 0.999998 0.500002 Li\n0.999998 0.500004 0.500002 Li\n-0.000001 -0.000001 0.500007 Li\n0.500006 0.500007 0.499981 Mn\n0.499995 0.499996 0.000004 V\n0.499995 0.000004 0.000005 V\n0.000004 0.499995 0.000005 V\n0.739652 0.739652 0.247589 O\n0.739655 0.273104 0.247588 O\n0.273104 0.739655 0.247588 O\n0.253689 0.253689 0.238932 O\n0.746305 0.746306 0.761084 O\n0.726889 0.260355 0.752398 O\n0.260355 0.726889 0.752398 O\n0.260357 0.260357 0.752397 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Mn",
"V",
"O"
],
"chemical_system": "Li-Mn-O-V",
"density": 4.351145103235033,
"density_atomic": 0.11022696256883431,
"volume": 136.08285713790607,
"volume_molar": 5.463400804716274,
"formula_full": "Li3 Mn1 V3 O8",
"formula_reduced": "Li3MnV3O8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 3.049893189425288,
"spacegroup": 166
},
{
"id": "jvasp-49112",
"created_at": "2022-09-04T14:36:57.885383Z",
"updated_at": "2022-09-04T14:36:57.885401Z",
"structure_string": "Mn2 B2 O6\n1.0\n2.322310 1.340786 4.855529\n-2.322310 1.340786 4.855529\n-0.000000 -2.681572 4.855529\nMn B O\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500001 0.500001 0.499999 Mn\n0.250000 0.250000 0.249999 B\n0.750001 0.750001 0.749998 B\n0.250001 0.951517 0.548482 O\n0.048484 0.451517 0.749999 O\n0.451517 0.750001 0.048483 O\n0.548484 0.250001 0.951515 O\n0.951517 0.548485 0.249999 O\n0.750001 0.048484 0.451515 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"B",
"O"
],
"chemical_system": "B-Mn-O",
"density": 4.164400771534415,
"density_atomic": 0.11023830790758704,
"volume": 90.71256797939077,
"volume_molar": 5.4628385307296,
"formula_full": "Mn2 B2 O6",
"formula_reduced": "MnBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.966484064942529,
"spacegroup": 167
},
{
"id": "jvasp-103964",
"created_at": "2022-09-04T14:36:59.664637Z",
"updated_at": "2022-09-04T14:36:59.664672Z",
"structure_string": "Cd1 H6 C5 O4\n1.0\n4.066197 -0.096767 0.805809\n1.868403 4.145200 0.179873\n0.151667 -0.041712 8.550413\nCd H C O\n1 6 5 4\ndirect\n0.908491 0.082441 0.768088 Cd\n0.468148 0.709535 0.424053 H\n0.586876 0.340182 0.321686 H\n0.859469 0.890725 0.352138 H\n0.027550 0.105226 0.114645 H\n0.021910 0.544661 0.225417 H\n0.422505 0.992724 0.184300 H\n0.191301 0.427034 0.536183 C\n0.361639 0.546124 0.386625 C\n0.101757 0.715194 0.277464 C\n0.246821 0.895561 0.144172 C\n0.456279 0.709704 0.987279 C\n0.181555 0.527113 0.675264 O\n0.067255 0.215305 0.518795 O\n0.614996 0.408947 0.988214 O\n0.460444 0.872352 0.859340 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.7748604766200855,
"density_atomic": 0.11025107946817589,
"volume": 145.12329563737669,
"volume_molar": 5.4622057117711025,
"formula_full": "Cd1 H6 C5 O4",
"formula_reduced": "CdH6C5O4",
"formula_anonymous": "AB4C5D6",
"energy_above_hull": 4.122690859375,
"spacegroup": 1
},
{
"id": "jvasp-27332",
"created_at": "2022-09-04T14:38:17.657556Z",
"updated_at": "2022-09-04T14:38:17.657572Z",
"structure_string": "U8 H24\n1.0\n6.620843 0.000000 -0.000000\n-0.000000 6.620843 -0.000000\n-0.000000 -0.000000 6.620843\nU H\n8 24\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.500000 U\n0.250000 0.000000 0.500000 U\n0.750000 0.000000 0.500000 U\n0.000000 0.500000 0.250000 U\n0.000000 0.500000 0.750000 U\n0.500000 0.750000 0.000000 U\n0.500000 0.250000 0.000000 U\n0.696262 0.000000 0.844033 H\n0.155967 0.696262 0.000000 H\n0.000000 0.844033 0.696262 H\n0.000000 0.155967 0.696262 H\n0.803738 0.344033 0.500000 H\n0.655966 0.500000 0.196262 H\n0.344033 0.500000 0.196262 H\n0.696262 0.000000 0.155967 H\n0.196262 0.344033 0.500000 H\n0.000000 0.844033 0.303738 H\n0.844033 0.303738 0.000000 H\n0.303738 0.000000 0.155967 H\n0.844033 0.696262 0.000000 H\n0.155967 0.303738 0.000000 H\n0.500000 0.803738 0.655966 H\n0.655966 0.500000 0.803738 H\n0.344033 0.500000 0.803738 H\n0.196262 0.655966 0.500000 H\n0.803738 0.655966 0.500000 H\n0.500000 0.803738 0.344033 H\n0.500000 0.196262 0.655966 H\n0.000000 0.155967 0.303738 H\n0.303738 0.000000 0.844033 H\n0.500000 0.196262 0.344033 H\n",
"nsites": 32,
"nelements": 2,
"elements": [
"U",
"H"
],
"chemical_system": "H-U",
"density": 11.03344844555191,
"density_atomic": 0.11025799978333166,
"volume": 290.22837402168824,
"volume_molar": 5.461862877826667,
"formula_full": "U8 H24",
"formula_reduced": "UH3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3422015,
"spacegroup": 223
},
{
"id": "jvasp-48181",
"created_at": "2022-09-04T14:35:41.015484Z",
"updated_at": "2022-09-04T14:35:41.015513Z",
"structure_string": "Fe8 O14 F2\n1.0\n-4.355294 0.059499 0.000000\n-0.059531 4.352644 -5.741919\n0.059531 -4.352644 -5.741919\nFe O F\n8 14 2\ndirect\n0.494967 0.123652 0.626882 Fe\n0.524386 0.386118 0.864152 Fe\n0.494967 0.873118 0.376349 Fe\n0.524386 0.635848 0.113883 Fe\n0.007525 0.755010 0.744990 Fe\n0.990456 0.498980 0.508621 Fe\n0.972448 0.235928 0.264073 Fe\n0.990455 0.991379 0.001021 Fe\n0.194732 0.973113 0.776545 O\n0.194732 0.723455 0.526887 O\n0.294874 0.097355 0.402645 O\n0.303740 0.846616 0.149670 O\n0.303740 0.350331 0.653384 O\n0.311871 0.599668 0.900332 O\n0.696737 0.650474 0.347497 O\n0.797153 0.022692 0.225390 O\n0.696737 0.152504 0.849526 O\n0.692762 0.902476 0.597524 O\n0.809221 0.530804 0.721510 O\n0.797153 0.274610 0.477308 O\n0.809221 0.778491 0.969196 O\n0.701335 0.401117 0.098883 O\n0.198195 0.223596 0.027329 F\n0.198195 0.472671 0.276405 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.4071032679676385,
"density_atomic": 0.11026424621466906,
"volume": 217.65894951365613,
"volume_molar": 5.461553465187378,
"formula_full": "Fe8 O14 F2",
"formula_reduced": "Fe4O7F",
"formula_anonymous": "AB4C7",
"energy_above_hull": 2.9705163985416667,
"spacegroup": 8
},
{
"id": "jvasp-16000",
"created_at": "2022-09-04T14:36:41.984295Z",
"updated_at": "2022-09-04T14:36:41.984320Z",
"structure_string": "Si1 C1 N1\n1.0\n2.923451 -0.000000 1.687855\n0.974484 2.756256 1.687855\n0.000000 0.000000 3.375711\nSi C N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Si\n0.749998 0.750001 0.750002 C\n0.249999 0.250000 0.250001 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Si",
"C",
"N"
],
"chemical_system": "C-N-Si",
"density": 3.3028512275258946,
"density_atomic": 0.11029113970807497,
"volume": 27.200734419288576,
"volume_molar": 5.4602217149444225,
"formula_full": "Si1 C1 N1",
"formula_reduced": "SiCN",
"formula_anonymous": "ABC",
"energy_above_hull": 4.739020616666666,
"spacegroup": 216
}
]
}