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=elements&page=338",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=336",
"results": [
{
"id": "jvasp-101764",
"created_at": "2022-09-04T14:37:02.236289Z",
"updated_at": "2022-09-04T14:37:02.236308Z",
"structure_string": "Fe4 O4\n1.0\n3.032430 0.056298 -0.028344\n-0.105922 4.970756 -1.707295\n0.051099 -0.047768 5.255883\nFe O\n4 4\ndirect\n0.500001 -0.000000 0.500001 Fe\n0.500001 0.500000 0.000001 Fe\n-0.000000 0.000000 -0.000001 Fe\n-0.000000 0.500000 0.499998 Fe\n0.000011 0.249995 0.750031 O\n0.500010 0.249995 0.250030 O\n-0.000009 0.750007 0.249967 O\n0.499990 0.750004 0.749970 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 6.039719992175245,
"density_atomic": 0.10125227284641482,
"volume": 79.01057206029195,
"volume_molar": 5.947659830940016,
"formula_full": "Fe4 O4",
"formula_reduced": "FeO",
"formula_anonymous": "AB",
"energy_above_hull": 1.4375044999999995,
"spacegroup": 225
},
{
"id": "jvasp-109425",
"created_at": "2022-09-04T14:37:58.073432Z",
"updated_at": "2022-09-04T14:37:58.073452Z",
"structure_string": "Fe4 O4\n1.0\n3.663208 0.000102 1.343434\n-0.492580 3.629939 1.343435\n-0.098275 -0.112515 5.934367\nFe O\n4 4\ndirect\n0.499999 0.000001 0.500000 Fe\n0.250001 0.249999 -0.000000 Fe\n-0.000001 0.499999 0.500000 Fe\n0.750002 0.749998 -0.000001 Fe\n0.375000 0.375000 0.249998 O\n0.874999 0.874998 0.249998 O\n0.124997 0.124999 0.750002 O\n0.625000 0.625000 0.750000 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 5.963657564989828,
"density_atomic": 0.09997713200533014,
"volume": 80.01829858025425,
"volume_molar": 6.023518217824991,
"formula_full": "Fe4 O4",
"formula_reduced": "FeO",
"formula_anonymous": "AB",
"energy_above_hull": 1.3890444999999998,
"spacegroup": 131
},
{
"id": "jvasp-30118",
"created_at": "2022-09-04T14:38:00.386405Z",
"updated_at": "2022-09-04T14:38:00.386433Z",
"structure_string": "Fe2 O4\n1.0\n-1.472561 2.405629 0.000000\n-1.228682 -2.405629 0.811650\n1.094890 2.323731 8.544696\nFe O\n2 4\ndirect\n0.499999 0.750000 0.749999 Fe\n0.499998 0.249999 0.250002 Fe\n0.237265 0.618632 0.144102 O\n0.237265 0.118633 0.644102 O\n0.762733 0.881367 0.355898 O\n0.762735 0.381368 0.855897 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 4.826857096973312,
"density_atomic": 0.09927170572000597,
"volume": 60.44018239117287,
"volume_molar": 6.066321431995274,
"formula_full": "Fe2 O4",
"formula_reduced": "FeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0486175,
"spacegroup": 166
},
{
"id": "jvasp-99626",
"created_at": "2022-09-04T14:36:33.079181Z",
"updated_at": "2022-09-04T14:36:33.079211Z",
"structure_string": "Fe4 O6\n1.0\n4.978267 -0.000014 0.000011\n-2.489156 3.638658 -2.312496\n0.000009 0.035642 5.415095\nFe O\n4 6\ndirect\n0.644511 0.289012 0.933529 Fe\n0.355490 0.710990 0.066471 Fe\n0.855509 0.711008 0.566501 Fe\n0.144491 0.288993 0.433500 Fe\n0.440413 0.190407 0.250010 O\n0.559588 0.809594 0.749989 O\n0.749994 0.809586 0.249988 O\n0.250007 0.190414 0.750013 O\n0.059606 0.500009 0.250001 O\n0.940394 0.499992 0.749999 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 5.384115328259446,
"density_atomic": 0.10152253073820418,
"volume": 98.50030261545555,
"volume_molar": 5.931826872528696,
"formula_full": "Fe4 O6",
"formula_reduced": "Fe2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.7123283,
"spacegroup": 167
},
{
"id": "jvasp-11517",
"created_at": "2022-09-04T14:36:32.626408Z",
"updated_at": "2022-09-04T14:36:32.626427Z",
"structure_string": "Fe4 O8\n1.0\n-5.613491 0.004957 -0.005430\n-0.005537 -5.613447 -0.008593\n2.805645 2.798199 3.977589\nFe O\n4 8\ndirect\n0.500000 -0.000000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000001 -0.000000 0.500000 Fe\n0.262891 0.788507 0.525742 O\n0.288515 0.762896 0.025756 O\n0.737235 0.762859 0.025744 O\n0.711487 0.237104 0.974245 O\n0.737153 0.762758 0.474254 O\n0.262849 0.237242 0.525747 O\n0.262766 0.237142 0.974257 O\n0.737111 0.211494 0.474259 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 4.663393562996172,
"density_atomic": 0.09590982789455592,
"volume": 125.11752198317885,
"volume_molar": 6.278961074375811,
"formula_full": "Fe4 O8",
"formula_reduced": "FeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0142375,
"spacegroup": 227
},
{
"id": "jvasp-30542",
"created_at": "2022-09-04T14:37:29.149251Z",
"updated_at": "2022-09-04T14:37:29.149275Z",
"structure_string": "Fe2 O4\n1.0\n2.865107 0.000000 -0.000000\n-1.432554 2.481257 0.000000\n0.000000 -0.000000 11.025037\nFe O\n2 4\ndirect\n0.666668 0.333333 0.750000 Fe\n0.333335 0.666668 0.250000 Fe\n0.333335 0.666668 0.394467 O\n0.666668 0.333333 0.894467 O\n0.333335 0.666668 0.105533 O\n0.666668 0.333333 0.605533 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 3.722181591497818,
"density_atomic": 0.07655236278266764,
"volume": 78.37772449994804,
"volume_molar": 7.866694823119797,
"formula_full": "Fe2 O4",
"formula_reduced": "FeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.4018908333333338,
"spacegroup": 194
},
{
"id": "jvasp-30592",
"created_at": "2022-09-04T14:37:28.773297Z",
"updated_at": "2022-09-04T14:37:28.773311Z",
"structure_string": "Fe1 O2\n1.0\n2.641030 -0.036038 3.944908\n1.171905 2.367061 3.944908\n-0.058949 -0.036038 4.746985\nFe O\n1 2\ndirect\n0.500002 0.499999 0.499999 Fe\n0.761361 0.761359 0.761359 O\n0.238642 0.238640 0.238641 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 4.760108105438624,
"density_atomic": 0.09789891052188548,
"volume": 30.643854809082317,
"volume_molar": 6.151386902976554,
"formula_full": "Fe1 O2",
"formula_reduced": "FeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0174175000000005,
"spacegroup": 166
},
{
"id": "jvasp-14311",
"created_at": "2022-09-04T14:36:59.288839Z",
"updated_at": "2022-09-04T14:36:59.288862Z",
"structure_string": "Fe4 P1\n1.0\n4.132603 0.000000 0.000000\n0.000000 4.132603 0.000000\n0.000000 -0.000000 4.132387\nFe P\n4 1\ndirect\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 P\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 5.984652016354713,
"density_atomic": 0.07084702929332082,
"volume": 70.5745893635004,
"volume_molar": 8.500202224523964,
"formula_full": "Fe4 P1",
"formula_reduced": "Fe4P",
"formula_anonymous": "AB4",
"energy_above_hull": 3.6524735,
"spacegroup": 221
},
{
"id": "jvasp-29559",
"created_at": "2022-09-04T14:37:02.278214Z",
"updated_at": "2022-09-04T14:37:02.278232Z",
"structure_string": "Fe2 P8\n1.0\n4.524048 -0.000000 -2.217063\n0.000000 5.571908 0.000000\n0.004704 0.000000 5.733926\nFe P\n2 8\ndirect\n0.174102 0.750000 0.348204 Fe\n0.825898 0.250000 0.651797 Fe\n0.003079 0.132956 0.366398 P\n0.307259 0.802175 0.037713 P\n0.996921 0.632956 0.633603 P\n0.269546 0.197825 0.962288 P\n0.636681 0.867045 0.633603 P\n0.363319 0.367044 0.366398 P\n0.692740 0.302175 0.962288 P\n0.730454 0.697825 0.037713 P\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 4.128251564518141,
"density_atomic": 0.06915796534896293,
"volume": 144.59650380894203,
"volume_molar": 8.70780499341325,
"formula_full": "Fe2 P8",
"formula_reduced": "FeP4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.1915415,
"spacegroup": 20
},
{
"id": "jvasp-19829",
"created_at": "2022-09-04T14:36:46.079384Z",
"updated_at": "2022-09-04T14:36:46.079404Z",
"structure_string": "Fe6 P3\n1.0\n2.899407 -5.021920 -0.000000\n2.899407 5.021920 0.000000\n-0.000000 -0.000000 3.447491\nFe P\n6 3\ndirect\n0.000000 0.407594 0.500000 Fe\n0.592407 0.592407 0.500000 Fe\n0.407594 0.000000 0.500000 Fe\n0.742621 0.000000 0.000000 Fe\n0.257379 0.257379 0.000000 Fe\n0.000000 0.742621 0.000000 Fe\n0.666668 0.333334 0.000000 P\n0.333334 0.666668 0.000000 P\n0.000000 0.000000 0.500000 P\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 7.079000032976111,
"density_atomic": 0.08964589336994853,
"volume": 100.39500596930877,
"volume_molar": 6.717698417202419,
"formula_full": "Fe6 P3",
"formula_reduced": "Fe2P",
"formula_anonymous": "AB2",
"energy_above_hull": 2.7695021666666664,
"spacegroup": 189
},
{
"id": "jvasp-22663",
"created_at": "2022-09-04T14:37:09.865616Z",
"updated_at": "2022-09-04T14:37:09.865652Z",
"structure_string": "Fe4 P16\n1.0\n5.093430 0.000000 0.104248\n2.546715 5.230942 0.052125\n0.006318 0.000000 11.157040\nFe P\n4 16\ndirect\n0.923605 0.152791 0.750000 Fe\n0.076397 0.847209 0.250000 Fe\n0.000001 0.500000 0.500000 Fe\n0.500001 0.500000 -0.000000 Fe\n0.866910 0.187000 0.549908 P\n0.933104 0.535567 0.293046 P\n0.227307 0.143444 0.216232 P\n0.336144 0.207128 0.024000 P\n0.370753 0.856555 0.716232 P\n0.468672 0.464432 0.793046 P\n0.946092 0.187000 0.950092 P\n0.629249 0.143444 0.283768 P\n0.066898 0.464432 0.706954 P\n0.543272 0.792872 0.524000 P\n0.053909 0.813000 0.049908 P\n0.133092 0.813000 0.450092 P\n0.663858 0.792872 0.976000 P\n0.456729 0.207128 0.476000 P\n0.772694 0.856555 0.783768 P\n0.531330 0.535567 0.206954 P\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 4.016240756151564,
"density_atomic": 0.06728151971994535,
"volume": 297.25844605247636,
"volume_molar": 8.950661021134396,
"formula_full": "Fe4 P16",
"formula_reduced": "FeP4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.1888855,
"spacegroup": 15
},
{
"id": "jvasp-29237",
"created_at": "2022-09-04T14:37:01.488891Z",
"updated_at": "2022-09-04T14:37:01.488916Z",
"structure_string": "Fe6 P24\n1.0\n4.651551 -0.005034 0.000000\n-1.410890 6.911683 0.000000\n0.000000 0.000000 13.769307\nFe P\n6 24\ndirect\n0.000000 0.000000 0.000000 Fe\n0.858138 0.619761 0.830317 Fe\n0.141862 0.880239 0.330317 Fe\n0.141862 0.380239 0.169683 Fe\n0.858138 0.119761 0.669683 Fe\n-0.000000 0.500000 0.500000 Fe\n0.928793 0.634403 0.224678 P\n0.071207 0.865597 0.724678 P\n0.632414 0.430013 0.943931 P\n0.367586 0.069987 0.443931 P\n0.367586 0.569987 0.056069 P\n0.632414 0.930013 0.556069 P\n0.737516 0.304512 0.387359 P\n0.262484 0.195489 0.887359 P\n0.262484 0.695489 0.612642 P\n0.507845 0.032623 0.780203 P\n0.344890 0.145382 0.107322 P\n0.344890 0.645382 0.392678 P\n0.655110 0.854618 0.892678 P\n0.804513 0.749356 0.446278 P\n0.195487 0.750644 0.946278 P\n0.195487 0.250644 0.553722 P\n0.804513 0.249357 0.053722 P\n0.928793 0.134403 0.275322 P\n0.071207 0.365597 0.775322 P\n0.507845 0.532623 0.719798 P\n0.492155 0.967377 0.219798 P\n0.492155 0.467378 0.280202 P\n0.655110 0.354618 0.607322 P\n0.737516 0.804511 0.112642 P\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 4.046201181371595,
"density_atomic": 0.06778342761408042,
"volume": 442.5860576246251,
"volume_molar": 8.884385124763211,
"formula_full": "Fe6 P24",
"formula_reduced": "FeP4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.1891495,
"spacegroup": 14
}
]
}