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=-spacegroup&page=1265",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=1263",
"results": [
{
"id": "jvasp-56631",
"created_at": "2022-09-04T14:38:33.388023Z",
"updated_at": "2022-09-04T14:38:33.388039Z",
"structure_string": "K6 Mo4 Br2 O14\n1.0\n2.989044 -5.177177 0.000000\n2.989044 5.177177 -0.000000\n0.000000 0.000000 15.688623\nK Mo Br O\n6 4 2 14\ndirect\n0.666666 0.333332 0.458012 K\n0.333332 0.666666 0.541988 K\n0.333332 0.666666 0.958012 K\n0.666666 0.333332 0.750000 K\n0.666666 0.333332 0.041988 K\n0.333332 0.666666 0.250000 K\n0.000000 0.000000 0.870208 Mo\n0.000000 0.000000 0.629791 Mo\n0.000000 0.000000 0.370208 Mo\n0.000000 0.000000 0.129791 Mo\n0.666666 0.333332 0.250000 Br\n0.333332 0.666666 0.750000 Br\n0.316633 0.158317 0.908914 O\n0.841682 0.683366 0.591086 O\n0.158317 0.316633 0.091086 O\n0.000000 0.000000 0.750000 O\n0.683366 0.841682 0.091086 O\n0.683366 0.841682 0.408914 O\n0.841682 0.158316 0.591086 O\n0.158316 0.841682 0.091086 O\n0.158317 0.316633 0.408914 O\n0.841682 0.683366 0.908914 O\n0.158316 0.841682 0.408914 O\n0.000000 0.000000 0.250000 O\n0.316633 0.158317 0.591086 O\n0.841682 0.158316 0.908914 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"K",
"Mo",
"Br",
"O"
],
"chemical_system": "Br-K-Mo-O",
"density": 3.4272155876941737,
"density_atomic": 0.05354676078920122,
"volume": 485.5569154286439,
"volume_molar": 11.246508045010419,
"formula_full": "K6 Mo4 Br2 O14",
"formula_reduced": "K3Mo2BrO7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.285887261923077,
"spacegroup": 194
},
{
"id": "jvasp-57669",
"created_at": "2022-09-04T14:38:33.274023Z",
"updated_at": "2022-09-04T14:38:33.274056Z",
"structure_string": "Zr4 Cr8\n1.0\n2.540814 -4.400820 0.000000\n2.540814 4.400820 -0.000000\n-0.000000 -0.000000 8.070107\nZr Cr\n4 8\ndirect\n0.333332 0.666666 0.059983 Zr\n0.666666 0.333332 0.559983 Zr\n0.666666 0.333332 0.940017 Zr\n0.333332 0.666666 0.440017 Zr\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.335024 0.167512 0.250000 Cr\n0.167512 0.335024 0.750000 Cr\n0.167512 0.832487 0.750000 Cr\n0.832487 0.167512 0.250000 Cr\n0.832486 0.664974 0.250000 Cr\n0.664974 0.832486 0.750000 Cr\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"Cr"
],
"chemical_system": "Cr-Zr",
"density": 7.184708879968847,
"density_atomic": 0.06649140011394536,
"volume": 180.47446706545165,
"volume_molar": 9.057022035451116,
"formula_full": "Zr4 Cr8",
"formula_reduced": "ZrCr2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.098713100000001,
"spacegroup": 194
},
{
"id": "jvasp-15837",
"created_at": "2022-09-04T14:38:33.368561Z",
"updated_at": "2022-09-04T14:38:33.368571Z",
"structure_string": "Hf4 S2\n1.0\n1.687476 -2.922794 -0.000000\n1.687476 2.922794 -0.000000\n0.000000 -0.000000 11.808388\nHf S\n4 2\ndirect\n0.666668 0.333335 0.099245 Hf\n0.333335 0.666668 0.599245 Hf\n0.666668 0.333335 0.400755 Hf\n0.333335 0.666668 0.900755 Hf\n0.000000 0.000000 0.250000 S\n0.000000 0.000000 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"S"
],
"chemical_system": "Hf-S",
"density": 11.092323037367345,
"density_atomic": 0.0515103888055377,
"volume": 116.4813572394344,
"volume_molar": 11.691118820195317,
"formula_full": "Hf4 S2",
"formula_reduced": "Hf2S",
"formula_anonymous": "AB2",
"energy_above_hull": 3.438308666666667,
"spacegroup": 194
},
{
"id": "jvasp-56367",
"created_at": "2022-09-04T14:38:33.442372Z",
"updated_at": "2022-09-04T14:38:33.442385Z",
"structure_string": "K6 Bi2\n1.0\n3.072973 -5.322546 -0.000000\n3.072973 5.322546 0.000000\n-0.000000 0.000000 10.903472\nK Bi\n6 2\ndirect\n0.666667 0.333332 0.918140 K\n0.333332 0.666667 0.418140 K\n0.000000 0.000000 0.250000 K\n0.333332 0.666667 0.081860 K\n0.000000 0.000000 0.750000 K\n0.666667 0.333332 0.581859 K\n0.333332 0.666667 0.750000 Bi\n0.666667 0.333332 0.250000 Bi\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Bi"
],
"chemical_system": "Bi-K",
"density": 3.038017802981024,
"density_atomic": 0.022429366669509045,
"volume": 356.67525159662085,
"volume_molar": 26.84935713404082,
"formula_full": "K6 Bi2",
"formula_reduced": "K3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-56378",
"created_at": "2022-09-04T14:38:33.559759Z",
"updated_at": "2022-09-04T14:38:33.559772Z",
"structure_string": "Dy4 Al12\n1.0\n3.069234 -5.316070 -0.000000\n3.069234 5.316070 0.000000\n0.000000 0.000000 9.576253\nDy Al\n4 12\ndirect\n0.000000 0.000000 0.500000 Dy\n0.666666 0.333332 0.750000 Dy\n0.333332 0.666666 0.250000 Dy\n0.000000 0.000000 0.000000 Dy\n0.182905 0.817093 0.750000 Al\n0.634187 0.817093 0.750000 Al\n-0.000000 0.500000 0.000000 Al\n0.499999 0.499999 0.000000 Al\n0.817093 0.634187 0.250000 Al\n0.365811 0.182905 0.250000 Al\n0.182905 0.365811 0.750000 Al\n0.499999 0.499999 0.500000 Al\n0.500000 -0.000000 0.500000 Al\n0.817093 0.182905 0.250000 Al\n0.500000 -0.000000 0.000000 Al\n-0.000000 0.500000 0.500000 Al\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Dy",
"Al"
],
"chemical_system": "Al-Dy",
"density": 5.174435336702771,
"density_atomic": 0.05120043893270729,
"volume": 312.4973209903296,
"volume_molar": 11.761892838291672,
"formula_full": "Dy4 Al12",
"formula_reduced": "DyAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5018987250000002,
"spacegroup": 194
},
{
"id": "jvasp-38431",
"created_at": "2022-09-04T14:38:33.479036Z",
"updated_at": "2022-09-04T14:38:33.479065Z",
"structure_string": "Mo2 Ru6\n1.0\n2.750798 -4.764522 -0.000000\n2.750798 4.764522 0.000000\n0.000000 0.000000 4.356831\nMo Ru\n2 6\ndirect\n0.333333 0.666667 0.250000 Mo\n0.666667 0.333333 0.750000 Mo\n0.666769 0.833385 0.750000 Ru\n0.166615 0.333231 0.750000 Ru\n0.166615 0.833385 0.750000 Ru\n0.333231 0.166615 0.250000 Ru\n0.833385 0.666769 0.250000 Ru\n0.833385 0.166615 0.250000 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"Ru"
],
"chemical_system": "Mo-Ru",
"density": 11.607440881303964,
"density_atomic": 0.07005050018764619,
"volume": 114.20332443837205,
"volume_molar": 8.596856187847806,
"formula_full": "Mo2 Ru6",
"formula_reduced": "MoRu3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.84878185,
"spacegroup": 194
},
{
"id": "jvasp-21694",
"created_at": "2022-09-04T14:38:33.578638Z",
"updated_at": "2022-09-04T14:38:33.578649Z",
"structure_string": "Hf4 Pd12\n1.0\n2.825120 -4.893251 -0.000000\n2.825120 4.893251 0.000000\n0.000000 -0.000000 9.278155\nHf Pd\n4 12\ndirect\n0.666667 0.333333 0.250000 Hf\n0.333333 0.666667 0.750000 Hf\n0.000000 0.000000 0.500000 Hf\n0.000000 0.000000 0.000000 Hf\n0.168623 0.831377 0.250000 Pd\n0.831377 0.662753 0.750000 Pd\n0.337246 0.168623 0.750000 Pd\n0.662753 0.831377 0.250000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.000000 0.500000 0.500000 Pd\n0.000000 0.500000 0.000000 Pd\n0.500000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n0.831377 0.168623 0.750000 Pd\n0.168623 0.337246 0.250000 Pd\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Hf",
"Pd"
],
"chemical_system": "Hf-Pd",
"density": 12.888261673968023,
"density_atomic": 0.062372617562367234,
"volume": 256.5228240421589,
"volume_molar": 9.655103465841206,
"formula_full": "Hf4 Pd12",
"formula_reduced": "HfPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.393942525,
"spacegroup": 194
},
{
"id": "jvasp-41384",
"created_at": "2022-09-04T14:38:33.580116Z",
"updated_at": "2022-09-04T14:38:33.580148Z",
"structure_string": "Lu6 Ni14 B4\n1.0\n2.498845 -4.328127 -0.000000\n2.498845 4.328127 0.000000\n-0.000000 0.000000 14.223190\nLu Ni B\n6 14 4\ndirect\n0.333332 0.666666 0.216851 Lu\n0.666666 0.333332 0.716853 Lu\n0.666666 0.333332 0.283147 Lu\n0.333332 0.666666 0.783149 Lu\n0.333332 0.666666 0.000000 Lu\n0.666666 0.333332 0.500000 Lu\n0.166050 0.833948 0.397155 Ni\n0.166051 0.332102 0.397155 Ni\n0.667896 0.833947 0.397155 Ni\n0.332102 0.166051 0.897153 Ni\n0.833947 0.667896 0.897153 Ni\n0.833947 0.166051 0.897153 Ni\n0.332102 0.166051 0.102847 Ni\n0.166051 0.332102 0.602845 Ni\n0.667896 0.833947 0.602845 Ni\n0.833947 0.166051 0.102847 Ni\n0.166050 0.833948 0.602845 Ni\n0.000000 0.000000 0.249997 Ni\n0.000000 0.000000 0.750003 Ni\n0.833947 0.667896 0.102847 Ni\n0.000000 0.000000 0.500000 B\n0.333332 0.666666 0.500000 B\n0.666666 0.333332 0.000000 B\n0.000000 0.000000 0.000000 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Lu",
"Ni",
"B"
],
"chemical_system": "B-Lu-Ni",
"density": 10.334647568237678,
"density_atomic": 0.07800903767347611,
"volume": 307.6566602507936,
"volume_molar": 7.719798807424068,
"formula_full": "Lu6 Ni14 B4",
"formula_reduced": "Lu3Ni7B2",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 2.008144101388889,
"spacegroup": 194
},
{
"id": "jvasp-11237",
"created_at": "2022-09-04T14:38:33.582592Z",
"updated_at": "2022-09-04T14:38:33.582621Z",
"structure_string": "Al2 Co2 O6\n1.0\n1.539291 -2.666131 -0.000000\n1.539291 2.666131 -0.000000\n0.000000 0.000000 11.510431\nAl Co O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.666666 0.333333 0.750000 Co\n0.333333 0.666666 0.250000 Co\n0.333333 0.666666 0.420977 O\n0.666666 0.333333 0.920977 O\n0.666666 0.333333 0.579023 O\n0.333333 0.666666 0.079023 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"Co",
"O"
],
"chemical_system": "Al-Co-O",
"density": 4.7073644267443555,
"density_atomic": 0.10584642735460104,
"volume": 94.476500056998,
"volume_molar": 5.6895078185539,
"formula_full": "Al2 Co2 O6",
"formula_reduced": "AlCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.1893828400000004,
"spacegroup": 194
},
{
"id": "jvasp-20925",
"created_at": "2022-09-04T14:38:33.594142Z",
"updated_at": "2022-09-04T14:38:33.594160Z",
"structure_string": "Ta8 Al2 C6\n1.0\n1.572538 -2.723715 -0.000000\n1.572538 2.723715 0.000000\n-0.000000 0.000000 24.260891\nTa Al C\n8 2 6\ndirect\n0.000000 0.000000 0.657626 Ta\n0.000000 0.000000 0.157626 Ta\n0.000000 0.000000 0.342374 Ta\n0.000000 0.000000 0.842374 Ta\n0.333333 0.666668 0.555244 Ta\n0.666668 0.333333 0.055244 Ta\n0.666668 0.333333 0.444756 Ta\n0.333333 0.666668 0.944756 Ta\n0.666668 0.333333 0.250000 Al\n0.333333 0.666668 0.750000 Al\n0.666668 0.333333 0.608154 C\n0.333333 0.666668 0.108154 C\n0.333333 0.666668 0.391846 C\n0.000000 0.000000 0.000000 C\n0.666668 0.333333 0.891846 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ta",
"Al",
"C"
],
"chemical_system": "Al-C-Ta",
"density": 12.573226467063229,
"density_atomic": 0.07698753755291274,
"volume": 207.8258443972619,
"volume_molar": 7.822228053288553,
"formula_full": "Ta8 Al2 C6",
"formula_reduced": "Ta4AlC3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 6.71574495,
"spacegroup": 194
},
{
"id": "jvasp-37538",
"created_at": "2022-09-04T14:38:33.706118Z",
"updated_at": "2022-09-04T14:38:33.706150Z",
"structure_string": "Sn2 Au6\n1.0\n2.934473 -5.082657 0.000000\n2.934473 5.082657 -0.000000\n-0.000000 -0.000000 5.303773\nSn Au\n2 6\ndirect\n0.333332 0.666667 0.250000 Sn\n0.666667 0.333332 0.750000 Sn\n0.165357 0.834642 0.750000 Au\n0.669284 0.834641 0.750000 Au\n0.165358 0.330715 0.750000 Au\n0.834642 0.165357 0.250000 Au\n0.330715 0.165358 0.250000 Au\n0.834641 0.669284 0.250000 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"Au"
],
"chemical_system": "Au-Sn",
"density": 14.895764465599902,
"density_atomic": 0.05056548098807148,
"volume": 158.2106971727851,
"volume_molar": 11.909588601403074,
"formula_full": "Sn2 Au6",
"formula_reduced": "SnAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4146036025,
"spacegroup": 194
},
{
"id": "jvasp-51666",
"created_at": "2022-09-04T14:38:33.708423Z",
"updated_at": "2022-09-04T14:38:33.708451Z",
"structure_string": "Hf6 Al6 C10\n1.0\n1.664242 -2.882553 0.000000\n1.664242 2.882553 -0.000000\n0.000000 0.000000 27.524403\nHf Al C\n6 6 10\ndirect\n0.333332 0.666666 0.405939 Hf\n0.333332 0.666666 0.094060 Hf\n0.666666 0.333332 0.905939 Hf\n0.666666 0.333332 0.594060 Hf\n0.000000 0.000000 0.000000 Hf\n0.000000 0.000000 0.500000 Hf\n0.000000 0.000000 0.750000 Al\n0.333332 0.666666 0.823957 Al\n0.666666 0.333332 0.323957 Al\n0.333332 0.666666 0.676042 Al\n0.666666 0.333332 0.176042 Al\n0.000000 0.000000 0.250000 Al\n0.666666 0.333332 0.250000 C\n0.333332 0.666666 0.950552 C\n0.000000 0.000000 0.150423 C\n0.000000 0.000000 0.650423 C\n0.666666 0.333332 0.049448 C\n0.666666 0.333332 0.450552 C\n0.333332 0.666666 0.549448 C\n0.000000 0.000000 0.349577 C\n0.000000 0.000000 0.849576 C\n0.333332 0.666666 0.750000 C\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Hf",
"Al",
"C"
],
"chemical_system": "Al-C-Hf",
"density": 8.507162762856703,
"density_atomic": 0.08330690463008487,
"volume": 264.08375269359215,
"volume_molar": 7.228861505226551,
"formula_full": "Hf6 Al6 C10",
"formula_reduced": "Hf3Al3C5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 5.620704309090908,
"spacegroup": 194
}
]
}