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=-nelements&page=1077",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=1075",
"results": [
{
"id": "jvasp-47070",
"created_at": "2022-09-04T14:38:04.070802Z",
"updated_at": "2022-09-04T14:38:04.070837Z",
"structure_string": "Hf4 Co4 O12\n1.0\n5.385299 0.000000 0.000000\n0.000000 5.375827 0.000000\n0.000000 0.000000 7.785320\nHf Co O\n4 4 12\ndirect\n0.500000 0.000000 0.000000 Hf\n0.500000 0.000000 0.500000 Hf\n0.000000 0.500000 0.000000 Hf\n0.000000 0.500000 0.500000 Hf\n0.017569 0.027485 0.250000 Co\n0.517569 0.472516 0.750000 Co\n0.482432 0.527485 0.250000 Co\n0.982432 0.972516 0.750000 Co\n0.837109 0.835102 0.068497 O\n0.337109 0.664899 0.931503 O\n0.337109 0.664899 0.568497 O\n0.877298 0.590332 0.750000 O\n0.122702 0.409669 0.250000 O\n0.162891 0.164899 0.568497 O\n0.662891 0.335102 0.068497 O\n0.162891 0.164899 0.931503 O\n0.837109 0.835102 0.431503 O\n0.622702 0.090332 0.750000 O\n0.662891 0.335102 0.431503 O\n0.377298 0.909669 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Hf",
"Co",
"O"
],
"chemical_system": "Co-Hf-O",
"density": 8.41131776059872,
"density_atomic": 0.08873570873851007,
"volume": 225.38840658766583,
"volume_molar": 6.786603550715174,
"formula_full": "Hf4 Co4 O12",
"formula_reduced": "HfCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.914776879999999,
"spacegroup": 62
},
{
"id": "jvasp-46991",
"created_at": "2022-09-04T14:38:04.082456Z",
"updated_at": "2022-09-04T14:38:04.082485Z",
"structure_string": "Mn6 O2 F10\n1.0\n4.816929 0.108846 -0.000000\n0.108846 4.816929 0.000000\n0.000000 -0.000000 9.686408\nMn O F\n6 2 10\ndirect\n0.015724 0.984277 0.011490 Mn\n0.016253 0.983749 0.333333 Mn\n0.015724 0.984277 0.655177 Mn\n0.514295 0.485706 0.833333 Mn\n0.478961 0.521040 0.169746 Mn\n0.478961 0.521040 0.496921 Mn\n0.189040 0.810961 0.175618 O\n0.189040 0.810961 0.491049 O\n0.791359 0.208642 0.178477 F\n0.698649 0.694112 0.665050 F\n0.687143 0.705162 0.333333 F\n0.698649 0.694112 0.001617 F\n0.204130 0.795871 0.833333 F\n0.294839 0.312858 0.333333 F\n0.305889 0.301352 0.001617 F\n0.791359 0.208642 0.488191 F\n0.305889 0.301352 0.665050 F\n0.824107 0.175894 0.833333 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.077562787745647,
"density_atomic": 0.08012924789401855,
"volume": 224.63707663657797,
"volume_molar": 7.515533863446555,
"formula_full": "Mn6 O2 F10",
"formula_reduced": "Mn3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.63543629295977,
"spacegroup": 38
},
{
"id": "jvasp-30198",
"created_at": "2022-09-04T14:38:04.085986Z",
"updated_at": "2022-09-04T14:38:04.086012Z",
"structure_string": "Cu1 Te1 O4\n1.0\n4.733340 -1.074985 -0.656165\n6.767002 4.321328 -0.944979\n6.767136 2.726823 1.666163\nCu Te O\n1 1 4\ndirect\n0.500001 0.000002 0.499998 Cu\n0.500000 0.500000 0.499999 Te\n0.499917 0.000105 0.174833 O\n0.116091 0.499984 0.191996 O\n0.500076 0.999895 0.825173 O\n0.883911 0.500015 0.808004 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cu",
"Te",
"O"
],
"chemical_system": "Cu-O-Te",
"density": 5.855747041418551,
"density_atomic": 0.08292773077724686,
"volume": 72.35215462625729,
"volume_molar": 7.261914324143443,
"formula_full": "Cu1 Te1 O4",
"formula_reduced": "CuTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.729895369444445,
"spacegroup": 65
},
{
"id": "jvasp-46102",
"created_at": "2022-09-04T14:38:04.090520Z",
"updated_at": "2022-09-04T14:38:04.090545Z",
"structure_string": "Dy2 Bi6 O12\n1.0\n6.992789 -0.115041 -0.117748\n-0.273783 6.988374 -0.117746\n-0.273783 -0.280072 6.983752\nDy Bi O\n2 6 12\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500001 0.500000 0.499999 Dy\n0.069733 0.555294 0.251831 Bi\n0.251832 0.069733 0.555294 Bi\n0.444707 0.748168 0.930266 Bi\n0.555294 0.251832 0.069733 Bi\n0.748169 0.930267 0.444705 Bi\n0.930268 0.444706 0.748167 Bi\n0.811443 0.599479 0.472444 O\n0.691163 0.926654 0.069441 O\n0.599480 0.472444 0.811441 O\n0.527556 0.188558 0.400520 O\n0.472445 0.811442 0.599478 O\n0.073346 0.930557 0.308837 O\n0.308838 0.073346 0.930557 O\n0.188558 0.400521 0.527555 O\n0.926655 0.069442 0.691162 O\n0.069443 0.691162 0.926654 O\n0.400521 0.527555 0.188557 O\n0.930558 0.308838 0.073345 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Dy",
"Bi",
"O"
],
"chemical_system": "Bi-Dy-O",
"density": 8.633737098929307,
"density_atomic": 0.058720772771061684,
"volume": 340.5949727190281,
"volume_molar": 10.255554339311734,
"formula_full": "Dy2 Bi6 O12",
"formula_reduced": "Dy(BiO2)3",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.03191204,
"spacegroup": 148
},
{
"id": "jvasp-57803",
"created_at": "2022-09-04T14:38:04.095563Z",
"updated_at": "2022-09-04T14:38:04.095591Z",
"structure_string": "Pb2 Se4 O12\n1.0\n0.000000 4.865816 -0.161544\n8.849172 0.000000 0.000000\n0.000000 -2.246455 -6.682873\nPb Se O\n2 4 12\ndirect\n0.500001 0.500000 0.499999 Pb\n0.500000 0.000000 -0.000000 Pb\n0.113455 0.655361 0.818510 Se\n0.886546 0.344639 0.181488 Se\n0.113455 0.844638 0.318511 Se\n0.886547 0.155361 0.681488 Se\n0.854526 0.662797 0.587255 O\n0.769977 0.163121 0.210608 O\n0.769978 0.336879 0.710608 O\n0.382069 0.546281 0.773824 O\n0.617933 0.046281 0.726175 O\n0.230024 0.836878 0.789391 O\n0.230024 0.663121 0.289391 O\n0.145476 0.337203 0.412744 O\n0.145476 0.162797 0.912744 O\n0.382069 0.953719 0.273824 O\n0.617932 0.453719 0.226175 O\n0.854525 0.837203 0.087255 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Pb",
"Se",
"O"
],
"chemical_system": "O-Pb-Se",
"density": 5.26317964125966,
"density_atomic": 0.06186300853798904,
"volume": 290.9654804283646,
"volume_molar": 9.734639330225757,
"formula_full": "Pb2 Se4 O12",
"formula_reduced": "Pb(SeO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.2078509503703705,
"spacegroup": 14
},
{
"id": "jvasp-106985",
"created_at": "2022-09-04T14:38:04.182468Z",
"updated_at": "2022-09-04T14:38:04.182504Z",
"structure_string": "Yb1 Tc1 O3\n1.0\n3.869241 -0.000000 0.000000\n0.000000 3.869241 0.000000\n-0.000000 -0.000000 3.869241\nYb Tc O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Tc\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"Tc",
"O"
],
"chemical_system": "O-Tc-Yb",
"density": 9.145647125191553,
"density_atomic": 0.08631626925588551,
"volume": 57.926507286563165,
"volume_molar": 6.976831612296981,
"formula_full": "Yb1 Tc1 O3",
"formula_reduced": "YbTcO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.05482454,
"spacegroup": 221
},
{
"id": "jvasp-45921",
"created_at": "2022-09-04T14:38:04.083054Z",
"updated_at": "2022-09-04T14:38:04.083081Z",
"structure_string": "V4 O4 F4\n1.0\n0.000000 5.099089 -0.105507\n4.580633 0.000000 0.000000\n0.000000 -0.117030 -5.630498\nV O F\n4 4 4\ndirect\n0.221089 0.482174 0.354983 V\n0.221089 0.017825 0.854983 V\n0.778912 0.982174 0.145018 V\n0.778912 0.517825 0.645018 V\n0.084588 0.227320 0.123613 O\n0.084588 0.272680 0.623614 O\n0.915413 0.727319 0.376387 O\n0.915413 0.772680 0.876387 O\n0.418391 0.760734 0.117495 F\n0.418391 0.739265 0.617495 F\n0.581609 0.260734 0.382506 F\n0.581609 0.239266 0.882506 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.338596701201226,
"density_atomic": 0.09120730238083173,
"volume": 131.5684126901876,
"volume_molar": 6.602695839917333,
"formula_full": "V4 O4 F4",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0541226608333334,
"spacegroup": 14
},
{
"id": "jvasp-37970",
"created_at": "2022-09-04T14:38:04.184448Z",
"updated_at": "2022-09-04T14:38:04.184473Z",
"structure_string": "Ce2 Cd1 Hg1\n1.0\n-0.000000 3.803087 3.803087\n3.803087 0.000000 3.803087\n3.803087 3.803087 0.000000\nCe Cd Hg\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Ce\n0.000000 0.000000 0.000000 Ce\n0.250000 0.250000 0.250000 Cd\n0.750001 0.750001 0.750001 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Cd",
"Hg"
],
"chemical_system": "Cd-Ce-Hg",
"density": 8.954382086990607,
"density_atomic": 0.03635977726479489,
"volume": 110.01167501300876,
"volume_molar": 16.562644804292837,
"formula_full": "Ce2 Cd1 Hg1",
"formula_reduced": "Ce2CdHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5685232812500001,
"spacegroup": 225
},
{
"id": "jvasp-35171",
"created_at": "2022-09-04T14:38:04.196681Z",
"updated_at": "2022-09-04T14:38:04.196702Z",
"structure_string": "Li8 N3 O1\n1.0\n4.757046 -0.000000 0.000000\n-0.000000 4.757046 -0.000000\n0.000000 0.000000 4.757046\nLi N O\n8 3 1\ndirect\n0.257767 0.742234 0.257767 Li\n0.742234 0.257767 0.257767 Li\n0.742234 0.742234 0.742234 Li\n0.257767 0.257767 0.742234 Li\n0.257767 0.742234 0.742234 Li\n0.742234 0.257767 0.742234 Li\n0.742234 0.742234 0.257767 Li\n0.257767 0.257767 0.257767 Li\n0.000000 0.500000 0.000000 N\n0.500000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.500000 0.500000 0.500000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"N",
"O"
],
"chemical_system": "Li-N-O",
"density": 1.7515180657622658,
"density_atomic": 0.11147287264993161,
"volume": 107.64950893195953,
"volume_molar": 5.402337462776147,
"formula_full": "Li8 N3 O1",
"formula_reduced": "Li8N3O",
"formula_anonymous": "AB3C8",
"energy_above_hull": 2.3251627708333333,
"spacegroup": 221
},
{
"id": "jvasp-40222",
"created_at": "2022-09-04T14:38:04.222116Z",
"updated_at": "2022-09-04T14:38:04.222135Z",
"structure_string": "Li1 Dy1 Tl2\n1.0\n0.000000 3.646182 3.646182\n3.646182 0.000000 3.646182\n3.646182 3.646182 0.000000\nLi Dy Tl\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Li\n0.250001 0.250001 0.250001 Dy\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Dy",
"Tl"
],
"chemical_system": "Dy-Li-Tl",
"density": 9.903480921354587,
"density_atomic": 0.041258645609626846,
"volume": 96.94937729770469,
"volume_molar": 14.596069917028153,
"formula_full": "Li1 Dy1 Tl2",
"formula_reduced": "LiDyTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1202304249999999,
"spacegroup": 225
},
{
"id": "jvasp-33682",
"created_at": "2022-09-04T14:38:04.242660Z",
"updated_at": "2022-09-04T14:38:04.242679Z",
"structure_string": "Br6 Cl6 O6\n1.0\n9.071043 -0.143160 -0.317005\n-3.741738 8.264605 -0.316997\n-3.741722 -5.702100 5.990858\nBr Cl O\n6 6 6\ndirect\n0.254658 0.728470 0.575631 Br\n0.271530 0.424368 0.745342 Br\n0.424368 0.745342 0.271529 Br\n0.575632 0.254658 0.728470 Br\n0.728470 0.575632 0.254657 Br\n0.745342 0.271529 0.424367 Br\n0.926588 0.871814 0.642320 Cl\n0.357678 0.073410 0.128185 Cl\n0.871814 0.642321 0.926588 Cl\n0.128186 0.357679 0.073410 Cl\n0.642321 0.926589 0.871813 Cl\n0.073411 0.128186 0.357679 Cl\n0.158549 0.536848 0.706749 O\n0.293251 0.841451 0.463152 O\n0.463152 0.293251 0.841451 O\n0.536847 0.706749 0.158548 O\n0.706748 0.158548 0.536847 O\n0.841451 0.463152 0.293250 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Br",
"Cl",
"O"
],
"chemical_system": "Br-Cl-O",
"density": 3.1705044940391423,
"density_atomic": 0.04360630547863942,
"volume": 412.78433938452577,
"volume_molar": 13.8102521960957,
"formula_full": "Br6 Cl6 O6",
"formula_reduced": "BrClO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7705672241666668,
"spacegroup": 148
},
{
"id": "jvasp-37752",
"created_at": "2022-09-04T14:38:04.256015Z",
"updated_at": "2022-09-04T14:38:04.256034Z",
"structure_string": "Pm1 Y1 Al2\n1.0\n0.000000 3.652544 3.652544\n3.652544 0.000000 3.652544\n3.652544 3.652544 0.000000\nPm Y Al\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.750000 Y\n0.499998 0.499998 0.499998 Al\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Y",
"Al"
],
"chemical_system": "Al-Pm-Y",
"density": 4.9048702365129335,
"density_atomic": 0.04104342802306177,
"volume": 97.4577464083276,
"volume_molar": 14.67260667558333,
"formula_full": "Pm1 Y1 Al2",
"formula_reduced": "PmYAl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.85740805625,
"spacegroup": 225
}
]
}