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=1581",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1579",
"results": [
{
"id": "jvasp-81001",
"created_at": "2022-09-04T14:37:08.793995Z",
"updated_at": "2022-09-04T14:37:08.794025Z",
"structure_string": "Li2 Hg1 Pb1\n1.0\n-9.320667 0.000000 -5.381289\n-6.163676 -0.903067 -0.086780\n-4.735737 3.135752 -2.560040\nLi Hg Pb\n2 1 1\ndirect\n0.758611 0.000000 0.000000 Li\n0.241389 0.000000 0.000000 Li\n0.000000 0.000000 0.000000 Hg\n0.500000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Hg",
"Pb"
],
"chemical_system": "Hg-Li-Pb",
"density": 6.802201923268676,
"density_atomic": 0.03885846579713417,
"volume": 102.93767182890174,
"volume_molar": 15.497628731508323,
"formula_full": "Li2 Hg1 Pb1",
"formula_reduced": "Li2HgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-24699",
"created_at": "2022-09-04T14:37:08.812586Z",
"updated_at": "2022-09-04T14:37:08.812599Z",
"structure_string": "Rb2 Li2 Cl4\n1.0\n3.942801 0.000000 -1.128621\n0.000000 7.120722 0.000000\n0.011051 0.000000 7.489943\nRb Li Cl\n2 2 4\ndirect\n0.369997 0.250000 0.739993 Rb\n0.630003 0.750000 0.260006 Rb\n0.895761 0.750000 0.791524 Li\n0.104238 0.250000 0.208476 Li\n0.000000 0.000000 0.000000 Cl\n0.000000 0.500000 0.000000 Cl\n0.690326 0.250000 0.380652 Cl\n0.309673 0.750000 0.619347 Cl\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Li",
"Cl"
],
"chemical_system": "Cl-Li-Rb",
"density": 2.5781836627747787,
"density_atomic": 0.038027624998414375,
"volume": 210.3733798872155,
"volume_molar": 15.836226322972058,
"formula_full": "Rb2 Li2 Cl4",
"formula_reduced": "RbLiCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-8435",
"created_at": "2022-09-04T14:37:08.814518Z",
"updated_at": "2022-09-04T14:37:08.814547Z",
"structure_string": "Co3 Sn1 C1\n1.0\n3.844916 -0.000000 -0.000000\n0.000000 3.844916 -0.000000\n0.000000 0.000000 3.844916\nCo Sn C\n3 1 1\ndirect\n0.000000 0.500001 0.500001 Co\n0.500001 0.500001 0.000000 Co\n0.500001 0.000000 0.500001 Co\n0.000000 0.000000 0.000000 Sn\n0.500001 0.500001 0.500001 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"Sn",
"C"
],
"chemical_system": "C-Co-Sn",
"density": 8.983845972322078,
"density_atomic": 0.08796490454309236,
"volume": 56.840850632090365,
"volume_molar": 6.8460720684916625,
"formula_full": "Co3 Sn1 C1",
"formula_reduced": "Co3SnC",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.47688088,
"spacegroup": 221
},
{
"id": "jvasp-79729",
"created_at": "2022-09-04T14:37:08.710767Z",
"updated_at": "2022-09-04T14:37:08.710785Z",
"structure_string": "Tl2 Hg1 Se1\n1.0\n-18.920188 6.529419 -0.258117\n-13.091769 3.071979 2.189572\n-11.726796 6.933847 -0.174779\nTl Hg Se\n2 1 1\ndirect\n0.741896 -0.000777 -0.000778 Tl\n0.258106 0.000775 0.000777 Tl\n0.500001 -0.000001 -0.000000 Hg\n0.999999 -0.000000 0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"Hg",
"Se"
],
"chemical_system": "Hg-Se-Tl",
"density": 8.863984900589895,
"density_atomic": 0.03102070459106405,
"volume": 128.94613622516673,
"volume_molar": 19.413294570152225,
"formula_full": "Tl2 Hg1 Se1",
"formula_reduced": "Tl2HgSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-34220",
"created_at": "2022-09-04T14:37:08.719667Z",
"updated_at": "2022-09-04T14:37:08.719681Z",
"structure_string": "Li4 C1 O4\n1.0\n4.452601 -0.170244 0.111335\n0.183391 4.394003 0.072181\n-0.095531 -0.070021 4.396834\nLi C O\n4 1 4\ndirect\n0.004330 0.505035 0.005293 Li\n0.504319 0.002881 0.504473 Li\n0.004330 0.005286 0.505041 Li\n0.504319 0.504473 0.002868 Li\n0.504220 0.004658 0.004659 C\n0.692548 0.190327 0.190332 O\n0.314887 0.818704 0.190769 O\n0.694597 0.818108 0.818105 O\n0.314880 0.190768 0.818699 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"C",
"O"
],
"chemical_system": "C-Li-O",
"density": 1.998371739138551,
"density_atomic": 0.10437301974854073,
"volume": 86.2291808906471,
"volume_molar": 5.7698251660331,
"formula_full": "Li4 C1 O4",
"formula_reduced": "Li4CO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.227791555555556,
"spacegroup": 111
},
{
"id": "jvasp-33078",
"created_at": "2022-09-04T14:37:08.722453Z",
"updated_at": "2022-09-04T14:37:08.722473Z",
"structure_string": "Al6 Bi10 Br24\n1.0\n10.820129 0.111962 6.429685\n3.712224 10.164011 6.429685\n0.158338 0.111962 12.585347\nAl Bi Br\n6 10 24\ndirect\n0.769900 0.730100 0.250000 Al\n0.250000 0.769900 0.730100 Al\n0.230100 0.269900 0.750000 Al\n0.269900 0.750000 0.230100 Al\n0.730100 0.250000 0.769900 Al\n0.750000 0.230100 0.269900 Al\n0.250000 0.405321 0.094679 Bi\n0.094679 0.250000 0.405321 Bi\n0.405321 0.094679 0.250000 Bi\n0.750000 0.594678 0.905321 Bi\n0.327315 0.327314 0.327314 Bi\n0.594679 0.905321 0.750000 Bi\n0.827315 0.827314 0.827314 Bi\n0.672685 0.672685 0.672685 Bi\n0.172685 0.172685 0.172685 Bi\n0.905321 0.750000 0.594678 Bi\n0.309237 0.932317 0.039624 Br\n0.595648 0.771375 0.200561 Br\n0.799439 0.404352 0.228624 Br\n0.039625 0.309237 0.932318 Br\n0.690763 0.067682 0.960375 Br\n0.299439 0.728625 0.904352 Br\n0.190763 0.460375 0.567683 Br\n0.932318 0.039624 0.309237 Br\n0.904352 0.299439 0.728625 Br\n0.960375 0.690762 0.067682 Br\n0.728625 0.904352 0.299439 Br\n0.809237 0.539624 0.432317 Br\n0.567683 0.190762 0.460375 Br\n0.771375 0.200561 0.595648 Br\n0.700561 0.271375 0.095648 Br\n0.460375 0.567682 0.190762 Br\n0.539625 0.432317 0.809237 Br\n0.228625 0.799439 0.404352 Br\n0.432317 0.809237 0.539624 Br\n0.404352 0.228625 0.799439 Br\n0.067682 0.960375 0.690763 Br\n0.200561 0.595648 0.771375 Br\n0.095648 0.700561 0.271375 Br\n0.271375 0.095648 0.700561 Br\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Al",
"Bi",
"Br"
],
"chemical_system": "Al-Bi-Br",
"density": 5.077678694498043,
"density_atomic": 0.029336187287223415,
"volume": 1363.5037030671303,
"volume_molar": 20.52802806662876,
"formula_full": "Al6 Bi10 Br24",
"formula_reduced": "Al3Bi5Br12",
"formula_anonymous": "A3B5C12",
"energy_above_hull": 0.4991759579999999,
"spacegroup": 167
},
{
"id": "jvasp-50795",
"created_at": "2022-09-04T14:37:08.725051Z",
"updated_at": "2022-09-04T14:37:08.725073Z",
"structure_string": "Li6 Bi2 S6\n1.0\n6.956467 2.310562 2.513048\n1.765712 7.114308 2.513048\n1.765712 1.907964 7.299896\nLi Bi S\n6 2 6\ndirect\n0.083165 0.368659 0.686413 Li\n0.313587 0.916834 0.631342 Li\n0.368659 0.686412 0.083166 Li\n0.631340 0.313587 0.916836 Li\n0.686413 0.083165 0.368660 Li\n0.916834 0.631340 0.313588 Li\n0.169186 0.169186 0.169187 Bi\n0.830813 0.830813 0.830815 Bi\n0.047930 0.769025 0.420284 S\n0.230974 0.579716 0.952071 S\n0.420283 0.047929 0.769026 S\n0.579716 0.952070 0.230975 S\n0.769026 0.420283 0.047931 S\n0.952070 0.230974 0.579718 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Bi",
"S"
],
"chemical_system": "Bi-Li-S",
"density": 3.7949844212472805,
"density_atomic": 0.049073097482255315,
"volume": 285.2886962161367,
"volume_molar": 12.271776327503249,
"formula_full": "Li6 Bi2 S6",
"formula_reduced": "Li3BiS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.258132042857143,
"spacegroup": 148
},
{
"id": "jvasp-8743",
"created_at": "2022-09-04T14:37:08.728450Z",
"updated_at": "2022-09-04T14:37:08.728460Z",
"structure_string": "Ti1 Al1 Fe2\n1.0\n3.563319 0.000000 2.057284\n1.187773 3.359529 2.057284\n-0.000000 -0.000000 4.114566\nTi Al Fe\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Fe\n0.750000 0.750000 0.750000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-Ti",
"density": 6.28869506495247,
"density_atomic": 0.08120875648577354,
"volume": 49.25577207552409,
"volume_molar": 7.4156298170320865,
"formula_full": "Ti1 Al1 Fe2",
"formula_reduced": "TiAlFe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9665755333333337,
"spacegroup": 225
},
{
"id": "jvasp-50893",
"created_at": "2022-09-04T14:37:08.730064Z",
"updated_at": "2022-09-04T14:37:08.730085Z",
"structure_string": "Na2 Lu2 O4\n1.0\n1.673846 -2.724358 3.197481\n-1.673846 2.724358 3.197481\n-4.219708 -2.592590 3.197481\nNa Lu O\n2 2 4\ndirect\n0.249999 0.750000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.750000 0.250000 0.500000 Lu\n0.000000 0.000000 0.000000 Lu\n0.526269 0.026269 0.947460 O\n0.223730 0.223730 0.552540 O\n0.776269 0.776269 0.447460 O\n0.973731 0.473730 0.052540 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Lu",
"O"
],
"chemical_system": "Lu-Na-O",
"density": 7.541378926786055,
"density_atomic": 0.0789982962004266,
"volume": 101.26800684033992,
"volume_molar": 7.623127395964623,
"formula_full": "Na2 Lu2 O4",
"formula_reduced": "NaLuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5795954375000001,
"spacegroup": 141
},
{
"id": "jvasp-48620",
"created_at": "2022-09-04T14:37:08.734549Z",
"updated_at": "2022-09-04T14:37:08.734568Z",
"structure_string": "V4 O4 F6\n1.0\n3.784901 0.000000 0.000000\n1.892450 4.772265 0.000000\n-0.000000 -0.000000 9.642303\nV O F\n4 4 6\ndirect\n0.152882 0.694236 0.056892 V\n0.152882 0.694236 0.443108 V\n0.847118 0.305763 0.943108 V\n0.847118 0.305763 0.556892 V\n0.329277 0.341446 0.545852 O\n0.329277 0.341446 0.954147 O\n0.670723 0.658553 0.045853 O\n0.670723 0.658553 0.454147 O\n0.043672 0.912655 0.882848 F\n0.043672 0.912655 0.617151 F\n0.216350 0.567298 0.250000 F\n0.783650 0.432701 0.750000 F\n0.956328 0.087344 0.117151 F\n0.956328 0.087344 0.382848 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.639760980620447,
"density_atomic": 0.08038373562165617,
"volume": 174.1645855561391,
"volume_molar": 7.491740354472375,
"formula_full": "V4 O4 F6",
"formula_reduced": "V2O2F3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.7436608925,
"spacegroup": 63
},
{
"id": "jvasp-102547",
"created_at": "2022-09-04T14:37:08.764736Z",
"updated_at": "2022-09-04T14:37:08.764766Z",
"structure_string": "Pm1 Ge1 Pd2\n1.0\n4.128346 -0.000000 2.383502\n1.376115 3.892242 2.383502\n-0.000000 -0.000000 4.767003\nPm Ge Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500001 0.500000 0.499999 Ge\n0.250001 0.250000 0.249999 Pd\n0.750002 0.750000 0.749998 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ge",
"Pd"
],
"chemical_system": "Ge-Pd-Pm",
"density": 9.332128878846678,
"density_atomic": 0.052220213453165756,
"volume": 76.5986911100515,
"volume_molar": 11.53220249741227,
"formula_full": "Pm1 Ge1 Pd2",
"formula_reduced": "PmGePd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.25789463125,
"spacegroup": 225
},
{
"id": "jvasp-49831",
"created_at": "2022-09-04T14:37:08.773748Z",
"updated_at": "2022-09-04T14:37:08.773772Z",
"structure_string": "Ba2 Mg2 Ge2\n1.0\n4.669748 0.000000 -0.000000\n0.000000 4.669748 0.000000\n-0.000000 0.000000 7.883747\nBa Mg Ge\n2 2 2\ndirect\n0.000000 0.500000 0.340920 Ba\n0.500000 0.000000 0.659081 Ba\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.792742 Ge\n0.500000 0.000000 0.207259 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ge"
],
"chemical_system": "Ba-Ge-Mg",
"density": 4.525639017817176,
"density_atomic": 0.03490050266825946,
"volume": 171.9172946313105,
"volume_molar": 17.25516912246907,
"formula_full": "Ba2 Mg2 Ge2",
"formula_reduced": "BaMgGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
}
]
}