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=1584",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1582",
"results": [
{
"id": "jvasp-114805",
"created_at": "2022-09-04T14:38:41.293466Z",
"updated_at": "2022-09-04T14:38:41.293493Z",
"structure_string": "Pt2 S2 Cl2\n1.0\n3.478941 0.000000 0.000000\n0.000000 5.266268 0.000000\n0.000000 0.000000 6.857771\nPt S Cl\n2 2 2\ndirect\n0.499999 0.000000 0.374952 Pt\n0.000000 0.500000 0.625047 Pt\n0.000000 0.000000 0.602999 S\n0.499999 0.500000 0.397000 S\n0.000000 0.000000 0.126691 Cl\n0.499999 0.500000 0.873308 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pt",
"S",
"Cl"
],
"chemical_system": "Cl-Pt-S",
"density": 6.941352885977761,
"density_atomic": 0.04775493426398442,
"volume": 125.64146705411865,
"volume_molar": 12.610509998213416,
"formula_full": "Pt2 S2 Cl2",
"formula_reduced": "PtSCl",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2269184891666671,
"spacegroup": 59
},
{
"id": "jvasp-8675",
"created_at": "2022-09-04T14:37:07.080330Z",
"updated_at": "2022-09-04T14:37:07.080357Z",
"structure_string": "Pt1 S2 Cl6\n1.0\n4.897811 -0.271387 -0.050607\n-0.781546 6.010423 -0.023445\n-0.994963 -1.774351 7.779418\nPt S Cl\n1 2 6\ndirect\n0.500000 0.500000 0.500000 Pt\n0.207954 0.218718 0.286405 S\n0.792046 0.781281 0.713596 S\n0.560684 0.034942 0.738501 Cl\n0.174544 0.392823 0.672439 Cl\n0.825455 0.607177 0.327561 Cl\n0.218556 0.308321 0.054769 Cl\n0.781443 0.691678 0.945231 Cl\n0.439317 -0.034942 0.261499 Cl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"S",
"Cl"
],
"chemical_system": "Cl-Pt-S",
"density": 3.4556491776804417,
"density_atomic": 0.03968657602181109,
"volume": 226.77693321423718,
"volume_molar": 15.174251254858396,
"formula_full": "Pt1 S2 Cl6",
"formula_reduced": "Pt(SCl3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.890059533888889,
"spacegroup": 2
},
{
"id": "jvasp-13421",
"created_at": "2022-09-04T14:36:59.057565Z",
"updated_at": "2022-09-04T14:36:59.057593Z",
"structure_string": "Pt2 S4 Cl16\n1.0\n0.000000 6.223875 -0.069933\n7.127005 0.000000 0.000000\n0.000000 -2.044794 -12.170257\nPt S Cl\n2 4 16\ndirect\n0.000000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.700369 0.788127 0.978969 S\n0.700369 0.711872 0.478969 S\n0.299630 0.211873 0.021031 S\n0.299631 0.288127 0.521031 S\n0.256872 0.664198 0.624567 Cl\n0.743128 0.164198 0.875433 Cl\n0.743128 0.335801 0.375433 Cl\n0.256872 0.835801 0.124567 Cl\n0.298098 0.159126 0.666866 Cl\n0.701902 0.659126 0.833134 Cl\n0.701902 0.840873 0.333134 Cl\n0.219452 0.074866 0.413287 Cl\n0.780548 0.574866 0.086713 Cl\n0.171579 0.894621 0.854213 Cl\n0.219452 0.425133 0.913287 Cl\n0.780548 0.925133 0.586713 Cl\n0.828421 0.105379 0.145787 Cl\n0.171579 0.605378 0.354213 Cl\n0.298098 0.340874 0.166866 Cl\n0.828421 0.394621 0.645787 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Pt",
"S",
"Cl"
],
"chemical_system": "Cl-Pt-S",
"density": 3.333208983040695,
"density_atomic": 0.0406757799819371,
"volume": 540.8624004203372,
"volume_molar": 14.805225032376152,
"formula_full": "Pt2 S4 Cl16",
"formula_reduced": "Pt(SCl4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.7631849036363636,
"spacegroup": 14
},
{
"id": "jvasp-58908",
"created_at": "2022-09-04T14:36:30.996197Z",
"updated_at": "2022-09-04T14:36:30.996219Z",
"structure_string": "Pt2 S4 Cl16\n1.0\n0.000000 6.223151 -0.070219\n7.128407 0.000000 0.000000\n0.000000 -2.043965 -12.167527\nPt S Cl\n2 4 16\ndirect\n0.000000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.700360 0.788150 0.978947 S\n0.700360 0.711851 0.478947 S\n0.299640 0.211850 0.021054 S\n0.299641 0.288150 0.521054 S\n0.256904 0.664055 0.624645 Cl\n0.743097 0.164055 0.875355 Cl\n0.743097 0.335946 0.375355 Cl\n0.256903 0.835946 0.124645 Cl\n0.297928 0.159033 0.666871 Cl\n0.702073 0.659033 0.833129 Cl\n0.702073 0.840968 0.333129 Cl\n0.219484 0.075020 0.413228 Cl\n0.780516 0.575020 0.086773 Cl\n0.171698 0.894586 0.854225 Cl\n0.219485 0.424980 0.913228 Cl\n0.780516 0.924981 0.586773 Cl\n0.828303 0.105415 0.145775 Cl\n0.171698 0.605415 0.354225 Cl\n0.297928 0.340967 0.166871 Cl\n0.828303 0.394586 0.645775 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Pt",
"S",
"Cl"
],
"chemical_system": "Cl-Pt-S",
"density": 3.3336636466470027,
"density_atomic": 0.04068132832796342,
"volume": 540.7886345952401,
"volume_molar": 14.803205813367008,
"formula_full": "Pt2 S4 Cl16",
"formula_reduced": "Pt(SCl4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.7631976309090909,
"spacegroup": 14
},
{
"id": "jvasp-3447",
"created_at": "2022-09-04T14:36:22.036837Z",
"updated_at": "2022-09-04T14:36:22.036860Z",
"structure_string": "Pt1 Pb1 F6\n1.0\n4.812049 -0.000047 -0.664007\n-0.761917 4.751348 -0.664007\n-0.000040 -0.000047 4.857646\nPt Pb F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Pb\n0.705575 0.705575 0.062621 F\n0.705575 0.062621 0.705575 F\n0.294424 0.937378 0.294424 F\n0.294424 0.294424 0.937378 F\n0.937378 0.294424 0.294424 F\n0.062621 0.705575 0.705575 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pt",
"Pb",
"F"
],
"chemical_system": "F-Pb-Pt",
"density": 7.718960424908252,
"density_atomic": 0.07203094243989382,
"volume": 111.0633809445933,
"volume_molar": 8.360491416623033,
"formula_full": "Pt1 Pb1 F6",
"formula_reduced": "PtPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.053597989375,
"spacegroup": 166
},
{
"id": "jvasp-17598",
"created_at": "2022-09-04T14:37:58.075779Z",
"updated_at": "2022-09-04T14:37:58.075799Z",
"structure_string": "Pt3 Pb1 C1\n1.0\n4.348051 -0.000000 0.000000\n-0.000000 4.348051 0.000000\n-0.000000 0.000000 4.348051\nPt Pb C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pt",
"Pb",
"C"
],
"chemical_system": "C-Pb-Pt",
"density": 16.25066439134347,
"density_atomic": 0.06082555999302997,
"volume": 82.20228470683956,
"volume_molar": 9.900674585963664,
"formula_full": "Pt3 Pb1 C1",
"formula_reduced": "Pt3PbC",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.090335004,
"spacegroup": 221
},
{
"id": "jvasp-90225",
"created_at": "2022-09-04T14:35:52.500959Z",
"updated_at": "2022-09-04T14:35:52.500980Z",
"structure_string": "Pt1 N2 O6\n1.0\n5.275848 1.331968 2.862832\n2.277607 4.941783 2.862832\n1.603659 1.331968 5.784346\nPt N O\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Pt\n0.588632 0.588631 0.588631 N\n0.411369 0.411369 0.411368 N\n0.856980 0.307217 0.598152 O\n0.598153 0.856979 0.307216 O\n0.307218 0.598152 0.856979 O\n0.143022 0.692783 0.401847 O\n0.401848 0.143021 0.692783 O\n0.692784 0.401848 0.143020 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"N",
"O"
],
"chemical_system": "N-O-Pt",
"density": 5.034062816534088,
"density_atomic": 0.08550542629688875,
"volume": 105.25647774388653,
"volume_molar": 7.042992498616578,
"formula_full": "Pt1 N2 O6",
"formula_reduced": "Pt(NO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.593719877777778,
"spacegroup": 148
},
{
"id": "jvasp-90188",
"created_at": "2022-09-04T14:36:14.338242Z",
"updated_at": "2022-09-04T14:36:14.338268Z",
"structure_string": "Pt1 N4 Cl4\n1.0\n-2.996714 -2.996714 4.472690\n-2.996714 2.996714 -4.472690\n2.996714 -2.996714 -4.472690\nPt N Cl\n1 4 4\ndirect\n0.000000 0.000000 0.000000 Pt\n0.540420 0.770210 0.770210 N\n0.459578 0.229790 0.229790 N\n0.000000 0.229790 0.770210 N\n0.000000 0.770210 0.229790 N\n0.000000 0.267006 0.267006 Cl\n0.000000 0.732994 0.732994 Cl\n0.499999 0.000000 0.499999 Cl\n0.499999 0.499999 0.000000 Cl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"N",
"Cl"
],
"chemical_system": "Cl-N-Pt",
"density": 4.061036980804551,
"density_atomic": 0.056017423027067255,
"volume": 160.66429895661673,
"volume_molar": 10.750478038038521,
"formula_full": "Pt1 N4 Cl4",
"formula_reduced": "Pt(NCl)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 3.27973563,
"spacegroup": 139
},
{
"id": "jvasp-90033",
"created_at": "2022-09-04T14:36:10.603080Z",
"updated_at": "2022-09-04T14:36:10.603100Z",
"structure_string": "Pt1 N2 Cl6\n1.0\n-4.536492 -4.536492 -0.000000\n-4.536492 -0.000000 -4.536492\n0.000000 -4.536492 -4.536492\nPt N Cl\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Pt\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n0.747851 0.252149 0.252149 Cl\n0.747851 0.252149 0.747851 Cl\n0.747851 0.747851 0.252149 Cl\n0.252149 0.747851 0.747851 Cl\n0.252149 0.747851 0.252149 Cl\n0.252149 0.252149 0.747851 Cl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"N",
"Cl"
],
"chemical_system": "Cl-N-Pt",
"density": 3.875798820357463,
"density_atomic": 0.04820055797828748,
"volume": 186.719830174044,
"volume_molar": 12.49392333323765,
"formula_full": "Pt1 N2 Cl6",
"formula_reduced": "Pt(NCl3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.9270969227777777,
"spacegroup": 225
},
{
"id": "jvasp-90171",
"created_at": "2022-09-04T14:38:10.989018Z",
"updated_at": "2022-09-04T14:38:10.989044Z",
"structure_string": "Pt1 I6 N2\n1.0\n-5.177662 -5.177662 -0.000000\n-5.177662 -0.000000 -5.177662\n-0.000000 -5.177662 -5.177662\nPt I N\n1 6 2\ndirect\n0.000000 0.000000 0.000000 Pt\n0.744112 0.744112 0.255887 I\n0.744112 0.255887 0.255887 I\n0.744112 0.255887 0.744112 I\n0.255887 0.744112 0.744112 I\n0.255887 0.744112 0.255887 I\n0.255887 0.255887 0.744112 I\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"I",
"N"
],
"chemical_system": "I-N-Pt",
"density": 5.889038832496893,
"density_atomic": 0.03241988167888074,
"volume": 277.6074289581033,
"volume_molar": 18.575455702304424,
"formula_full": "Pt1 I6 N2",
"formula_reduced": "Pt(I3N)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.620736172222222,
"spacegroup": 225
},
{
"id": "jvasp-24318",
"created_at": "2022-09-04T14:38:28.534167Z",
"updated_at": "2022-09-04T14:38:28.534185Z",
"structure_string": "Pr4 Zr4 O14\n1.0\n6.612214 0.000000 3.817563\n2.204071 6.234055 3.817563\n0.000000 0.000000 7.635127\nPr Zr O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Pr\n0.500000 0.500000 -0.000000 Pr\n0.000000 0.500000 0.500000 Pr\n0.500000 -0.000000 0.500000 Pr\n0.500000 -0.000000 -0.000000 Zr\n0.000000 0.000000 0.000000 Zr\n-0.000000 -0.000000 0.500000 Zr\n0.000000 0.500000 -0.000000 Zr\n0.916487 0.333512 0.333512 O\n0.333512 0.333512 0.916488 O\n0.666487 0.666487 0.083512 O\n0.083512 0.666487 0.083512 O\n0.916487 0.333512 0.916488 O\n0.625000 0.625000 0.625000 O\n0.916487 0.916487 0.333512 O\n0.333512 0.916487 0.333513 O\n0.666487 0.083512 0.083512 O\n0.083512 0.083512 0.666488 O\n0.666487 0.083512 0.666488 O\n0.333512 0.916487 0.916488 O\n0.083512 0.666487 0.666488 O\n0.375000 0.375000 0.375000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Pr",
"Zr",
"O"
],
"chemical_system": "O-Pr-Zr",
"density": 6.0808332476129126,
"density_atomic": 0.06990188466378171,
"volume": 314.7268504392539,
"volume_molar": 8.61513361043934,
"formula_full": "Pr4 Zr4 O14",
"formula_reduced": "Pr2Zr2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8407948363636364,
"spacegroup": 227
},
{
"id": "jvasp-34910",
"created_at": "2022-09-04T14:37:12.603251Z",
"updated_at": "2022-09-04T14:37:12.603271Z",
"structure_string": "Pr1 Zr3 F15\n1.0\n6.889556 0.000144 -2.883584\n-4.332921 5.356471 -2.883584\n0.000069 0.000144 7.468671\nPr Zr F\n1 3 15\ndirect\n0.506232 0.506231 0.506233 Pr\n0.143519 0.143518 0.710794 Zr\n0.710794 0.143518 0.143519 Zr\n0.143519 0.710794 0.143519 Zr\n0.853197 0.066039 0.396787 F\n0.066040 0.396786 0.853196 F\n0.084230 0.325882 0.325883 F\n0.325883 0.325882 0.084231 F\n0.325883 0.084230 0.325883 F\n0.066040 0.853196 0.396787 F\n0.866035 0.645602 0.866036 F\n0.748620 0.407214 0.407215 F\n0.407215 0.407214 0.748621 F\n0.407215 0.748620 0.407215 F\n0.396787 0.853196 0.066041 F\n0.396787 0.066039 0.853196 F\n0.853197 0.396786 0.066041 F\n0.866036 0.866034 0.645604 F\n0.645603 0.866034 0.866036 F\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Pr",
"Zr",
"F"
],
"chemical_system": "F-Pr-Zr",
"density": 4.214457804685081,
"density_atomic": 0.06893248185330826,
"volume": 275.632031361252,
"volume_molar": 8.73628889906418,
"formula_full": "Pr1 Zr3 F15",
"formula_reduced": "PrZr3F15",
"formula_anonymous": "AB3C15",
"energy_above_hull": 0.6145203993421056,
"spacegroup": 160
}
]
}