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=-volume_molar&page=1211",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=1209",
"results": [
{
"id": "jvasp-90902",
"created_at": "2022-09-04T14:36:01.578046Z",
"updated_at": "2022-09-04T14:36:01.578070Z",
"structure_string": "Ta4 Tl4 S12\n1.0\n3.521982 0.000000 0.000000\n-0.000000 9.292236 0.000000\n0.000000 0.000000 14.397911\nTa Tl S\n4 4 12\ndirect\n0.750000 0.838696 0.429087 Ta\n0.250000 0.161304 0.570913 Ta\n0.750000 0.338696 0.070913 Ta\n0.250000 0.661304 0.929087 Ta\n0.250000 0.968617 0.170378 Tl\n0.250000 0.468616 0.329622 Tl\n0.750000 0.531384 0.670378 Tl\n0.750000 0.031384 0.829622 Tl\n0.750000 0.810077 0.000125 S\n0.250000 0.189924 -0.000125 S\n0.250000 0.522698 0.099515 S\n0.750000 0.742472 0.285286 S\n0.250000 0.257529 0.714714 S\n0.750000 0.242472 0.214714 S\n0.250000 0.757529 0.785286 S\n0.750000 0.977302 0.599515 S\n0.250000 0.022698 0.400485 S\n0.750000 0.477302 0.900485 S\n0.250000 0.689924 0.500125 S\n0.750000 0.310076 0.499875 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ta",
"Tl",
"S"
],
"chemical_system": "S-Ta-Tl",
"density": 6.787692273747625,
"density_atomic": 0.042444668659758725,
"volume": 471.20169933053944,
"volume_molar": 14.18821479859853,
"formula_full": "Ta4 Tl4 S12",
"formula_reduced": "TaTlS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.32369036,
"spacegroup": 62
},
{
"id": "jvasp-118262",
"created_at": "2022-09-04T14:38:52.768721Z",
"updated_at": "2022-09-04T14:38:52.768740Z",
"structure_string": "Na1 In1 F1\n1.0\n3.175673 1.525239 0.000000\n0.415626 7.041713 0.000000\n0.000000 0.000000 3.252749\nNa In F\n1 1 1\ndirect\n0.015723 -0.132417 0.000000 Na\n-0.040199 0.424305 0.000000 In\n0.331001 0.057255 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"In",
"F"
],
"chemical_system": "F-In-Na",
"density": 3.6841471889429718,
"density_atomic": 0.0424468997791586,
"volume": 70.6765397616388,
"volume_molar": 14.187469029144188,
"formula_full": "Na1 In1 F1",
"formula_reduced": "NaInF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 25
},
{
"id": "jvasp-23339",
"created_at": "2022-09-04T14:37:47.095808Z",
"updated_at": "2022-09-04T14:37:47.095818Z",
"structure_string": "U4 Te4 S4\n1.0\n4.184961 0.000000 0.000000\n-0.000000 7.609213 0.000000\n0.000000 0.000000 8.877579\nU Te S\n4 4 4\ndirect\n0.250000 0.706563 0.623637 U\n0.750000 0.293437 0.376363 U\n0.250000 0.206563 0.876363 U\n0.750000 0.793437 0.123637 U\n0.250000 0.475709 0.160257 Te\n0.750000 0.024291 0.660257 Te\n0.250000 0.975709 0.339743 Te\n0.750000 0.524291 0.839743 Te\n0.750000 0.647460 0.427876 S\n0.250000 0.852539 0.927876 S\n0.750000 0.147460 0.072124 S\n0.250000 0.352539 0.572124 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Te",
"S"
],
"chemical_system": "S-Te-U",
"density": 9.343989189753476,
"density_atomic": 0.04244783495431934,
"volume": 282.69993070115163,
"volume_molar": 14.187156462704838,
"formula_full": "U4 Te4 S4",
"formula_reduced": "UTeS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2467645888888885,
"spacegroup": 62
},
{
"id": "jvasp-20317",
"created_at": "2022-09-04T14:38:30.885824Z",
"updated_at": "2022-09-04T14:38:30.885843Z",
"structure_string": "Sb8 Pt4\n1.0\n6.563063 0.000000 0.000000\n-0.000000 6.563063 0.000000\n-0.000000 -0.000000 6.563063\nSb Pt\n8 4\ndirect\n0.374841 0.125159 0.874841 Sb\n0.125159 0.874841 0.374841 Sb\n0.874841 0.374841 0.125159 Sb\n0.625159 0.625159 0.625159 Sb\n0.374841 0.374841 0.374841 Sb\n0.125159 0.625159 0.874841 Sb\n0.874841 0.125159 0.625159 Sb\n0.625159 0.874841 0.125159 Sb\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 Pt\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sb",
"Pt"
],
"chemical_system": "Pt-Sb",
"density": 10.30533128090318,
"density_atomic": 0.042448419695312885,
"volume": 282.69603641628686,
"volume_molar": 14.18696102994138,
"formula_full": "Sb8 Pt4",
"formula_reduced": "Sb2Pt",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5809212000000004,
"spacegroup": 205
},
{
"id": "jvasp-93165",
"created_at": "2022-09-04T14:35:57.929377Z",
"updated_at": "2022-09-04T14:35:57.929402Z",
"structure_string": "Na1 Li1 Mg6\n1.0\n6.511028 -0.017102 0.000000\n-3.270326 5.630165 0.000000\n0.000000 0.000000 5.148777\nNa Li Mg\n1 1 6\ndirect\n0.328707 0.171293 0.750000 Na\n0.162330 0.337669 0.250000 Li\n0.166997 0.825432 0.250000 Mg\n0.674568 0.333002 0.250000 Mg\n0.667948 0.832051 0.250000 Mg\n0.329178 0.663793 0.750000 Mg\n0.836207 0.170822 0.750000 Mg\n0.834060 0.665939 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Li",
"Mg"
],
"chemical_system": "Li-Mg-Na",
"density": 1.5486717646738666,
"density_atomic": 0.042450061634717026,
"volume": 188.4567346177265,
"volume_molar": 14.186412287973921,
"formula_full": "Na1 Li1 Mg6",
"formula_reduced": "NaLiMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-18692",
"created_at": "2022-09-04T14:36:59.446802Z",
"updated_at": "2022-09-04T14:36:59.446835Z",
"structure_string": "Dy2 Ga2\n1.0\n4.037799 0.000000 -0.000000\n-0.000000 4.021482 -1.573608\n0.000000 -0.041619 5.819055\nDy Ga\n2 2\ndirect\n0.250000 0.860682 0.721366 Dy\n0.750000 0.139318 0.278635 Dy\n0.250000 0.577652 0.155306 Ga\n0.750000 0.422347 0.844695 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Dy",
"Ga"
],
"chemical_system": "Dy-Ga",
"density": 8.184990545846087,
"density_atomic": 0.04245157904547642,
"volume": 94.2249991623394,
"volume_molar": 14.185905201662248,
"formula_full": "Dy2 Ga2",
"formula_reduced": "DyGa",
"formula_anonymous": "AB",
"energy_above_hull": 0.0758038333333332,
"spacegroup": 63
},
{
"id": "jvasp-115288",
"created_at": "2022-09-04T14:38:44.030955Z",
"updated_at": "2022-09-04T14:38:44.030984Z",
"structure_string": "Te1 Pb1 O1\n1.0\n5.111765 -0.000000 0.000000\n-2.555883 4.426918 -0.000000\n-0.000000 -0.000000 3.122877\nTe Pb O\n1 1 1\ndirect\n0.666668 0.333333 0.000000 Te\n0.333334 0.666666 0.000000 Pb\n0.000000 0.000000 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Te",
"Pb",
"O"
],
"chemical_system": "O-Pb-Te",
"density": 8.242912743434102,
"density_atomic": 0.04245159555333828,
"volume": 70.66872189128091,
"volume_molar": 14.185899685286234,
"formula_full": "Te1 Pb1 O1",
"formula_reduced": "TePbO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1502640288888892,
"spacegroup": 187
},
{
"id": "jvasp-106500",
"created_at": "2022-09-04T14:36:47.490707Z",
"updated_at": "2022-09-04T14:36:47.490731Z",
"structure_string": "Ca1 Yb1 Ga2\n1.0\n4.423395 -0.000000 2.553848\n1.474465 4.170417 2.553848\n-0.000000 -0.000000 5.107697\nYb Ca Ga\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.499999 0.500000 0.500001 Ca\n0.249999 0.250000 0.250001 Ga\n0.749998 0.750001 0.750002 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ca",
"Ga"
],
"chemical_system": "Ca-Ga-Yb",
"density": 6.213363062518458,
"density_atomic": 0.04245214709204753,
"volume": 94.22373835007538,
"volume_molar": 14.1857153819391,
"formula_full": "Ca1 Yb1 Ga2",
"formula_reduced": "CaYbGa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100665",
"created_at": "2022-09-04T14:36:40.473153Z",
"updated_at": "2022-09-04T14:36:40.473168Z",
"structure_string": "Ba1 Ga2 Ge1 S6\n1.0\n6.115308 0.016487 -1.238458\n-1.280620 6.053418 -1.092226\n-0.036179 0.046505 6.356507\nBa Ga Ge S\n1 2 1 6\ndirect\n0.051631 0.053466 0.066524 Ba\n0.515648 0.665939 0.242529 Ga\n0.248923 0.530134 0.658420 Ga\n0.665579 0.241168 0.520516 Ge\n0.928620 0.471385 0.793819 S\n0.801341 0.929153 0.488526 S\n0.480160 0.802133 0.928882 S\n0.335127 0.183832 0.609309 S\n0.613971 0.325554 0.187044 S\n0.173840 0.612084 0.319270 S\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Ga",
"Ge",
"S"
],
"chemical_system": "Ba-Ga-Ge-S",
"density": 3.8194029892605443,
"density_atomic": 0.04245266716581565,
"volume": 235.55646011453302,
"volume_molar": 14.185541597370436,
"formula_full": "Ba1 Ga2 Ge1 S6",
"formula_reduced": "BaGa2GeS6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.220472657,
"spacegroup": 1
},
{
"id": "jvasp-79268",
"created_at": "2022-09-04T14:36:40.790052Z",
"updated_at": "2022-09-04T14:36:40.790074Z",
"structure_string": "La1 In1 Ag2\n1.0\n4.423354 0.000000 2.553825\n1.474451 4.170379 2.553825\n0.000000 -0.000000 5.107650\nLa In Ag\n1 1 2\ndirect\n0.499999 0.500000 0.499999 La\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Ag\n0.749999 0.750000 0.749999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"In",
"Ag"
],
"chemical_system": "Ag-In-La",
"density": 8.273689523417072,
"density_atomic": 0.04245331804976089,
"volume": 94.22113944807501,
"volume_molar": 14.18532410809741,
"formula_full": "La1 In1 Ag2",
"formula_reduced": "LaInAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1144548724999999,
"spacegroup": 225
},
{
"id": "jvasp-23730",
"created_at": "2022-09-04T14:37:36.048530Z",
"updated_at": "2022-09-04T14:37:36.048547Z",
"structure_string": "Hf4 In10\n1.0\n10.376874 0.000000 0.000000\n0.000000 10.376874 -0.000000\n0.000000 0.000000 3.062539\nHf In\n4 10\ndirect\n0.320032 0.820032 0.500000 Hf\n0.820032 0.679967 0.500000 Hf\n0.179968 0.320032 0.500000 Hf\n0.679967 0.179968 0.500000 Hf\n0.437969 0.291832 0.000000 In\n0.562031 0.708167 0.000000 In\n0.708167 0.437969 0.000000 In\n0.291832 0.562031 0.000000 In\n0.500000 0.000000 0.000000 In\n0.000000 0.500000 0.000000 In\n0.208167 0.062031 0.000000 In\n0.062031 0.791832 0.000000 In\n0.937969 0.208167 0.000000 In\n0.791832 0.937969 0.000000 In\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Hf",
"In"
],
"chemical_system": "Hf-In",
"density": 9.376628546913338,
"density_atomic": 0.042453482432343655,
"volume": 329.7727111624168,
"volume_molar": 14.185269181620695,
"formula_full": "Hf4 In10",
"formula_reduced": "Hf2In5",
"formula_anonymous": "A2B5",
"energy_above_hull": 1.3681508357142858,
"spacegroup": 127
},
{
"id": "jvasp-33905",
"created_at": "2022-09-04T14:38:32.533182Z",
"updated_at": "2022-09-04T14:38:32.533206Z",
"structure_string": "Te8 Mo8 S8\n1.0\n-1.855841 -2.822378 0.000235\n0.000076 0.001164 14.558487\n-7.749148 9.138150 -0.001826\nTe Mo S\n8 8 8\ndirect\n0.703260 0.106381 0.703304 Te\n0.073343 0.886244 0.573310 Te\n0.926654 0.113759 0.426686 Te\n0.426690 0.386249 0.926722 Te\n0.573315 0.613755 0.073282 Te\n0.296741 0.893622 0.296697 Te\n0.203296 0.393631 0.203340 Te\n0.796703 0.606372 0.796658 Te\n0.357540 0.250846 0.357575 Mo\n0.642454 0.749153 0.642418 Mo\n0.857548 0.249155 0.857583 Mo\n0.892482 0.764213 0.392437 Mo\n0.107516 0.235788 0.607560 Mo\n0.392480 0.735780 0.892435 Mo\n0.607522 0.264220 0.107566 Mo\n0.142459 0.750844 0.142423 Mo\n0.182241 0.160313 0.182286 S\n0.450641 0.153925 0.950677 S\n0.049337 0.653923 0.549301 S\n0.950661 0.346076 0.450696 S\n0.682273 0.339688 0.682318 S\n0.817753 0.839683 0.817707 S\n0.317729 0.660309 0.317683 S\n0.549365 0.846072 0.049328 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.006549140958763,
"density_atomic": 0.04245490239378469,
"volume": 565.3057396620832,
"volume_molar": 14.184794736170748,
"formula_full": "Te8 Mo8 S8",
"formula_reduced": "TeMoS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.413807888888889,
"spacegroup": 55
}
]
}