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=created_at&page=3444",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=3442",
"results": [
{
"id": "jvasp-9155",
"created_at": "2022-09-04T14:38:08.893765Z",
"updated_at": "2022-09-04T14:38:08.893783Z",
"structure_string": "Ge6 N8\n1.0\n5.096263 -0.000000 2.942329\n1.698754 4.804803 2.942329\n0.000000 0.000000 5.884657\nGe N\n6 8\ndirect\n0.500000 -0.000000 0.500001 Ge\n-0.000000 0.500000 0.500001 Ge\n0.499999 0.500000 0.000001 Ge\n0.499999 0.500000 0.500001 Ge\n0.125000 0.125000 0.125000 Ge\n0.874999 0.875000 0.875002 Ge\n0.741822 0.741823 0.741824 N\n0.258177 0.258177 0.725469 N\n0.258176 0.725468 0.258178 N\n0.725468 0.258177 0.258178 N\n0.741823 0.274532 0.741824 N\n0.274531 0.741823 0.741824 N\n0.258177 0.258177 0.258177 N\n0.741822 0.741823 0.274533 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ge",
"N"
],
"chemical_system": "Ge-N",
"density": 6.313886235609322,
"density_atomic": 0.09715820066751678,
"volume": 144.0948875526126,
"volume_molar": 6.198283540272892,
"formula_full": "Ge6 N8",
"formula_reduced": "Ge3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.7497744071428567,
"spacegroup": 227
},
{
"id": "jvasp-37131",
"created_at": "2022-09-04T14:38:08.893888Z",
"updated_at": "2022-09-04T14:38:08.893903Z",
"structure_string": "Os2 C2\n1.0\n1.470630 -2.547206 -0.000000\n1.470630 2.547206 0.000000\n-0.000000 -0.000000 5.526588\nOs C\n2 2\ndirect\n0.000000 0.000000 0.500000 Os\n0.000000 0.000000 0.000000 Os\n0.333333 0.666667 0.750000 C\n0.666667 0.333333 0.250000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Os",
"C"
],
"chemical_system": "C-Os",
"density": 16.22157718855419,
"density_atomic": 0.09660629261314611,
"volume": 41.40517032381887,
"volume_molar": 6.233694097045301,
"formula_full": "Os2 C2",
"formula_reduced": "OsC",
"formula_anonymous": "AB",
"energy_above_hull": 4.4472825,
"spacegroup": 194
},
{
"id": "jvasp-16253",
"created_at": "2022-09-04T14:38:08.895417Z",
"updated_at": "2022-09-04T14:38:08.895432Z",
"structure_string": "Ho2 Al1 Si2\n1.0\n3.789844 0.000000 1.477458\n1.167750 4.794406 2.604006\n0.007774 0.015179 5.579472\nHo Al Si\n2 1 2\ndirect\n0.788327 0.711672 0.711672 Ho\n0.211671 0.288329 0.288329 Ho\n0.000000 0.000000 0.000000 Al\n0.499999 0.290132 0.709868 Si\n0.499999 0.709869 0.290132 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ho",
"Al",
"Si"
],
"chemical_system": "Al-Ho-Si",
"density": 6.776881095765127,
"density_atomic": 0.0494068155705385,
"volume": 101.20061255236052,
"volume_molar": 12.188886675770759,
"formula_full": "Ho2 Al1 Si2",
"formula_reduced": "Ho2AlSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.1502962266666668,
"spacegroup": 71
},
{
"id": "jvasp-52537",
"created_at": "2022-09-04T14:38:08.896919Z",
"updated_at": "2022-09-04T14:38:08.896935Z",
"structure_string": "Ce2 Hf2 O8\n1.0\n-0.442770 0.000000 5.205393\n2.485329 -5.479895 2.581909\n2.485329 5.479895 2.581909\nCe Hf O\n2 2 8\ndirect\n0.750000 0.134007 0.365993 Ce\n0.250000 0.865993 0.634007 Ce\n0.250000 0.400305 0.099695 Hf\n0.750000 0.599695 0.900306 Hf\n0.171915 0.106749 0.045375 O\n0.328085 0.454625 0.393251 O\n0.767004 0.717055 0.266362 O\n0.732995 0.233638 0.782945 O\n0.267004 0.766362 0.217055 O\n0.232996 0.282945 0.733639 O\n0.671915 0.545376 0.606749 O\n0.828084 0.893251 0.954625 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"Hf",
"O"
],
"chemical_system": "Ce-Hf-O",
"density": 8.234056040073236,
"density_atomic": 0.07776191000218291,
"volume": 154.3171971941422,
"volume_molar": 7.744332359931679,
"formula_full": "Ce2 Hf2 O8",
"formula_reduced": "CeHfO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5843404166666666,
"spacegroup": 15
},
{
"id": "jvasp-37129",
"created_at": "2022-09-04T14:38:08.899025Z",
"updated_at": "2022-09-04T14:38:08.899057Z",
"structure_string": "Pr2 Au2\n1.0\n-3.943000 0.000000 0.000000\n0.000000 0.000000 -4.786726\n-1.971500 -5.674888 0.000000\nPr Au\n2 2\ndirect\n0.136464 0.750001 0.727074 Pr\n0.863536 0.250000 0.272926 Pr\n0.411716 0.750001 0.176569 Au\n0.588284 0.250000 0.823432 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Au"
],
"chemical_system": "Au-Pr",
"density": 10.4763863909908,
"density_atomic": 0.037345420263922326,
"volume": 107.10818011236077,
"volume_molar": 16.12551342960173,
"formula_full": "Pr2 Au2",
"formula_reduced": "PrAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.2760737100000001,
"spacegroup": 63
},
{
"id": "jvasp-46777",
"created_at": "2022-09-04T14:38:08.906937Z",
"updated_at": "2022-09-04T14:38:08.906947Z",
"structure_string": "Li8 Mn2 O4 F4\n1.0\n0.000000 5.974332 0.059100\n4.932059 0.000000 0.000000\n0.000000 -1.122285 -6.010755\nLi Mn O F\n8 2 4 4\ndirect\n0.166667 0.475999 0.920647 Li\n0.391894 0.992187 0.795473 Li\n0.608107 0.492187 0.704528 Li\n0.833335 0.975999 0.579355 Li\n0.166666 0.024001 0.420646 Li\n0.391894 0.507814 0.295473 Li\n0.608106 0.007814 0.204527 Li\n0.833334 0.524001 0.079354 Li\n0.000000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.880372 0.691394 0.803861 O\n0.119629 0.191394 0.696140 O\n0.880371 0.808606 0.303861 O\n0.119629 0.308606 0.196140 O\n0.613972 0.241359 0.951178 F\n0.386029 0.741359 0.548823 F\n0.613972 0.258641 0.451177 F\n0.386029 0.758641 0.048823 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 2.868584855525786,
"density_atomic": 0.10181898324308727,
"volume": 176.78432279200806,
"volume_molar": 5.914555977859715,
"formula_full": "Li8 Mn2 O4 F4",
"formula_reduced": "Li4Mn(OF)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 1.26246497848659,
"spacegroup": 14
},
{
"id": "jvasp-18034",
"created_at": "2022-09-04T14:38:08.909343Z",
"updated_at": "2022-09-04T14:38:08.909368Z",
"structure_string": "Ho3 In3 Pt3\n1.0\n3.819637 -6.615805 0.000000\n3.819637 6.615805 0.000000\n-0.000000 0.000000 3.846008\nHo In Pt\n3 3 3\ndirect\n0.595432 -0.000000 0.000000 Ho\n-0.000000 0.595432 0.000000 Ho\n0.404569 0.404569 0.000000 Ho\n0.262216 -0.000000 0.500000 In\n-0.000000 0.262216 0.500000 In\n0.737784 0.737784 0.500000 In\n0.000000 0.000000 0.000000 Pt\n0.666667 0.333333 0.500000 Pt\n0.333333 0.666667 0.500000 Pt\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ho",
"In",
"Pt"
],
"chemical_system": "Ho-In-Pt",
"density": 12.16930168601915,
"density_atomic": 0.04630176462889371,
"volume": 194.37704096451924,
"volume_molar": 13.006287791118012,
"formula_full": "Ho3 In3 Pt3",
"formula_reduced": "HoInPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7016623122222222,
"spacegroup": 189
},
{
"id": "jvasp-44515",
"created_at": "2022-09-04T14:38:08.922346Z",
"updated_at": "2022-09-04T14:38:08.922372Z",
"structure_string": "Li3 Fe1 Sb4 O12\n1.0\n5.166202 0.017412 -0.001664\n0.030973 5.627125 0.036250\n0.004390 0.649411 7.616235\nLi Fe Sb O\n3 1 4 12\ndirect\n0.497940 0.057752 0.790993 Li\n0.000457 0.572159 0.780624 Li\n0.498821 0.038343 0.277267 Li\n0.994348 0.613659 0.300577 Fe\n-0.000845 -0.005572 0.994083 Sb\n0.502940 0.483347 0.498587 Sb\n0.006705 0.021721 0.509518 Sb\n0.493368 0.487066 -0.002434 Sb\n0.299678 0.785521 0.904338 O\n0.152574 0.635509 0.530004 O\n0.832173 0.651397 0.068877 O\n0.321962 0.459769 0.241934 O\n0.641587 0.471148 0.748041 O\n0.851351 0.955154 0.761189 O\n0.819727 0.336960 0.383694 O\n0.664450 0.158036 0.057728 O\n0.141524 0.928590 0.236930 O\n0.705392 0.775534 0.395074 O\n0.193370 0.289429 0.906475 O\n0.382467 0.143683 0.546101 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Sb",
"O"
],
"chemical_system": "Fe-Li-O-Sb",
"density": 5.670839519607488,
"density_atomic": 0.09038125624916311,
"volume": 221.2848197735157,
"volume_molar": 6.663041663636715,
"formula_full": "Li3 Fe1 Sb4 O12",
"formula_reduced": "Li3Fe(SbO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.502143595,
"spacegroup": 1
},
{
"id": "jvasp-18287",
"created_at": "2022-09-04T14:38:08.922729Z",
"updated_at": "2022-09-04T14:38:08.922754Z",
"structure_string": "Mn1 In1 Ni2\n1.0\n3.701570 0.000000 2.137103\n1.233856 3.489874 2.137103\n0.000000 0.000000 4.274205\nMn In Ni\n1 1 2\ndirect\n0.500001 0.499999 0.500000 Mn\n0.000000 0.000000 0.000000 In\n0.750001 0.749999 0.750000 Ni\n0.250000 0.250000 0.250000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"In",
"Ni"
],
"chemical_system": "In-Mn-Ni",
"density": 8.635669930240411,
"density_atomic": 0.07244508550408636,
"volume": 55.21423533656227,
"volume_molar": 8.312697428813598,
"formula_full": "Mn1 In1 Ni2",
"formula_reduced": "MnInNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4413580028448276,
"spacegroup": 225
},
{
"id": "jvasp-110124",
"created_at": "2022-09-04T14:38:08.924854Z",
"updated_at": "2022-09-04T14:38:08.924876Z",
"structure_string": "Yb4 Pt3 Au1\n1.0\n4.431748 -0.000000 0.000000\n0.000000 5.568523 0.011371\n-0.000000 0.005846 7.099243\nYb Pt Au\n4 3 1\ndirect\n0.500000 0.649363 0.691765 Yb\n0.500000 0.849156 0.181896 Yb\n-0.000000 0.359173 0.304677 Yb\n-0.000000 0.144026 0.824272 Yb\n0.500000 0.337631 0.039811 Pt\n-0.000000 0.841668 0.462313 Pt\n-0.000000 0.657874 0.956988 Pt\n0.500000 0.161109 0.538276 Au\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Yb",
"Pt",
"Au"
],
"chemical_system": "Au-Pt-Yb",
"density": 13.974353341693147,
"density_atomic": 0.045662911630525674,
"volume": 175.19688767835814,
"volume_molar": 13.18825397891228,
"formula_full": "Yb4 Pt3 Au1",
"formula_reduced": "Yb4Pt3Au",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6016705712500001,
"spacegroup": 6
},
{
"id": "jvasp-45256",
"created_at": "2022-09-04T14:38:08.930292Z",
"updated_at": "2022-09-04T14:38:08.930301Z",
"structure_string": "Co8 P8 Se8\n1.0\n5.624885 -0.000000 0.000000\n-0.000000 5.705404 0.000000\n0.000000 0.000000 11.270572\nCo P Se\n8 8 8\ndirect\n0.013652 0.177951 0.380106 Co\n0.013652 0.322048 0.880106 Co\n0.486347 0.677951 0.380106 Co\n0.986347 0.822048 0.619894 Co\n0.513652 0.322048 0.619894 Co\n0.486347 0.822048 0.880106 Co\n0.986347 0.677951 0.119894 Co\n0.513652 0.177951 0.119894 Co\n0.371737 0.318914 0.435365 P\n0.871737 0.181085 0.564635 P\n0.628262 0.818914 0.064635 P\n0.128262 0.681085 0.935365 P\n0.128262 0.818914 0.435365 P\n0.371737 0.181085 0.935365 P\n0.871737 0.318914 0.064635 P\n0.628262 0.681085 0.564635 P\n0.119068 0.068073 0.176889 Se\n0.619067 0.431927 0.823111 Se\n0.880931 0.568073 0.323111 Se\n0.380932 0.931926 0.676889 Se\n0.880931 0.931926 0.823111 Se\n0.380932 0.568073 0.176889 Se\n0.119068 0.431927 0.676889 Se\n0.619067 0.068073 0.323111 Se\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Co",
"P",
"Se"
],
"chemical_system": "Co-P-Se",
"density": 6.202085572535287,
"density_atomic": 0.06635371359764596,
"volume": 361.69791709821425,
"volume_molar": 9.075815705684404,
"formula_full": "Co8 P8 Se8",
"formula_reduced": "CoPSe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.104906588888889,
"spacegroup": 61
},
{
"id": "jvasp-46852",
"created_at": "2022-09-04T14:38:08.931045Z",
"updated_at": "2022-09-04T14:38:08.931067Z",
"structure_string": "Li2 Co2 P2 O8\n1.0\n4.794864 0.000001 0.000000\n-2.397432 1.384157 7.845599\n2.397432 -4.152474 -0.000000\nLi Co P O\n2 2 2 8\ndirect\n0.005416 0.016247 0.005416 Li\n0.570089 0.710268 0.570088 Li\n0.125321 0.375963 0.125321 Co\n0.450182 0.350548 0.450182 Co\n0.864877 0.594631 0.864876 P\n0.710626 0.131882 0.710626 P\n0.157984 0.525041 0.542619 O\n0.032885 0.201472 0.751070 O\n0.417518 0.201472 0.032884 O\n0.647137 0.941410 0.647136 O\n0.824437 0.525041 0.157984 O\n0.542620 0.525041 0.824436 O\n0.751070 0.201472 0.417518 O\n0.928366 0.785101 0.928365 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"P",
"O"
],
"chemical_system": "Co-Li-O-P",
"density": 3.419627394370355,
"density_atomic": 0.08962283158332363,
"volume": 156.21019502138805,
"volume_molar": 6.7194270183275,
"formula_full": "Li2 Co2 P2 O8",
"formula_reduced": "LiCoPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4279429142857145,
"spacegroup": 148
}
]
}