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=updated_at&page=4543",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=4541",
"results": [
{
"id": "jvasp-120559",
"created_at": "2022-09-04T14:38:52.745967Z",
"updated_at": "2022-09-04T14:38:52.746003Z",
"structure_string": "Mg4 Ru4 N8\n1.0\n5.754520 -0.000000 0.000000\n0.000000 6.535805 0.000000\n-0.000000 -0.000000 5.343052\nMg Ru N\n4 4 8\ndirect\n0.591993 0.875108 0.999143 Mg\n0.408006 0.124892 0.499143 Mg\n0.908006 0.375108 0.499143 Mg\n0.091994 0.624893 0.999143 Mg\n0.571015 0.361685 0.009601 Ru\n0.428985 0.638316 0.509601 Ru\n0.928985 0.861685 0.509601 Ru\n0.071015 0.138316 0.009601 Ru\n0.569370 0.390753 0.366544 N\n0.430630 0.609248 0.866544 N\n0.930630 0.890753 0.866544 N\n0.069370 0.109248 0.366544 N\n0.608028 0.871371 0.394712 N\n0.391972 0.128630 0.894711 N\n0.891972 0.371371 0.894711 N\n0.108028 0.628630 0.394712 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Ru",
"N"
],
"chemical_system": "Mg-N-Ru",
"density": 5.0699539557955,
"density_atomic": 0.07962004005275633,
"volume": 200.95443294676042,
"volume_molar": 7.563599259696081,
"formula_full": "Mg4 Ru4 N8",
"formula_reduced": "MgRuN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4199265125,
"spacegroup": 33
},
{
"id": "jvasp-117638",
"created_at": "2022-09-04T14:38:52.748254Z",
"updated_at": "2022-09-04T14:38:52.748281Z",
"structure_string": "Be2 Br1\n1.0\n4.365193 0.000000 0.000000\n-2.182596 3.780368 -0.000000\n-0.000000 -0.000000 3.101135\nBe Br\n2 1\ndirect\n0.333334 0.666668 0.000000 Be\n0.666667 0.333334 0.000000 Be\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"Br"
],
"chemical_system": "Be-Br",
"density": 3.1776012358129235,
"density_atomic": 0.058622327013943654,
"volume": 51.175041196956116,
"volume_molar": 10.272776716228954,
"formula_full": "Be2 Br1",
"formula_reduced": "Be2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4138287683333333,
"spacegroup": 191
},
{
"id": "jvasp-120238",
"created_at": "2022-09-04T14:38:52.748642Z",
"updated_at": "2022-09-04T14:38:52.748656Z",
"structure_string": "H1 S1\n1.0\n3.233233 -0.000000 0.000000\n-1.616616 2.800062 -0.000000\n0.000000 -0.000000 2.495934\nH S\n1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.333331 0.666666 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 2.430435795204594,
"density_atomic": 0.0885099811019077,
"volume": 22.596321624984427,
"volume_molar": 6.803911474194407,
"formula_full": "H1 S1",
"formula_reduced": "HS",
"formula_anonymous": "AB",
"energy_above_hull": 1.7391949999999998,
"spacegroup": 187
},
{
"id": "jvasp-121057",
"created_at": "2022-09-04T14:38:52.749588Z",
"updated_at": "2022-09-04T14:38:52.749613Z",
"structure_string": "Ge1 O1\n1.0\n3.131246 0.144992 -0.144961\n-0.072875 -3.474685 0.102764\n-0.131775 -0.084295 -2.916709\nGe O\n1 1\ndirect\n-0.047875 0.070828 0.041887 Ge\n0.210603 0.339848 0.541852 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 4.629479899457389,
"density_atomic": 0.06290516318873451,
"volume": 31.793892561718586,
"volume_molar": 9.573364815749317,
"formula_full": "Ge1 O1",
"formula_reduced": "GeO",
"formula_anonymous": "AB",
"energy_above_hull": 0.5825447250000002,
"spacegroup": 6
},
{
"id": "jvasp-122070",
"created_at": "2022-09-04T14:38:52.754706Z",
"updated_at": "2022-09-04T14:38:52.754732Z",
"structure_string": "Hf8 Bi16\n1.0\n4.046022 -0.000000 0.000000\n0.000000 10.278639 0.000000\n0.000000 0.000000 15.738331\nHf Bi\n8 16\ndirect\n-0.000000 0.839674 0.494737 Hf\n-0.000000 0.160326 0.505263 Hf\n0.500000 0.660326 0.994737 Hf\n0.500000 0.339674 0.005263 Hf\n0.500000 0.523238 0.254288 Hf\n0.500000 0.476762 0.745712 Hf\n-0.000000 0.976762 0.754288 Hf\n-0.000000 0.023238 0.245712 Hf\n-0.000000 0.485259 0.892198 Bi\n-0.000000 0.514741 0.107802 Bi\n0.500000 0.236702 0.199731 Bi\n0.500000 0.763298 0.800269 Bi\n-0.000000 0.263298 0.699731 Bi\n-0.000000 0.736702 0.300269 Bi\n-0.000000 0.346613 0.351038 Bi\n-0.000000 0.125879 0.055819 Bi\n0.500000 0.153387 0.851038 Bi\n0.500000 0.846613 0.148962 Bi\n0.500000 0.985259 0.607802 Bi\n-0.000000 0.874121 0.944181 Bi\n0.500000 0.374121 0.555819 Bi\n0.500000 0.625879 0.444181 Bi\n-0.000000 0.653387 0.648962 Bi\n0.500000 0.014741 0.392198 Bi\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Hf",
"Bi"
],
"chemical_system": "Bi-Hf",
"density": 12.105735529394913,
"density_atomic": 0.03666812588056356,
"volume": 654.5194068050673,
"volume_molar": 16.42336665804924,
"formula_full": "Hf8 Bi16",
"formula_reduced": "HfBi2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 58
},
{
"id": "jvasp-118337",
"created_at": "2022-09-04T14:38:52.761615Z",
"updated_at": "2022-09-04T14:38:52.761631Z",
"structure_string": "Ti1 O1 F1\n1.0\n3.639472 -0.000000 0.000000\n-1.819736 3.151875 -0.000000\n-0.000000 -0.000000 3.135434\nTi O F\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Ti\n0.333333 0.666666 0.000000 O\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"O",
"F"
],
"chemical_system": "F-O-Ti",
"density": 3.8257287027532763,
"density_atomic": 0.08340963548748612,
"volume": 35.967067623141546,
"volume_molar": 7.219958131699901,
"formula_full": "Ti1 O1 F1",
"formula_reduced": "TiOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0377707052777778,
"spacegroup": 187
},
{
"id": "jvasp-119640",
"created_at": "2022-09-04T14:38:52.761643Z",
"updated_at": "2022-09-04T14:38:52.761666Z",
"structure_string": "Er8 Os2 Br8\n1.0\n8.783226 -0.008500 0.094271\n0.088543 8.782783 0.094271\n0.011731 0.011602 6.495364\nEr Os Br\n8 2 8\ndirect\n0.250928 0.901906 0.008659 Er\n0.749073 0.098093 0.991340 Er\n0.098093 0.749072 0.491340 Er\n0.901907 0.250928 0.508659 Er\n0.749964 0.902805 0.509410 Er\n0.250036 0.097194 0.490589 Er\n0.097194 0.250035 0.990589 Er\n0.902806 0.749964 0.009410 Er\n0.005095 0.994904 0.749999 Os\n0.994905 0.005095 0.250000 Os\n0.421928 0.812732 0.409716 Br\n0.578072 0.187267 0.590283 Br\n0.187267 0.578071 0.090283 Br\n0.812733 0.421928 0.909716 Br\n0.417848 0.196114 0.092665 Br\n0.582152 0.803886 0.907334 Br\n0.803887 0.582152 0.407335 Br\n0.196113 0.417847 0.592665 Br\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Er",
"Os",
"Br"
],
"chemical_system": "Br-Er-Os",
"density": 7.813977527368655,
"density_atomic": 0.035924872314105544,
"volume": 501.04562217003286,
"volume_molar": 16.76315146605397,
"formula_full": "Er8 Os2 Br8",
"formula_reduced": "Er4OsBr4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.3061357133333331,
"spacegroup": 15
},
{
"id": "jvasp-116651",
"created_at": "2022-09-04T14:38:52.762509Z",
"updated_at": "2022-09-04T14:38:52.762543Z",
"structure_string": "Sr3 Y2 Fe1 Cu3 Bi1 O12\n1.0\n5.197146 0.000000 1.404768\n-0.000000 5.382775 0.000000\n0.004099 -0.000000 10.301022\nSr Y Fe Cu Bi O\n3 2 1 3 1 12\ndirect\n0.178210 0.000000 0.643580 Sr\n0.821520 0.000000 0.356960 Sr\n0.322143 0.500000 0.355716 Sr\n0.503866 0.500000 0.992270 Y\n0.001070 0.000000 0.997861 Y\n0.406013 0.000000 0.187974 Fe\n0.585804 0.000000 0.828393 Cu\n0.085472 0.500000 0.829058 Cu\n0.916372 0.500000 0.167256 Cu\n0.689601 0.500000 0.620801 Bi\n0.699569 0.000000 0.600863 O\n0.199846 0.500000 0.600308 O\n0.181992 0.755647 0.148497 O\n0.669511 0.244353 0.148497 O\n0.669511 0.755647 0.148497 O\n0.318206 0.247912 0.859244 O\n0.318206 0.752088 0.859244 O\n0.822551 0.247912 0.859244 O\n0.822551 0.752088 0.859244 O\n0.308715 0.000000 0.382571 O\n0.181992 0.244353 0.148497 O\n0.797289 0.500000 0.405422 O\n",
"nsites": 22,
"nelements": 6,
"elements": [
"Sr",
"Y",
"Fe",
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-Fe-O-Sr-Y",
"density": 6.270819474765805,
"density_atomic": 0.07635156368603953,
"volume": 288.1407915948496,
"volume_molar": 7.887383662190951,
"formula_full": "Sr3 Y2 Fe1 Cu3 Bi1 O12",
"formula_reduced": "Sr3Y2FeCu3BiO12",
"formula_anonymous": "ABC2D3E3F12",
"energy_above_hull": 1.983299226363636,
"spacegroup": 38
},
{
"id": "jvasp-121059",
"created_at": "2022-09-04T14:38:52.764649Z",
"updated_at": "2022-09-04T14:38:52.764678Z",
"structure_string": "Ge2 O1\n1.0\n4.456188 0.817567 -0.853348\n1.583814 -2.411515 -0.358644\n-1.014623 -1.621195 -4.225315\nGe O\n2 1\ndirect\n0.831467 0.836814 0.411507 Ge\n0.304523 0.278274 0.941954 Ge\n0.101488 -0.170466 0.116423 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 5.066149083709693,
"density_atomic": 0.056750700158460544,
"volume": 52.862783923781286,
"volume_molar": 10.611570858482532,
"formula_full": "Ge2 O1",
"formula_reduced": "Ge2O",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9858818,
"spacegroup": 1
},
{
"id": "jvasp-120245",
"created_at": "2022-09-04T14:38:52.768469Z",
"updated_at": "2022-09-04T14:38:52.768506Z",
"structure_string": "Hf1 Se1\n1.0\n3.728786 0.000000 0.000000\n-0.000000 3.728786 0.000000\n0.000000 0.000000 3.423080\nHf Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.000000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Se"
],
"chemical_system": "Hf-Se",
"density": 8.982351084384991,
"density_atomic": 0.04202212670778671,
"volume": 47.59397385828641,
"volume_molar": 14.330880495118054,
"formula_full": "Hf1 Se1",
"formula_reduced": "HfSe",
"formula_anonymous": "AB",
"energy_above_hull": 2.009043183333333,
"spacegroup": 123
},
{
"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-120290",
"created_at": "2022-09-04T14:38:52.768793Z",
"updated_at": "2022-09-04T14:38:52.768821Z",
"structure_string": "Li1 Y1 O1\n1.0\n2.696063 1.598253 0.000000\n0.901410 7.442809 0.000000\n0.000000 0.000000 3.432140\nLi Y O\n1 1 1\ndirect\n-0.087969 -0.122441 0.000000 Li\n0.223526 0.341249 0.000000 Y\n0.080456 0.097327 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Y",
"O"
],
"chemical_system": "Li-O-Y",
"density": 2.9053284807108266,
"density_atomic": 0.0469295047556549,
"volume": 63.92566926968278,
"volume_molar": 12.83231261730787,
"formula_full": "Li1 Y1 O1",
"formula_reduced": "LiYO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2375396500000002,
"spacegroup": 38
}
]
}