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=-spacegroup&page=4126",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4124",
"results": [
{
"id": "jvasp-114727",
"created_at": "2022-09-04T14:38:43.053136Z",
"updated_at": "2022-09-04T14:38:43.053163Z",
"structure_string": "Ca2 O1\n1.0\n3.357774 0.725345 0.662328\n-1.028872 -3.338483 -0.051810\n0.021371 -1.373825 -5.928793\nCa O\n2 1\ndirect\n0.700732 0.007254 0.319923 Ca\n0.235029 0.473469 0.853780 Ca\n-0.032114 0.740369 0.086861 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"O"
],
"chemical_system": "Ca-O",
"density": 2.543319778698721,
"density_atomic": 0.047785864476593234,
"volume": 62.780071740032625,
"volume_molar": 12.602347631379153,
"formula_full": "Ca2 O1",
"formula_reduced": "Ca2O",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4355568066666669,
"spacegroup": 12
},
{
"id": "jvasp-112905",
"created_at": "2022-09-04T14:38:43.055021Z",
"updated_at": "2022-09-04T14:38:43.055048Z",
"structure_string": "Li6 Mn4 O10\n1.0\n4.712348 -0.000047 1.742933\n-0.058998 7.100673 2.455278\n-0.118253 0.000020 4.910606\nLi Mn O\n6 4 10\ndirect\n0.500000 0.800001 0.099999 Li\n0.000000 0.800001 0.600000 Li\n0.500010 0.196444 0.901784 Li\n0.499991 0.403554 0.298217 Li\n0.499996 0.610696 0.694642 Li\n0.500005 0.989302 0.505360 Li\n0.000006 0.993053 0.003466 Mn\n0.000004 0.197214 0.401382 Mn\n-0.000008 0.606948 0.196536 Mn\n-0.000005 0.402785 0.798620 Mn\n0.773768 0.587527 0.956580 O\n0.234327 0.799996 0.873142 O\n0.765674 0.800002 0.326859 O\n0.224615 0.198626 0.658499 O\n0.224618 0.401375 0.057126 O\n0.775381 0.198624 0.142874 O\n0.775387 0.401374 0.541501 O\n0.226224 0.587527 0.455905 O\n0.226234 0.012472 0.243421 O\n0.773776 0.012472 0.744096 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.220978936853461,
"density_atomic": 0.12064452316847016,
"volume": 165.7762779009176,
"volume_molar": 4.991640400941016,
"formula_full": "Li6 Mn4 O10",
"formula_reduced": "Li3Mn2O5",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 2.494556198275862,
"spacegroup": 12
},
{
"id": "jvasp-110908",
"created_at": "2022-09-04T14:38:43.261131Z",
"updated_at": "2022-09-04T14:38:43.261148Z",
"structure_string": "K2 Ce1 Cu2 S4\n1.0\n7.074150 0.012441 2.457444\n5.956528 3.816218 2.457444\n0.010244 0.003010 7.495934\nK Ce Cu S\n2 1 2 4\ndirect\n0.864231 0.864232 0.560358 K\n0.135768 0.135769 0.439641 K\n0.000000 0.000000 0.000000 Ce\n0.680193 0.680193 0.012900 Cu\n0.319807 0.319807 0.987099 Cu\n0.798104 0.798105 0.177361 S\n0.201895 0.201896 0.822637 S\n0.521619 0.521620 0.239533 S\n0.478380 0.478381 0.760466 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"K",
"Ce",
"Cu",
"S"
],
"chemical_system": "Ce-Cu-K-S",
"density": 3.8994604799738117,
"density_atomic": 0.04461973707960705,
"volume": 201.70446060546934,
"volume_molar": 13.496585040955681,
"formula_full": "K2 Ce1 Cu2 S4",
"formula_reduced": "K2Ce(CuS2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 0.7803758222222223,
"spacegroup": 12
},
{
"id": "jvasp-116690",
"created_at": "2022-09-04T14:38:43.025919Z",
"updated_at": "2022-09-04T14:38:43.025954Z",
"structure_string": "La4 C2 I5\n1.0\n10.023716 -0.011996 2.422150\n9.183935 4.016262 2.422150\n0.007151 0.001491 8.922790\nLa C I\n4 2 5\ndirect\n0.500756 0.500754 0.806612 La\n0.499247 0.499245 0.193387 La\n0.154548 0.154547 0.914819 La\n0.845454 0.845451 0.085181 La\n0.035616 0.035616 0.981174 C\n0.964386 0.964382 0.018825 C\n0.664915 0.664913 0.633298 I\n0.335087 0.335086 0.366701 I\n0.000000 -0.000000 0.500000 I\n0.333338 0.333336 0.807502 I\n0.666664 0.666662 0.192498 I\n",
"nsites": 11,
"nelements": 3,
"elements": [
"La",
"C",
"I"
],
"chemical_system": "C-I-La",
"density": 5.59856193573294,
"density_atomic": 0.030545141395934963,
"volume": 360.1227395681302,
"volume_molar": 19.71554389596456,
"formula_full": "La4 C2 I5",
"formula_reduced": "La4C2I5",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 1.8633737613636367,
"spacegroup": 12
},
{
"id": "jvasp-112740",
"created_at": "2022-09-04T14:38:43.703538Z",
"updated_at": "2022-09-04T14:38:43.703565Z",
"structure_string": "Na8 Fe4 O12\n1.0\n5.123719 0.005368 -0.834579\n0.411839 8.614832 2.520278\n0.004695 -0.018902 5.560718\nNa Fe O\n8 4 12\ndirect\n0.749967 0.250032 0.499944 Na\n0.249973 0.750032 0.499949 Na\n-0.000002 0.999986 0.000010 Na\n0.500000 0.499986 0.000014 Na\n0.235761 0.078603 0.500054 Na\n0.735764 0.578604 0.500062 Na\n0.264197 0.421455 0.500024 Na\n0.764197 0.921455 0.500022 Na\n0.000900 0.333619 0.999997 Fe\n0.499117 0.166360 -0.000009 Fe\n0.500901 0.833620 1.000000 Fe\n0.999120 0.666360 -0.000005 Fe\n0.588161 0.033769 0.802301 O\n0.654509 0.345504 0.801322 O\n0.154511 0.845502 0.801326 O\n0.845507 0.154484 0.198669 O\n0.345510 0.654483 0.198676 O\n0.344720 0.277165 0.197682 O\n0.844723 0.777165 0.197686 O\n0.911864 0.466217 0.197683 O\n0.411863 0.966216 0.197682 O\n0.155290 0.222807 0.802306 O\n0.655294 0.722807 0.802309 O\n0.088164 0.533771 0.802304 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-Na-O",
"density": 4.049884485424215,
"density_atomic": 0.09767132015795839,
"volume": 245.72208055738508,
"volume_molar": 6.165720653985967,
"formula_full": "Na8 Fe4 O12",
"formula_reduced": "Na2FeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4321723333333334,
"spacegroup": 12
},
{
"id": "jvasp-116502",
"created_at": "2022-09-04T14:38:43.369817Z",
"updated_at": "2022-09-04T14:38:43.369857Z",
"structure_string": "Li6 Co4 O10\n1.0\n11.685941 0.021162 1.066717\n11.338349 2.829047 1.066717\n-0.036835 -0.004560 4.935571\nLi Co O\n6 4 10\ndirect\n-0.000000 -0.000000 0.500000 Li\n0.403091 0.403092 0.703179 Li\n0.801580 0.801581 0.897702 Li\n0.198420 0.198420 0.102299 Li\n0.596908 0.596908 0.296822 Li\n0.500000 0.500000 0.000001 Li\n0.299944 0.299945 0.398358 Co\n0.700055 0.700056 0.601643 Co\n0.097165 0.097166 0.806608 Co\n0.902834 0.902835 0.193393 Co\n0.248050 0.248050 0.724418 O\n0.945574 0.945575 0.869571 O\n0.351743 0.351743 0.078443 O\n0.751949 0.751950 0.275583 O\n0.153637 0.153637 0.483169 O\n0.555981 0.555982 0.663857 O\n0.054425 0.054425 0.130429 O\n0.444018 0.444018 0.336144 O\n0.846362 0.846363 0.516832 O\n0.648256 0.648257 0.921558 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 4.480462686448982,
"density_atomic": 0.12338205855905303,
"volume": 162.0981221546698,
"volume_molar": 4.880888542735479,
"formula_full": "Li6 Co4 O10",
"formula_reduced": "Li3Co2O5",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 2.30810293,
"spacegroup": 12
},
{
"id": "jvasp-117147",
"created_at": "2022-09-04T14:38:43.371030Z",
"updated_at": "2022-09-04T14:38:43.371060Z",
"structure_string": "Bi3 Te4 Cl5 O10\n1.0\n7.895149 -0.012798 0.973941\n6.837923 3.946688 0.973941\n-0.127023 -0.033917 13.261207\nBi Te Cl O\n3 4 5 10\ndirect\n0.000000 0.000000 0.000000 Bi\n0.783165 0.783163 0.809241 Bi\n0.216836 0.216836 0.190759 Bi\n0.160352 0.160351 0.494643 Te\n0.839649 0.839648 0.505357 Te\n0.474345 0.474344 0.770027 Te\n0.525656 0.525655 0.229973 Te\n0.823274 0.823274 0.026658 Cl\n0.500001 0.499999 0.500000 Cl\n0.176727 0.176725 0.973342 Cl\n0.155596 0.155595 0.722816 Cl\n0.844405 0.844404 0.277184 Cl\n0.056885 0.056884 0.193513 O\n0.292924 0.292923 0.498485 O\n0.707077 0.707076 0.501515 O\n0.160488 0.160487 0.354395 O\n0.839514 0.839512 0.645605 O\n0.347784 0.347782 0.805900 O\n0.652217 0.652217 0.194100 O\n0.514648 0.514646 0.899656 O\n0.485353 0.485353 0.100344 O\n0.943117 0.943115 0.806487 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Bi",
"Te",
"Cl",
"O"
],
"chemical_system": "Bi-Cl-O-Te",
"density": 5.901733068191151,
"density_atomic": 0.05302477784088681,
"volume": 414.90037103061746,
"volume_molar": 11.357220162375475,
"formula_full": "Bi3 Te4 Cl5 O10",
"formula_reduced": "Bi3Te4(ClO2)5",
"formula_anonymous": "A3B4C5D10",
"energy_above_hull": 1.7335167865530303,
"spacegroup": 12
},
{
"id": "jvasp-111238",
"created_at": "2022-09-04T14:38:43.619391Z",
"updated_at": "2022-09-04T14:38:43.619407Z",
"structure_string": "V2 Bi4\n1.0\n4.949795 -0.010025 2.814810\n3.509744 3.490310 2.814810\n0.027737 0.011411 8.404539\nV Bi\n2 4\ndirect\n0.140992 0.140991 0.820839 V\n0.859006 0.859010 0.179161 V\n0.408794 0.408795 0.884735 Bi\n0.591204 0.591206 0.115265 Bi\n0.840811 0.840814 0.551486 Bi\n0.159187 0.159187 0.448514 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"V",
"Bi"
],
"chemical_system": "Bi-V",
"density": 10.726736520074168,
"density_atomic": 0.041329238889408,
"volume": 145.17567129787383,
"volume_molar": 14.571138791388137,
"formula_full": "V2 Bi4",
"formula_reduced": "VBi2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8985142666666663,
"spacegroup": 12
},
{
"id": "jvasp-112762",
"created_at": "2022-09-04T14:38:43.462168Z",
"updated_at": "2022-09-04T14:38:43.462192Z",
"structure_string": "Li4 Mn6 Sb2 O16\n1.0\n5.754155 0.000267 0.000036\n-0.000272 5.967470 0.230397\n-0.000062 0.107298 8.922018\nLi Mn Sb O\n4 6 2 16\ndirect\n0.000007 0.247669 0.136494 Li\n0.499994 0.747662 0.636491 Li\n-0.000005 0.752333 0.863507 Li\n0.500004 0.252339 0.363510 Li\n0.249964 0.750007 0.249980 Mn\n-0.000001 0.500000 0.500002 Mn\n0.750040 0.249994 0.750020 Mn\n0.749961 0.749999 0.250019 Mn\n0.500004 0.000001 0.000000 Mn\n0.250039 0.250002 0.749981 Mn\n-0.000002 -0.000000 0.500002 Sb\n0.500001 0.500001 -0.000001 Sb\n-0.000032 0.972624 0.267092 O\n0.728306 0.758599 -0.003309 O\n0.228310 0.258602 0.496690 O\n0.499968 0.527378 0.232908 O\n0.000032 0.027377 0.732907 O\n0.500033 0.472622 0.767093 O\n0.271695 0.241401 0.003310 O\n0.500026 0.033724 0.779947 O\n0.728313 0.241396 0.003311 O\n0.228305 0.741398 0.503310 O\n0.499975 0.966277 0.220055 O\n0.000025 0.466276 0.720054 O\n0.771694 0.258603 0.496691 O\n-0.000025 0.533723 0.279946 O\n0.771690 0.741399 0.503310 O\n0.271690 0.758604 0.996690 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.64672952708363,
"density_atomic": 0.09143760285770325,
"volume": 306.2197512283221,
"volume_molar": 6.586065876389781,
"formula_full": "Li4 Mn6 Sb2 O16",
"formula_reduced": "Li2Mn3SbO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.956231130295567,
"spacegroup": 12
},
{
"id": "jvasp-111091",
"created_at": "2022-09-04T14:38:43.507995Z",
"updated_at": "2022-09-04T14:38:43.508020Z",
"structure_string": "Ce2 Sb2 Rh2\n1.0\n4.774748 0.018183 3.501969\n2.715278 3.927571 3.501969\n0.015044 0.007925 7.296459\nCe Sb Rh\n2 2 2\ndirect\n0.565171 0.565171 0.664720 Ce\n0.434829 0.434829 0.335280 Ce\n0.834286 0.834284 0.080029 Sb\n0.165714 0.165716 0.919971 Sb\n0.165244 0.165245 0.310577 Rh\n0.834756 0.834756 0.689423 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Sb",
"Rh"
],
"chemical_system": "Ce-Rh-Sb",
"density": 8.894228162250812,
"density_atomic": 0.044050173018484066,
"volume": 136.20831857986838,
"volume_molar": 13.671094452848177,
"formula_full": "Ce2 Sb2 Rh2",
"formula_reduced": "CeSbRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6982182,
"spacegroup": 12
},
{
"id": "jvasp-112818",
"created_at": "2022-09-04T14:38:43.615381Z",
"updated_at": "2022-09-04T14:38:43.615395Z",
"structure_string": "Na4 Co2 O6\n1.0\n5.107849 -0.007550 0.826778\n-2.753376 4.302220 0.826778\n-0.000898 -0.001638 5.564386\nNa Co O\n4 2 6\ndirect\n0.842967 0.157033 0.500001 Na\n0.157032 0.842967 0.500001 Na\n0.499999 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Na\n0.332752 0.667248 0.000000 Co\n0.667248 0.332752 0.000000 Co\n0.690633 0.690634 0.801164 O\n0.932359 0.553319 0.198111 O\n0.553318 0.932359 0.198111 O\n0.067640 0.446681 0.801890 O\n0.446681 0.067640 0.801890 O\n0.309366 0.309366 0.198837 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Co",
"O"
],
"chemical_system": "Co-Na-O",
"density": 4.156535811195474,
"density_atomic": 0.09821891667868853,
"volume": 122.17605738064256,
"volume_molar": 6.131345125400554,
"formula_full": "Na4 Co2 O6",
"formula_reduced": "Na2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4341699,
"spacegroup": 12
},
{
"id": "jvasp-112767",
"created_at": "2022-09-04T14:38:43.683050Z",
"updated_at": "2022-09-04T14:38:43.683065Z",
"structure_string": "Li7 Si2 Ni3 O12\n1.0\n4.799199 0.000059 -0.814867\n-2.399525 4.211444 0.407211\n0.004136 -0.000034 9.579287\nLi Si Ni O\n7 2 3 12\ndirect\n0.583293 0.666575 0.750001 Li\n0.340290 0.666691 0.996758 Li\n0.826409 0.666701 0.503243 Li\n0.177597 0.342659 0.502743 Li\n0.665080 0.342676 0.997264 Li\n0.501549 0.990659 0.502718 Li\n0.989113 0.990677 0.997274 Li\n0.916571 0.333139 0.750000 Si\n0.250031 0.000050 0.750001 Si\n0.083356 0.666707 0.250000 Ni\n0.748818 -0.002372 0.249998 Ni\n0.417916 0.335834 0.250002 Ni\n0.618291 0.037641 0.855652 O\n0.461417 0.666664 0.370023 O\n0.705292 0.666749 0.129977 O\n0.177995 0.666593 0.644529 O\n0.988618 0.666616 0.855471 O\n0.049981 0.338063 0.137936 O\n0.788072 0.338005 0.362050 O\n0.378643 -0.004538 0.137961 O\n0.116776 -0.004597 0.362053 O\n0.247252 0.295574 0.855646 O\n0.919352 0.037625 0.644348 O\n0.548320 0.295559 0.644356 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Si",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Si",
"density": 4.054965718093958,
"density_atomic": 0.12394910320063707,
"volume": 193.62786321375052,
"volume_molar": 4.858559363880131,
"formula_full": "Li7 Si2 Ni3 O12",
"formula_reduced": "Li7Si2(NiO4)3",
"formula_anonymous": "A2B3C7D12",
"energy_above_hull": 2.2084444333333333,
"spacegroup": 12
}
]
}