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=-energy_above_hull&page=845",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=843",
"results": [
{
"id": "jvasp-60637",
"created_at": "2022-09-04T14:36:15.839154Z",
"updated_at": "2022-09-04T14:36:15.839175Z",
"structure_string": "V8 O20\n1.0\n3.587366 0.000000 0.000000\n0.000000 10.042316 0.000000\n0.000000 0.000000 10.007847\nV O\n8 20\ndirect\n0.250000 0.873915 0.016922 V\n0.750001 0.626086 0.516922 V\n0.250000 0.373915 0.483078 V\n0.750001 0.126085 0.983079 V\n0.750001 0.930113 0.606192 V\n0.250000 0.569887 0.106192 V\n0.750001 0.430113 0.893808 V\n0.250000 0.069887 0.393808 V\n0.250000 0.436971 0.955856 O\n0.750001 0.429082 0.463812 O\n0.250000 0.287751 0.618266 O\n0.250000 0.070919 0.963813 O\n0.250000 0.243643 0.357529 O\n0.750001 0.212250 0.118266 O\n0.250000 0.494892 0.248367 O\n0.750001 0.256357 0.857529 O\n0.750001 0.505109 0.751633 O\n0.250000 0.743643 0.142471 O\n0.250000 0.570919 0.536188 O\n0.750001 0.712250 0.381734 O\n0.750001 0.063029 0.455856 O\n0.750001 0.756358 0.642471 O\n0.250000 0.787751 0.881734 O\n0.750001 0.929082 0.036188 O\n0.250000 0.936971 0.544145 O\n0.250000 -0.005108 0.251633 O\n0.750001 0.563029 0.044145 O\n0.750001 0.005108 0.748367 O\n",
"nsites": 28,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 3.3507637332976405,
"density_atomic": 0.07766186278687259,
"volume": 360.5373216045613,
"volume_molar": 7.754308928343063,
"formula_full": "V8 O20",
"formula_reduced": "V2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.0445151285714287,
"spacegroup": 62
},
{
"id": "jvasp-112486",
"created_at": "2022-09-04T14:38:41.723869Z",
"updated_at": "2022-09-04T14:38:41.723898Z",
"structure_string": "V4 O10\n1.0\n6.567885 0.126710 0.181054\n1.560846 6.525196 0.363661\n-0.184151 -0.197866 4.304916\nV O\n4 10\ndirect\n0.228592 0.705767 0.608338 V\n0.771408 0.294233 0.391662 V\n0.690619 0.817878 0.396503 V\n0.309381 0.182122 0.603497 V\n0.962213 0.798071 0.496336 O\n0.037787 0.201929 0.503664 O\n0.384045 0.887922 0.501937 O\n0.615955 0.112078 0.498063 O\n0.232583 0.707191 0.983210 O\n0.767417 0.292809 0.016790 O\n0.689661 0.819788 0.023098 O\n0.310339 0.180213 0.976901 O\n0.313093 0.444173 0.500493 O\n0.686907 0.555827 0.499507 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 3.278021129447762,
"density_atomic": 0.0759758811514592,
"volume": 184.26900468703698,
"volume_molar": 7.926384885217403,
"formula_full": "V4 O10",
"formula_reduced": "V2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.0443137,
"spacegroup": 2
},
{
"id": "jvasp-114475",
"created_at": "2022-09-04T14:38:41.715434Z",
"updated_at": "2022-09-04T14:38:41.715465Z",
"structure_string": "Ca1 B1 C1\n1.0\n2.746299 -0.875493 0.000000\n0.082996 5.002999 0.000000\n0.000000 0.000000 3.908748\nCa B C\n1 1 1\ndirect\n0.059309 0.421411 0.000000 Ca\n-0.204931 -0.107047 0.000000 B\n0.327409 -0.042337 0.000000 C\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"B",
"C"
],
"chemical_system": "B-C-Ca",
"density": 1.9345994276669451,
"density_atomic": 0.05556670415750116,
"volume": 53.9891657330736,
"volume_molar": 10.83767851865126,
"formula_full": "Ca1 B1 C1",
"formula_reduced": "CaBC",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0442710011111105,
"spacegroup": 38
},
{
"id": "jvasp-23292",
"created_at": "2022-09-04T14:37:49.427845Z",
"updated_at": "2022-09-04T14:37:49.427877Z",
"structure_string": "Ti4 Ni2 P4 O20\n1.0\n0.000000 7.569670 -0.264325\n6.901449 0.000000 0.000000\n0.000000 -3.488033 -6.340776\nTi Ni P O\n4 2 4 20\ndirect\n0.706395 0.723208 0.742997 Ti\n0.206394 0.776792 0.742997 Ti\n0.293606 0.276792 0.257004 Ti\n0.793607 0.223208 0.257004 Ti\n0.500000 0.500000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.009224 0.641696 0.256796 P\n0.490776 0.141696 0.743205 P\n-0.009224 0.358304 0.743205 P\n0.509225 0.858304 0.256796 P\n0.000001 0.151931 0.214101 O\n0.855671 0.504175 0.268263 O\n0.644331 0.004175 0.731739 O\n0.101276 0.774293 0.447170 O\n0.355670 -0.004175 0.268263 O\n0.500001 0.348069 0.214101 O\n0.000000 0.848069 0.785900 O\n0.500000 0.651931 0.785900 O\n0.601276 0.725708 0.447170 O\n0.828297 0.472893 0.767905 O\n0.328297 0.027107 0.767905 O\n0.171704 0.527107 0.232096 O\n0.671704 0.972893 0.232097 O\n0.398725 0.274293 0.552831 O\n0.104214 0.226226 0.938155 O\n0.395787 0.726226 0.061846 O\n0.895787 0.773774 0.061847 O\n0.604214 0.273774 0.938155 O\n0.898725 0.225707 0.552832 O\n0.144330 0.495825 0.731738 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Ti",
"Ni",
"P",
"O"
],
"chemical_system": "Ni-O-P-Ti",
"density": 3.7022868052981734,
"density_atomic": 0.08885839476123125,
"volume": 337.615822124765,
"volume_molar": 6.777233345461523,
"formula_full": "Ti4 Ni2 P4 O20",
"formula_reduced": "Ti2Ni(PO5)2",
"formula_anonymous": "AB2C2D10",
"energy_above_hull": 3.0442370044444447,
"spacegroup": 14
},
{
"id": "jvasp-44390",
"created_at": "2022-09-04T14:38:15.617352Z",
"updated_at": "2022-09-04T14:38:15.617367Z",
"structure_string": "Li2 Cr3 Ni1 O8\n1.0\n5.778087 -0.016828 -0.011898\n2.874471 5.012383 -0.011898\n2.874471 1.659576 4.729686\nLi Cr Ni O\n2 3 1 8\ndirect\n0.126108 0.126108 0.126108 Li\n0.873892 0.873892 0.873892 Li\n-0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500001 0.500000 -0.000000 Cr\n0.500000 0.500000 0.500000 Ni\n0.262055 0.262055 0.262055 O\n0.261191 0.261192 0.712530 O\n0.261192 0.712530 0.261192 O\n0.712530 0.261192 0.261192 O\n0.287470 0.738808 0.738808 O\n0.738808 0.287470 0.738808 O\n0.738809 0.738808 0.287470 O\n0.737946 0.737945 0.737946 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Ni",
"O"
],
"chemical_system": "Cr-Li-Ni-O",
"density": 4.307940733527393,
"density_atomic": 0.1018632144333151,
"volume": 137.43921275098893,
"volume_molar": 5.911987750928873,
"formula_full": "Li2 Cr3 Ni1 O8",
"formula_reduced": "Li2Cr3NiO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.044204471428572,
"spacegroup": 166
},
{
"id": "jvasp-30322",
"created_at": "2022-09-04T14:37:59.258194Z",
"updated_at": "2022-09-04T14:37:59.258211Z",
"structure_string": "Mn2 P4 O14\n1.0\n4.956428 0.102701 -0.138757\n-1.617272 6.001792 -0.126459\n-1.092843 -3.667994 7.912175\nMn P O\n2 4 14\ndirect\n0.078167 0.594018 0.364367 Mn\n0.921834 0.405982 0.635633 Mn\n0.244104 0.127151 0.363337 P\n0.605195 0.691928 0.879311 P\n0.394806 0.308072 0.120689 P\n0.755897 0.872850 0.636663 P\n0.693314 0.456702 0.252687 O\n0.810501 0.532579 0.830916 O\n0.627237 0.802992 0.063663 O\n0.538626 0.243491 0.493187 O\n0.268638 0.091497 0.179588 O\n0.731363 0.908503 0.820413 O\n0.189501 0.467421 0.169084 O\n0.372765 0.197009 0.936337 O\n0.942794 0.694845 0.587917 O\n0.306687 0.543299 0.747313 O\n0.057208 0.305155 0.412083 O\n0.066611 0.880977 0.348148 O\n0.461376 0.756510 0.506813 O\n0.933390 0.119024 0.651852 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mn",
"P",
"O"
],
"chemical_system": "Mn-O-P",
"density": 3.267096694609672,
"density_atomic": 0.08596119581174565,
"volume": 232.6631198081498,
"volume_molar": 7.0056502857271115,
"formula_full": "Mn2 P4 O14",
"formula_reduced": "MnP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 3.0439632741379308,
"spacegroup": 2
},
{
"id": "jvasp-80100",
"created_at": "2022-09-04T14:37:04.698396Z",
"updated_at": "2022-09-04T14:37:04.698421Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n-2.901355 -2.901355 -0.000000\n-2.901355 -0.000000 -2.901355\n0.000000 -2.901355 -2.901355\nMn V Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.499999 0.499999 0.499999 Mn\n0.749999 0.749999 0.749999 V\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.837253410123212,
"density_atomic": 0.0818893423042984,
"volume": 48.84640525181064,
"volume_molar": 7.353998201160172,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0439477519396547,
"spacegroup": 225
},
{
"id": "jvasp-18016",
"created_at": "2022-09-04T14:38:13.224844Z",
"updated_at": "2022-09-04T14:38:13.224862Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n3.553486 -0.000000 2.051607\n1.184495 3.350259 2.051607\n-0.000000 -0.000000 4.103212\nMn V Ga\n2 1 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750000 0.750000 Mn\n0.500001 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.836814198370917,
"density_atomic": 0.08188475309942705,
"volume": 48.84914283301403,
"volume_molar": 7.354410353643892,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.043920251939655,
"spacegroup": 225
},
{
"id": "jvasp-11012",
"created_at": "2022-09-04T14:37:10.632002Z",
"updated_at": "2022-09-04T14:37:10.632024Z",
"structure_string": "Zn1 Cr4 S8\n1.0\n6.891658 0.015990 0.011306\n3.459676 5.992334 0.000000\n3.459676 1.997444 5.649627\nZn Cr S\n1 4 8\ndirect\n0.500000 -0.000000 0.000000 Zn\n0.000001 0.499999 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.500001 0.499999 0.500001 Cr\n0.500000 -0.000001 0.500001 Cr\n0.256396 0.255151 0.255152 S\n0.256397 0.255151 0.733301 S\n0.256397 0.733300 0.255152 S\n0.732611 0.255795 0.255796 S\n0.267391 0.744203 0.744205 S\n0.743605 0.744848 0.266700 S\n0.743605 0.266699 0.744850 S\n0.743605 0.744847 0.744850 S\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Cr",
"S"
],
"chemical_system": "Cr-S-Zn",
"density": 3.779096700038367,
"density_atomic": 0.05583125085248175,
"volume": 232.8445055681954,
"volume_molar": 10.78632605941751,
"formula_full": "Zn1 Cr4 S8",
"formula_reduced": "Zn(CrS2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.043699230769231,
"spacegroup": 166
},
{
"id": "jvasp-17797",
"created_at": "2022-09-04T14:38:14.602842Z",
"updated_at": "2022-09-04T14:38:14.602859Z",
"structure_string": "Zr3 In1\n1.0\n4.462919 -0.000000 0.000000\n0.000000 4.462919 0.000000\n-0.000000 -0.000000 4.462919\nZr In\n3 1\ndirect\n0.500000 0.000000 0.500000 Zr\n0.000000 0.500000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"In"
],
"chemical_system": "In-Zr",
"density": 7.257247387771411,
"density_atomic": 0.044999011881289054,
"volume": 88.89084077117772,
"volume_molar": 13.38282888496948,
"formula_full": "Zr3 In1",
"formula_reduced": "Zr3In",
"formula_anonymous": "AB3",
"energy_above_hull": 3.043595867500001,
"spacegroup": 221
},
{
"id": "jvasp-117382",
"created_at": "2022-09-04T14:38:27.167850Z",
"updated_at": "2022-09-04T14:38:27.167875Z",
"structure_string": "K3 Ti8 O17\n1.0\n8.008351 -0.022176 0.704574\n7.099913 3.704783 0.704574\n-0.028765 -0.007011 12.115461\nK Ti O\n3 8 17\ndirect\n0.557931 0.557929 0.164233 K\n0.442625 0.442624 0.820869 K\n0.510830 0.510828 0.455178 K\n0.199029 0.199028 0.423419 Ti\n0.804067 0.804065 0.578953 Ti\n0.887809 0.887806 0.070232 Ti\n0.111086 0.111086 0.928626 Ti\n0.755877 0.755875 0.830653 Ti\n0.150309 0.150309 0.674325 Ti\n0.848978 0.848975 0.324567 Ti\n0.243138 0.243137 0.170749 Ti\n0.105962 0.105962 0.535174 O\n0.227745 0.227745 0.816127 O\n0.772054 0.772052 0.185805 O\n0.148630 0.148629 0.293042 O\n0.850266 0.850263 0.710908 O\n-0.000159 -0.000159 0.000668 O\n0.894053 0.894050 0.464884 O\n0.725640 0.725638 0.433602 O\n0.684727 0.684725 0.675928 O\n0.364882 0.364881 0.090405 O\n0.635103 0.635101 0.913307 O\n0.274212 0.274211 0.568241 O\n0.940415 0.940412 0.226965 O\n0.172370 0.172370 0.063228 O\n0.827700 0.827698 0.938143 O\n0.316044 0.316043 0.325741 O\n0.061598 0.061598 0.777040 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Ti",
"O"
],
"chemical_system": "K-O-Ti",
"density": 3.547725000997848,
"density_atomic": 0.07746712585567521,
"volume": 361.44364065042606,
"volume_molar": 7.7738017171561555,
"formula_full": "K3 Ti8 O17",
"formula_reduced": "K3Ti8O17",
"formula_anonymous": "A3B8C17",
"energy_above_hull": 3.043490005952381,
"spacegroup": 8
},
{
"id": "jvasp-79213",
"created_at": "2022-09-04T14:37:14.761100Z",
"updated_at": "2022-09-04T14:37:14.761136Z",
"structure_string": "Al1 V1 Co2\n1.0\n-2.874316 -2.874316 -0.000000\n-2.874316 -0.000000 -2.874316\n0.000000 -2.874316 -2.874316\nAl V Co\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.500001 V\n0.250000 0.250000 0.250000 Co\n0.750001 0.750001 0.750001 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"V",
"Co"
],
"chemical_system": "Al-Co-V",
"density": 6.845494147428732,
"density_atomic": 0.08422217611358478,
"volume": 47.493429694875964,
"volume_molar": 7.150302969942673,
"formula_full": "Al1 V1 Co2",
"formula_reduced": "AlVCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0433247000000003,
"spacegroup": 225
}
]
}