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=1110",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=1108",
"results": [
{
"id": "jvasp-11812",
"created_at": "2022-09-04T14:38:12.270171Z",
"updated_at": "2022-09-04T14:38:12.270199Z",
"structure_string": "Ce2 V2 O8\n1.0\n5.849363 0.024064 -1.714506\n-3.275576 4.846259 -1.714506\n-0.012718 -0.024064 6.095442\nCe V O\n2 2 8\ndirect\n0.874999 0.125000 0.749999 Ce\n0.124999 0.875000 0.249999 Ce\n0.624999 0.375000 0.249999 V\n0.374999 0.625000 0.749999 V\n0.799262 0.732502 0.433238 O\n0.799262 0.366025 0.066760 O\n0.267497 0.200736 0.066760 O\n0.200736 0.633976 0.933238 O\n0.200736 0.267498 0.566760 O\n0.633974 0.200736 0.433238 O\n0.366024 0.799264 0.566760 O\n0.732501 0.799264 0.933238 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"V",
"O"
],
"chemical_system": "Ce-O-V",
"density": 4.902251900660254,
"density_atomic": 0.06944864305075045,
"volume": 172.78955315557212,
"volume_molar": 8.671358424669645,
"formula_full": "Ce2 V2 O8",
"formula_reduced": "CeVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.464645616666667,
"spacegroup": 141
},
{
"id": "jvasp-21253",
"created_at": "2022-09-04T14:38:12.269365Z",
"updated_at": "2022-09-04T14:38:12.269392Z",
"structure_string": "Te4 S2 O14\n1.0\n4.598084 0.000000 0.000000\n0.000000 6.951174 0.000000\n0.000000 0.000000 8.998887\nTe S O\n4 2 14\ndirect\n0.744985 0.319581 0.699648 Te\n0.244985 0.680419 0.800352 Te\n0.244985 0.680419 0.199648 Te\n0.744985 0.319581 0.300352 Te\n0.169028 0.008319 0.500000 S\n0.669028 0.991680 0.000000 S\n0.406942 0.151579 0.500000 O\n0.906942 0.848421 0.000000 O\n0.987078 0.037980 0.636579 O\n0.487078 0.962019 0.863421 O\n0.487078 0.962019 0.136579 O\n0.987078 0.037980 0.363421 O\n0.631962 0.597148 0.743935 O\n0.631962 0.597148 0.256065 O\n0.331969 0.586745 0.000000 O\n0.131963 0.402852 0.756065 O\n0.775303 0.191089 0.000000 O\n0.275304 0.808911 0.500000 O\n0.131963 0.402852 0.243935 O\n0.831969 0.413254 0.500000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Te",
"S",
"O"
],
"chemical_system": "O-S-Te",
"density": 4.6101165670997615,
"density_atomic": 0.06953542871395581,
"volume": 287.62316375833296,
"volume_molar": 8.66053588994606,
"formula_full": "Te4 S2 O14",
"formula_reduced": "Te2SO7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.345331003333333,
"spacegroup": 31
},
{
"id": "jvasp-19343",
"created_at": "2022-09-04T14:38:12.262128Z",
"updated_at": "2022-09-04T14:38:12.262154Z",
"structure_string": "Mg4 Ti4 O12\n1.0\n5.073871 0.000000 0.000000\n-0.000000 5.304473 0.000000\n0.000000 0.000000 7.453113\nMg Ti O\n4 4 12\ndirect\n0.988287 0.058505 0.250000 Mg\n0.488287 0.441495 0.750000 Mg\n0.511713 0.558504 0.250000 Mg\n0.011713 0.941495 0.750000 Mg\n0.500000 0.000000 0.000000 Ti\n0.000000 0.500000 0.000000 Ti\n0.000000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.182383 0.187575 0.933339 O\n0.682383 0.312425 0.066660 O\n0.317617 0.687575 0.933339 O\n0.817617 0.812424 0.066660 O\n0.182383 0.187575 0.566660 O\n0.373840 0.942671 0.250000 O\n0.126160 0.442672 0.250000 O\n0.626160 0.057328 0.750000 O\n0.317617 0.687575 0.566660 O\n0.873839 0.557328 0.750000 O\n0.682383 0.312425 0.433340 O\n0.817617 0.812424 0.433340 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"O"
],
"chemical_system": "Mg-O-Ti",
"density": 3.979115106168012,
"density_atomic": 0.0997035507882451,
"volume": 200.5946612922232,
"volume_molar": 6.04004643003146,
"formula_full": "Mg4 Ti4 O12",
"formula_reduced": "MgTiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.5471475766666665,
"spacegroup": 62
},
{
"id": "jvasp-46469",
"created_at": "2022-09-04T14:38:12.260202Z",
"updated_at": "2022-09-04T14:38:12.260227Z",
"structure_string": "Li1 Mn2 Fe3 O8\n1.0\n0.000000 4.070555 4.070555\n4.054221 -0.002530 4.073084\n4.054221 4.073084 -0.002530\nLi Mn Fe O\n1 2 3 8\ndirect\n0.125346 0.124654 0.124654 Li\n0.497635 0.498911 0.005821 Mn\n0.497635 0.005821 0.498911 Mn\n0.008036 0.497677 0.497677 Fe\n0.496612 0.497677 0.497677 Fe\n0.873435 0.876565 0.876565 Fe\n0.715408 0.259748 0.259748 O\n0.265096 0.259748 0.259748 O\n0.262348 0.715485 0.259819 O\n0.262348 0.259819 0.715485 O\n0.738028 0.737242 0.286702 O\n0.738028 0.286702 0.737242 O\n0.737941 0.739975 0.739975 O\n0.282107 0.739975 0.739975 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Mn-O",
"density": 5.090121571159053,
"density_atomic": 0.10407440785333033,
"volume": 134.51914153314115,
"volume_molar": 5.786380037335273,
"formula_full": "Li1 Mn2 Fe3 O8",
"formula_reduced": "LiMn2Fe3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.3012813559113297,
"spacegroup": 44
},
{
"id": "jvasp-44777",
"created_at": "2022-09-04T14:38:12.250727Z",
"updated_at": "2022-09-04T14:38:12.250754Z",
"structure_string": "Li2 Mn2 P4 H2 O14\n1.0\n6.591472 -0.033692 -0.038344\n0.291756 6.464567 0.017577\n2.336918 0.706834 6.014399\nLi Mn P H O\n2 2 4 2 14\ndirect\n0.157279 0.103474 0.776435 Li\n0.842721 0.896526 0.223567 Li\n0.723568 0.347074 0.895263 Mn\n0.276432 0.652926 0.104738 Mn\n0.230185 0.157053 0.226359 P\n0.813865 0.394366 0.360703 P\n0.186135 0.605634 0.639298 P\n0.769815 0.842947 0.773643 P\n0.499392 0.159255 0.347085 H\n0.500608 0.840745 0.652916 H\n0.984986 0.752744 0.609899 O\n0.282125 0.734642 0.768060 O\n0.637195 0.673751 0.948100 O\n0.331285 0.593085 0.402476 O\n0.921280 0.597949 0.227474 O\n0.078720 0.402051 0.772527 O\n0.834332 0.018878 0.874679 O\n0.362805 0.326249 0.051901 O\n0.717875 0.265358 0.231942 O\n0.015014 0.247256 0.390102 O\n0.165668 0.981122 0.125322 O\n0.352292 0.079226 0.391763 O\n0.668715 0.406914 0.597525 O\n0.647708 0.920774 0.608239 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"Mn",
"P",
"H",
"O"
],
"chemical_system": "H-Li-Mn-O-P",
"density": 3.0624991258305485,
"density_atomic": 0.0934481784736528,
"volume": 256.8268359213301,
"volume_molar": 6.444363986931975,
"formula_full": "Li2 Mn2 P4 H2 O14",
"formula_reduced": "LiMnP2HO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.9124868951149425,
"spacegroup": 2
},
{
"id": "jvasp-44769",
"created_at": "2022-09-04T14:38:12.249540Z",
"updated_at": "2022-09-04T14:38:12.249563Z",
"structure_string": "Li4 Ti3 Cr3 W2 O16\n1.0\n-5.904245 -0.000313 0.000236\n2.951777 5.082692 -0.018585\n-0.000267 -0.151382 -9.656281\nLi Ti Cr W O\n4 3 3 2 16\ndirect\n0.665953 0.331932 0.899900 Li\n0.997289 0.994588 0.991080 Li\n0.994767 0.989530 0.495086 Li\n0.333706 0.667434 0.404040 Li\n0.340119 0.175961 0.217436 Ti\n0.835820 0.175968 0.217436 Ti\n0.169706 0.339432 0.716496 Ti\n0.170278 0.830642 0.712324 Cr\n0.660345 0.830642 0.712323 Cr\n0.830299 0.660622 0.210971 Cr\n0.666277 0.332575 0.487996 W\n0.336176 0.672372 0.986519 W\n0.165924 0.331868 0.099219 O\n0.166206 0.834457 0.093361 O\n0.330343 0.660714 0.604646 O\n0.482455 0.519845 0.843322 O\n0.037363 0.519842 0.843321 O\n0.830892 0.661802 0.596588 O\n0.965385 0.488095 0.341728 O\n0.516907 0.033837 0.341919 O\n0.835257 0.167444 0.597369 O\n0.000368 0.000756 0.808108 O\n0.999604 0.999233 0.311312 O\n0.663453 0.326931 0.104058 O\n0.481735 0.963487 0.838816 O\n0.332174 0.167448 0.597372 O\n0.522685 0.488091 0.341729 O\n0.668232 0.834459 0.093359 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Ti",
"Cr",
"W",
"O"
],
"chemical_system": "Cr-Li-O-Ti-W",
"density": 5.449554640743525,
"density_atomic": 0.09662257458377516,
"volume": 289.7873516682483,
"volume_molar": 6.232643650763613,
"formula_full": "Li4 Ti3 Cr3 W2 O16",
"formula_reduced": "Li4Ti3Cr3(WO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.7155744,
"spacegroup": 8
},
{
"id": "jvasp-18014",
"created_at": "2022-09-04T14:38:12.245947Z",
"updated_at": "2022-09-04T14:38:12.245971Z",
"structure_string": "Tm3 In3 Rh3\n1.0\n3.748699 -6.492936 0.000000\n3.748699 6.492936 -0.000000\n-0.000000 0.000000 3.824330\nTm In Rh\n3 3 3\ndirect\n-0.000000 0.403869 0.500000 Tm\n0.596131 0.596131 0.500000 Tm\n0.403869 -0.000000 0.500000 Tm\n0.261476 0.261476 0.000000 In\n-0.000000 0.738525 0.000000 In\n0.738525 -0.000000 0.000000 In\n0.333333 0.666667 0.000000 Rh\n0.000000 0.000000 0.500000 Rh\n0.666667 0.333333 0.000000 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tm",
"In",
"Rh"
],
"chemical_system": "In-Rh-Tm",
"density": 10.346417001513116,
"density_atomic": 0.04834320740659842,
"volume": 186.16886389651464,
"volume_molar": 12.457056705712148,
"formula_full": "Tm3 In3 Rh3",
"formula_reduced": "TmInRh",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8521324066666665,
"spacegroup": 189
},
{
"id": "jvasp-18271",
"created_at": "2022-09-04T14:38:12.233630Z",
"updated_at": "2022-09-04T14:38:12.233650Z",
"structure_string": "Tb1 In1 Cu2\n1.0\n4.070799 -0.000000 2.350277\n1.356933 3.837986 2.350277\n0.000000 0.000000 4.700553\nTb In Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500001 0.500000 In\n0.749999 0.750001 0.750000 Cu\n0.250000 0.250000 0.250000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"In",
"Cu"
],
"chemical_system": "Cu-In-Tb",
"density": 9.063232342779688,
"density_atomic": 0.054466314837416964,
"volume": 73.43988687209847,
"volume_molar": 11.05663340355633,
"formula_full": "Tb1 In1 Cu2",
"formula_reduced": "TbInCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.07428354625,
"spacegroup": 225
},
{
"id": "jvasp-43028",
"created_at": "2022-09-04T14:38:12.230884Z",
"updated_at": "2022-09-04T14:38:12.230898Z",
"structure_string": "Cr1 Sb1 O4\n1.0\n5.539538 0.176120 -0.000000\n2.582733 4.903773 -0.000000\n-4.061135 -2.539947 2.788072\nCr Sb O\n1 1 4\ndirect\n0.750000 0.249999 0.500000 Cr\n0.000000 0.000000 0.000000 Sb\n0.543391 0.043390 0.500000 O\n0.208303 0.208303 0.000000 O\n0.956609 0.456608 0.500000 O\n0.791697 0.791696 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Sb",
"O"
],
"chemical_system": "Cr-O-Sb",
"density": 5.301543320948027,
"density_atomic": 0.08057070859890728,
"volume": 74.46875054641599,
"volume_molar": 7.474354966864067,
"formula_full": "Cr1 Sb1 O4",
"formula_reduced": "CrSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.685242916666667,
"spacegroup": 119
},
{
"id": "jvasp-12372",
"created_at": "2022-09-04T14:38:12.227115Z",
"updated_at": "2022-09-04T14:38:12.227135Z",
"structure_string": "Mn4 Co4 Ge4\n1.0\n3.757723 0.000000 0.000000\n-0.000000 5.835835 0.000000\n0.000000 0.000000 7.078026\nMn Co Ge\n4 4 4\ndirect\n0.749999 0.467455 0.310243 Mn\n0.250000 0.532544 0.689758 Mn\n0.250000 0.032545 0.810243 Mn\n0.749999 0.967454 0.189758 Mn\n0.749999 0.842909 0.560633 Co\n0.749999 0.342909 0.939368 Co\n0.250000 0.157090 0.439368 Co\n0.250000 0.657090 0.060633 Co\n0.749999 0.241748 0.620440 Ge\n0.250000 0.758251 0.379561 Ge\n0.749999 0.741748 0.879561 Ge\n0.250000 0.258251 0.120440 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Mn",
"density": 7.981309960617385,
"density_atomic": 0.07731100610661006,
"volume": 155.2172272011605,
"volume_molar": 7.789499921519079,
"formula_full": "Mn4 Co4 Ge4",
"formula_reduced": "MnCoGe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.418691363793103,
"spacegroup": 62
},
{
"id": "jvasp-37740",
"created_at": "2022-09-04T14:38:12.221899Z",
"updated_at": "2022-09-04T14:38:12.221919Z",
"structure_string": "Ho1 Tm1 Tl2\n1.0\n0.000000 3.744020 3.744020\n3.744020 -0.000000 3.744020\n3.744020 3.744020 0.000000\nHo Tm Tl\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Tm",
"Tl"
],
"chemical_system": "Ho-Tl-Tm",
"density": 11.748374231119305,
"density_atomic": 0.038107943762285885,
"volume": 104.9649916813056,
"volume_molar": 15.802848869426287,
"formula_full": "Ho1 Tm1 Tl2",
"formula_reduced": "HoTmTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2862012541666666,
"spacegroup": 225
},
{
"id": "jvasp-36760",
"created_at": "2022-09-04T14:38:12.220782Z",
"updated_at": "2022-09-04T14:38:12.220805Z",
"structure_string": "K1 Ag1 O2\n1.0\n3.013041 -0.000000 0.000000\n-0.000000 3.568966 0.000000\n0.000000 0.000000 5.881571\nK Ag O\n1 1 2\ndirect\n0.000000 0.500001 0.000000 K\n0.000000 0.000000 0.500000 Ag\n0.500000 0.000000 0.730149 O\n0.500000 0.000000 0.269851 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ag",
"O"
],
"chemical_system": "Ag-K-O",
"density": 4.698693691153599,
"density_atomic": 0.06324398038285522,
"volume": 63.24712606299457,
"volume_molar": 9.522077395420448,
"formula_full": "K1 Ag1 O2",
"formula_reduced": "KAgO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6912105649999999,
"spacegroup": 47
}
]
}