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=-nelements&page=3378",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=3376",
"results": [
{
"id": "jvasp-41848",
"created_at": "2022-09-04T14:37:34.457620Z",
"updated_at": "2022-09-04T14:37:34.457647Z",
"structure_string": "Li1 Al1 Pt2\n1.0\n-0.000002 3.007991 3.007991\n3.007990 -0.000001 3.007990\n3.007990 3.007990 -0.000001\nLi Al Pt\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Li\n0.249999 0.249999 0.249999 Al\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Al",
"Pt"
],
"chemical_system": "Al-Li-Pt",
"density": 12.937432229253353,
"density_atomic": 0.0734852875913216,
"volume": 54.43266442999386,
"volume_molar": 8.195029178481704,
"formula_full": "Li1 Al1 Pt2",
"formula_reduced": "LiAlPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6609339000000003,
"spacegroup": 225
},
{
"id": "jvasp-23114",
"created_at": "2022-09-04T14:37:34.460319Z",
"updated_at": "2022-09-04T14:37:34.460345Z",
"structure_string": "K2 Er6 F20\n1.0\n7.020386 -0.000000 4.053222\n2.340129 6.618884 4.053222\n0.000000 0.000000 8.106444\nK Er F\n2 6 20\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.239990 0.760010 0.760010 Er\n0.760011 0.239989 0.239989 Er\n0.760011 0.760010 0.239989 Er\n0.239990 0.239989 0.760010 Er\n0.760011 0.239989 0.760010 Er\n0.239990 0.760010 0.239989 Er\n0.500001 0.831942 0.168057 F\n0.831943 0.168057 0.499999 F\n0.500000 0.500000 0.831942 F\n0.831943 0.500000 0.499999 F\n0.887970 0.887969 0.887968 F\n0.112031 0.112031 0.663909 F\n0.168058 0.500000 0.500000 F\n0.887970 0.336091 0.887968 F\n0.336091 0.887969 0.887969 F\n0.887970 0.887969 0.336090 F\n0.112031 0.112031 0.112031 F\n0.500000 0.168057 0.831942 F\n0.500001 0.831942 0.499999 F\n0.831943 0.500000 0.168057 F\n0.168058 0.831942 0.500000 F\n0.500000 0.168057 0.500000 F\n0.168058 0.500000 0.831942 F\n0.500000 0.500000 0.168057 F\n0.663909 0.112031 0.112030 F\n0.112031 0.663909 0.112030 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Er",
"F"
],
"chemical_system": "Er-F-K",
"density": 6.4437211989939085,
"density_atomic": 0.07433303804175337,
"volume": 376.6831107356625,
"volume_molar": 8.10156683844581,
"formula_full": "K2 Er6 F20",
"formula_reduced": "KEr3F10",
"formula_anonymous": "AB3C10",
"energy_above_hull": 0.0319755084821427,
"spacegroup": 225
},
{
"id": "jvasp-21982",
"created_at": "2022-09-04T14:37:34.464735Z",
"updated_at": "2022-09-04T14:37:34.464748Z",
"structure_string": "Ba1 Ge1 F6\n1.0\n4.839087 -0.005713 -0.686711\n-0.790249 4.774129 -0.686711\n-0.004851 -0.005713 4.887568\nBa Ge F\n1 1 6\ndirect\n0.500000 0.500001 0.500001 Ba\n0.000000 0.000000 0.000000 Ge\n0.268014 0.268015 0.923986 F\n0.268014 0.923986 0.268014 F\n0.731987 0.076016 0.731987 F\n0.731987 0.731987 0.076015 F\n0.076015 0.731987 0.731987 F\n0.923986 0.268015 0.268014 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"F"
],
"chemical_system": "Ba-F-Ge",
"density": 4.766699264685674,
"density_atomic": 0.07088767162877983,
"volume": 112.85460244616165,
"volume_molar": 8.495328766807821,
"formula_full": "Ba1 Ge1 F6",
"formula_reduced": "BaGeF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-41733",
"created_at": "2022-09-04T14:37:34.467345Z",
"updated_at": "2022-09-04T14:37:34.467363Z",
"structure_string": "Ac2 Hg1 Ge1\n1.0\n-0.000000 3.967496 3.967496\n3.967496 -0.000000 3.967496\n3.967496 3.967496 0.000000\nAc Hg Ge\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ac\n0.500000 0.500000 0.500000 Ac\n0.750002 0.750002 0.750002 Hg\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Hg",
"Ge"
],
"chemical_system": "Ac-Ge-Hg",
"density": 9.668105822884833,
"density_atomic": 0.03202436322379913,
"volume": 124.90490355878089,
"volume_molar": 18.804872771130086,
"formula_full": "Ac2 Hg1 Ge1",
"formula_reduced": "Ac2HgGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0256426374999999,
"spacegroup": 225
},
{
"id": "jvasp-41920",
"created_at": "2022-09-04T14:37:34.439995Z",
"updated_at": "2022-09-04T14:37:34.440017Z",
"structure_string": "Sc1 Al1 Co2\n1.0\n-0.000005 2.979216 2.979221\n2.979219 -0.000004 2.979220\n2.979220 2.979216 -0.000005\nSc Al Co\n1 1 2\ndirect\n0.750002 0.749997 0.750002 Sc\n0.250001 0.250000 0.250001 Al\n0.500001 0.499998 0.500001 Co\n0.000000 0.000000 0.000000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Al",
"Co"
],
"chemical_system": "Al-Co-Sc",
"density": 5.959583869714887,
"density_atomic": 0.07563482979775105,
"volume": 52.885687859628625,
"volume_molar": 7.962126412002668,
"formula_full": "Sc1 Al1 Co2",
"formula_reduced": "ScAlCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5710774625,
"spacegroup": 225
},
{
"id": "jvasp-42001",
"created_at": "2022-09-04T14:37:34.514057Z",
"updated_at": "2022-09-04T14:37:34.514082Z",
"structure_string": "Pm2 Zn1 Pb1\n1.0\n-0.000004 3.780112 3.780112\n3.780111 -0.000002 3.780110\n3.780113 3.780112 -0.000004\nPm Zn Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500001 0.500001 0.500001 Pm\n0.750000 0.750000 0.750000 Zn\n0.249999 0.249999 0.249999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Zn",
"Pb"
],
"chemical_system": "Pb-Pm-Zn",
"density": 8.647913054479373,
"density_atomic": 0.0370267448350906,
"volume": 108.03002040322923,
"volume_molar": 16.26429972934796,
"formula_full": "Pm2 Zn1 Pb1",
"formula_reduced": "Pm2ZnPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3504308924999999,
"spacegroup": 225
},
{
"id": "jvasp-22034",
"created_at": "2022-09-04T14:37:34.626220Z",
"updated_at": "2022-09-04T14:37:34.626237Z",
"structure_string": "Sr8 Al16 S32\n1.0\n11.551426 -0.007091 -3.074151\n-6.721065 9.394826 -3.074151\n-0.011716 -0.022771 12.094625\nSr Al S\n8 16 32\ndirect\n0.875000 0.125000 0.250000 Sr\n0.375000 0.625000 0.250000 Sr\n0.625000 0.375000 0.750000 Sr\n0.623410 0.873410 0.746819 Sr\n0.126590 0.376590 0.753181 Sr\n0.376590 0.126590 0.253181 Sr\n0.873410 0.623410 0.246819 Sr\n0.125000 0.875000 0.750000 Sr\n0.531041 0.637495 0.999776 Al\n0.637719 0.031265 0.500225 Al\n0.362505 0.468960 0.500225 Al\n0.968735 0.362282 0.999776 Al\n0.889827 0.864677 0.999094 Al\n0.362281 0.968735 0.499776 Al\n0.637495 0.531041 0.499776 Al\n0.031265 0.637719 0.000225 Al\n0.865583 0.390734 0.500907 Al\n0.135324 0.110173 0.500907 Al\n0.609267 0.134417 0.999094 Al\n0.110173 0.135324 0.000907 Al\n0.134417 0.609267 0.499094 Al\n0.864676 0.889827 0.499094 Al\n0.468959 0.362505 0.000225 Al\n0.390733 0.865583 0.000907 Al\n0.918394 0.418465 0.835541 S\n0.417146 0.417076 0.835541 S\n0.581535 0.081606 0.664460 S\n0.645553 0.336571 0.998327 S\n0.338244 0.147227 0.501674 S\n0.661756 0.852774 0.498327 S\n0.852773 0.661756 0.998327 S\n0.354447 0.663430 0.001674 S\n0.336570 0.645553 0.498327 S\n0.147227 0.338244 0.001674 S\n0.663430 0.354448 0.501674 S\n0.582924 0.582854 0.664460 S\n0.582854 0.582924 0.164460 S\n0.081606 0.581535 0.164459 S\n0.312413 0.160602 0.001559 S\n0.159043 0.810854 0.498441 S\n0.839398 0.687588 0.498441 S\n0.189147 0.840957 0.001559 S\n0.687587 0.839399 0.998442 S\n0.840957 0.189147 0.501559 S\n0.160602 0.312413 0.501559 S\n0.418465 0.918395 0.335541 S\n0.810853 0.159043 0.998442 S\n0.081314 0.080549 0.163701 S\n0.582387 0.083151 0.163701 S\n0.083150 0.582387 0.663701 S\n0.918686 0.919451 0.836300 S\n0.417613 0.916850 0.836300 S\n0.080549 0.081314 0.663701 S\n0.417076 0.417147 0.335541 S\n0.916850 0.417613 0.336300 S\n0.919451 0.918687 0.336300 S\n",
"nsites": 56,
"nelements": 3,
"elements": [
"Sr",
"Al",
"S"
],
"chemical_system": "Al-S-Sr",
"density": 2.7356480190688046,
"density_atomic": 0.04273639454493484,
"volume": 1310.3585502777792,
"volume_molar": 14.091363635432721,
"formula_full": "Sr8 Al16 S32",
"formula_reduced": "Sr(AlS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4589917014285714,
"spacegroup": 70
},
{
"id": "jvasp-59790",
"created_at": "2022-09-04T14:37:34.640005Z",
"updated_at": "2022-09-04T14:37:34.640026Z",
"structure_string": "Nd4 Sn4 Pd4\n1.0\n4.720294 0.000000 0.000000\n0.000000 7.496216 0.000000\n0.000000 0.000000 8.023893\nNd Sn Pd\n4 4 4\ndirect\n0.250000 0.488738 0.702797 Nd\n0.749999 0.511262 0.297203 Nd\n0.250000 0.988738 0.797203 Nd\n0.749999 0.011262 0.202797 Nd\n0.250000 0.809718 0.412198 Sn\n0.749999 0.690283 0.912198 Sn\n0.250000 0.309717 0.087802 Sn\n0.749999 0.190283 0.587802 Sn\n0.749999 0.298426 0.916093 Pd\n0.250000 0.201574 0.416094 Pd\n0.749999 0.798426 0.583906 Pd\n0.250000 0.701575 0.083906 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nd",
"Sn",
"Pd"
],
"chemical_system": "Nd-Pd-Sn",
"density": 8.641254376381744,
"density_atomic": 0.04226539928488385,
"volume": 283.9201853770675,
"volume_molar": 14.248394341216619,
"formula_full": "Nd4 Sn4 Pd4",
"formula_reduced": "NdSnPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7989862999999998,
"spacegroup": 62
},
{
"id": "jvasp-41995",
"created_at": "2022-09-04T14:37:34.647821Z",
"updated_at": "2022-09-04T14:37:34.647838Z",
"structure_string": "Sr2 Cd1 In1\n1.0\n0.000000 4.031686 4.031686\n4.031686 0.000000 4.031686\n4.031686 4.031686 0.000000\nSr Cd In\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500001 0.500001 0.500001 Sr\n0.250000 0.250000 0.250000 Cd\n0.750002 0.750002 0.750002 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Cd",
"In"
],
"chemical_system": "Cd-In-Sr",
"density": 5.099075409346147,
"density_atomic": 0.030518971519842692,
"volume": 131.0660156879565,
"volume_molar": 19.73244988313106,
"formula_full": "Sr2 Cd1 In1",
"formula_reduced": "Sr2CdIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-35732",
"created_at": "2022-09-04T14:37:34.721417Z",
"updated_at": "2022-09-04T14:37:34.721439Z",
"structure_string": "Cr1 Co2 Sb1\n1.0\n3.003970 3.003970 0.000000\n3.003970 0.000000 -3.003970\n0.000000 3.003970 -3.003970\nCr Co Sb\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Cr\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.250000 0.250000 0.250000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Co",
"Sb"
],
"chemical_system": "Co-Cr-Sb",
"density": 8.932095178897763,
"density_atomic": 0.07378077660283129,
"volume": 54.21466382134154,
"volume_molar": 8.162208419704957,
"formula_full": "Cr1 Co2 Sb1",
"formula_reduced": "CrCo2Sb",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.269526325,
"spacegroup": 225
},
{
"id": "jvasp-40903",
"created_at": "2022-09-04T14:37:35.402892Z",
"updated_at": "2022-09-04T14:37:35.402919Z",
"structure_string": "Bi4 Te4 O16\n1.0\n-0.000000 5.618429 -0.000000\n-6.457985 2.809214 0.037824\n2.099570 -2.809214 9.410169\nBi Te O\n4 4 16\ndirect\n0.229632 0.610818 0.155295 Bi\n0.042493 0.744670 0.744825 Bi\n0.957662 0.244669 0.244826 Bi\n0.314846 0.110818 0.655295 Bi\n0.652775 0.923483 0.384138 Te\n0.492539 0.505232 0.503642 Te\n0.807879 0.423483 0.884138 Te\n0.505871 0.005232 0.003642 Te\n0.353942 0.001996 0.154129 O\n0.702175 0.203849 0.415491 O\n0.347449 0.418217 0.620197 O\n0.083303 0.531208 0.903262 O\n0.519559 0.289299 0.085045 O\n0.798191 0.501997 0.654129 O\n0.200616 0.494671 0.343761 O\n0.276185 0.789300 0.585045 O\n0.911461 0.460029 0.091252 O\n0.636166 0.588970 0.380564 O\n0.288752 0.031207 0.403262 O\n0.648472 0.994672 0.843761 O\n0.719761 0.960029 0.591252 O\n0.854530 0.918218 0.120196 O\n0.509467 0.703850 0.915491 O\n0.155429 0.088970 0.880564 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Bi",
"Te",
"O"
],
"chemical_system": "Bi-O-Te",
"density": 7.782509734029906,
"density_atomic": 0.07019961520691793,
"volume": 341.88221586768583,
"volume_molar": 8.578595113732957,
"formula_full": "Bi4 Te4 O16",
"formula_reduced": "BiTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.905097677777778,
"spacegroup": 9
},
{
"id": "jvasp-22929",
"created_at": "2022-09-04T14:37:34.497695Z",
"updated_at": "2022-09-04T14:37:34.497715Z",
"structure_string": "Y8 Ti4 O20\n1.0\n3.700910 -0.000000 0.000000\n-0.000000 10.384073 0.000000\n0.000000 0.000000 11.296589\nY Ti O\n8 4 20\ndirect\n0.250000 0.635959 0.056637 Y\n0.750000 0.364040 0.943363 Y\n0.250000 0.135960 0.443363 Y\n0.750000 0.864040 0.556637 Y\n0.250000 0.616472 0.723568 Y\n0.750000 0.383528 0.276432 Y\n0.250000 0.116472 0.776432 Y\n0.750000 0.883528 0.223568 Y\n0.750000 0.827553 0.881777 Ti\n0.250000 0.172446 0.118223 Ti\n0.250000 0.672446 0.381777 Ti\n0.750000 0.327554 0.618223 Ti\n0.250000 0.254719 0.269938 O\n0.250000 0.224846 0.956040 O\n0.750000 0.775154 0.043960 O\n0.250000 0.994372 0.605381 O\n0.750000 0.005628 0.394619 O\n0.250000 0.494372 0.894619 O\n0.750000 0.505628 0.105381 O\n0.750000 0.745281 0.730062 O\n0.750000 0.245281 0.769938 O\n0.750000 0.734879 0.384283 O\n0.750000 0.495742 0.653148 O\n0.250000 0.504258 0.346852 O\n0.750000 0.995741 0.846852 O\n0.250000 0.004258 0.153148 O\n0.750000 0.275154 0.456040 O\n0.250000 0.265120 0.615717 O\n0.750000 0.234880 0.115717 O\n0.250000 0.765120 0.884283 O\n0.250000 0.754718 0.230062 O\n0.250000 0.724846 0.543960 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Y",
"Ti",
"O"
],
"chemical_system": "O-Ti-Y",
"density": 4.6767743865086455,
"density_atomic": 0.07370999701461554,
"volume": 434.1337850502815,
"volume_molar": 8.170046132013685,
"formula_full": "Y8 Ti4 O20",
"formula_reduced": "Y2TiO5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.6965108416666665,
"spacegroup": 62
}
]
}