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=4434",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=4432",
"results": [
{
"id": "jvasp-106127",
"created_at": "2022-09-04T14:35:47.680267Z",
"updated_at": "2022-09-04T14:35:47.680298Z",
"structure_string": "Bi2 Pd1 Pt1\n1.0\n4.382216 0.000000 0.000000\n-2.191108 3.795110 0.000000\n-0.000000 0.000000 5.658797\nBi Pd Pt\n2 1 1\ndirect\n0.333333 0.666667 0.245790 Bi\n0.666667 0.333333 0.754210 Bi\n0.000000 0.000000 0.500000 Pd\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Bi",
"Pd",
"Pt"
],
"chemical_system": "Bi-Pd-Pt",
"density": 12.694522953337525,
"density_atomic": 0.042502818279625834,
"volume": 94.1114062997898,
"volume_molar": 14.168803396472125,
"formula_full": "Bi2 Pd1 Pt1",
"formula_reduced": "Bi2PdPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4493189250000005,
"spacegroup": 164
},
{
"id": "jvasp-99280",
"created_at": "2022-09-04T14:35:47.673418Z",
"updated_at": "2022-09-04T14:35:47.673445Z",
"structure_string": "Pr4 Sn2 S10\n1.0\n4.011868 0.000000 0.000000\n0.000000 7.874396 0.000000\n0.000000 -0.000000 11.329442\nPr Sn S\n4 2 10\ndirect\n0.500000 0.430900 0.169592 Pr\n0.500000 0.069100 0.669592 Pr\n0.500000 0.569100 0.830408 Pr\n0.500000 0.930901 0.330408 Pr\n0.000000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.000000 0.351166 0.703199 S\n0.000000 0.148834 0.203199 S\n0.000000 0.000000 0.500000 S\n0.500000 0.810663 0.073117 S\n0.000000 0.500000 0.000000 S\n0.000000 0.648834 0.296801 S\n0.500000 0.310663 0.426883 S\n0.500000 0.689338 0.573117 S\n0.500000 0.189337 0.926883 S\n0.000000 0.851166 0.796801 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Pr",
"Sn",
"S"
],
"chemical_system": "Pr-S-Sn",
"density": 5.204195974898866,
"density_atomic": 0.044704122599983596,
"volume": 357.9088251696471,
"volume_molar": 13.471108277611537,
"formula_full": "Pr4 Sn2 S10",
"formula_reduced": "Pr2SnS5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.733101425,
"spacegroup": 55
},
{
"id": "jvasp-67014",
"created_at": "2022-09-04T14:35:47.671087Z",
"updated_at": "2022-09-04T14:35:47.671110Z",
"structure_string": "Sr1 Ti1 Be2\n1.0\n2.926461 0.000000 0.000000\n0.000000 2.926461 -0.000000\n0.000000 -0.000000 8.027199\nSr Ti Be\n1 1 2\ndirect\n0.000000 0.000000 0.464235 Sr\n0.500000 0.500000 0.838077 Ti\n0.000000 0.000000 0.038836 Be\n0.500000 0.500000 0.158852 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"Be"
],
"chemical_system": "Be-Sr-Ti",
"density": 3.708003341765612,
"density_atomic": 0.05818492517695229,
"volume": 68.746328844373,
"volume_molar": 10.350001725851557,
"formula_full": "Sr1 Ti1 Be2",
"formula_reduced": "SrTiBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8530667108333327,
"spacegroup": 99
},
{
"id": "jvasp-64047",
"created_at": "2022-09-04T14:35:47.667646Z",
"updated_at": "2022-09-04T14:35:47.667668Z",
"structure_string": "Ba4 La1 Tc1\n1.0\n0.000000 4.870064 4.870064\n4.870064 -0.000000 4.870064\n4.870064 4.870064 0.000000\nBa La Tc\n4 1 1\ndirect\n0.121930 0.626022 0.626022 Ba\n0.626022 0.626022 0.626022 Ba\n0.626022 0.121930 0.626022 Ba\n0.626022 0.626022 0.121930 Ba\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"La",
"Tc"
],
"chemical_system": "Ba-La-Tc",
"density": 5.6513938724358646,
"density_atomic": 0.025972708965496232,
"volume": 231.01171340928568,
"volume_molar": 23.18641758932496,
"formula_full": "Ba4 La1 Tc1",
"formula_reduced": "Ba4LaTc",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3632583966666665,
"spacegroup": 216
},
{
"id": "jvasp-92411",
"created_at": "2022-09-04T14:35:47.662981Z",
"updated_at": "2022-09-04T14:35:47.663009Z",
"structure_string": "Zr1 Fe2 Si2\n1.0\n3.627243 0.000000 -1.312653\n-0.475032 3.596003 -1.312653\n-0.093102 -0.106210 5.410621\nZr Fe Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.749999 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.371552 0.371551 0.743104 Si\n0.628448 0.628448 0.256897 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Fe",
"Si"
],
"chemical_system": "Fe-Si-Zr",
"density": 6.1846691666832125,
"density_atomic": 0.07187785531518473,
"volume": 69.56245394461169,
"volume_molar": 8.378297785309377,
"formula_full": "Zr1 Fe2 Si2",
"formula_reduced": "Zr(FeSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.58940054,
"spacegroup": 139
},
{
"id": "jvasp-94242",
"created_at": "2022-09-04T14:35:47.654445Z",
"updated_at": "2022-09-04T14:35:47.654467Z",
"structure_string": "Ba1 Mg6 Co1\n1.0\n8.097855 -1.110347 0.000000\n-5.010516 6.457774 0.000000\n0.000000 0.000000 4.460337\nBa Mg Co\n1 6 1\ndirect\n0.275853 0.224147 0.750001 Ba\n0.210094 0.796659 0.250000 Mg\n0.703339 0.289905 0.250000 Mg\n0.681376 0.818622 0.250000 Mg\n0.317569 0.661271 0.750001 Mg\n0.838727 0.182429 0.750001 Mg\n0.870650 0.629347 0.750001 Mg\n0.102384 0.397615 0.250000 Co\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Co"
],
"chemical_system": "Ba-Co-Mg",
"density": 2.7253338357474144,
"density_atomic": 0.038381325679406636,
"volume": 208.43469730104638,
"volume_molar": 15.690288580186166,
"formula_full": "Ba1 Mg6 Co1",
"formula_reduced": "BaMg6Co",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-74651",
"created_at": "2022-09-04T14:35:47.653155Z",
"updated_at": "2022-09-04T14:35:47.653179Z",
"structure_string": "Be2 Cd1 Ir1\n1.0\n-1.745851 1.745851 4.214240\n1.745851 -1.745851 4.214240\n1.745851 1.745851 -4.214240\nBe Cd Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Cd\n0.750000 0.250000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Ir"
],
"chemical_system": "Be-Cd-Ir",
"density": 10.427743516703,
"density_atomic": 0.07785139214224296,
"volume": 51.379941834457696,
"volume_molar": 7.735431049192922,
"formula_full": "Be2 Cd1 Ir1",
"formula_reduced": "Be2CdIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6055607624999997,
"spacegroup": 119
},
{
"id": "jvasp-86296",
"created_at": "2022-09-04T14:35:47.651148Z",
"updated_at": "2022-09-04T14:35:47.651177Z",
"structure_string": "Zr10 Sb8\n1.0\n8.849279 0.000000 -0.000000\n-4.424639 7.663700 0.000000\n-0.000000 0.000000 5.965924\nZr Sb\n10 8\ndirect\n0.281833 0.281833 0.749999 Zr\n0.666667 0.333333 0.000000 Zr\n0.333333 0.666667 0.000000 Zr\n-0.000000 0.718167 0.749999 Zr\n0.666667 0.333333 0.500000 Zr\n0.281833 0.000000 0.250000 Zr\n-0.000000 0.281833 0.250000 Zr\n0.718167 0.000000 0.749999 Zr\n0.718167 0.718167 0.250000 Zr\n0.333333 0.666667 0.500000 Zr\n-0.000000 0.387810 0.749999 Sb\n0.000000 0.000000 0.500000 Sb\n0.612190 0.612190 0.749999 Sb\n0.387810 0.000000 0.749999 Sb\n0.000000 0.000000 0.000000 Sb\n0.612190 0.000000 0.250000 Sb\n0.387810 0.387810 0.250000 Sb\n-0.000000 0.612190 0.250000 Sb\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Zr",
"Sb"
],
"chemical_system": "Sb-Zr",
"density": 7.741771821000071,
"density_atomic": 0.04448856576676065,
"volume": 404.5983431870619,
"volume_molar": 13.536378744084855,
"formula_full": "Zr10 Sb8",
"formula_reduced": "Zr5Sb4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.6088018777777777,
"spacegroup": 193
},
{
"id": "jvasp-74223",
"created_at": "2022-09-04T14:35:47.649050Z",
"updated_at": "2022-09-04T14:35:47.649084Z",
"structure_string": "Be1 Sn1 Cl2\n1.0\n-2.327284 2.327284 4.113011\n2.327284 -2.327284 4.113011\n2.327284 2.327284 -4.113011\nBe Sn Cl\n1 1 2\ndirect\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Sn\n0.000000 0.000000 0.000000 Cl\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sn",
"Cl"
],
"chemical_system": "Be-Cl-Sn",
"density": 3.7014452954602195,
"density_atomic": 0.04488914789021106,
"volume": 89.10839675066046,
"volume_molar": 13.415582703260098,
"formula_full": "Be1 Sn1 Cl2",
"formula_reduced": "BeSnCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.62785148375,
"spacegroup": 139
},
{
"id": "jvasp-91783",
"created_at": "2022-09-04T14:35:47.648220Z",
"updated_at": "2022-09-04T14:35:47.648234Z",
"structure_string": "Th2 Al6\n1.0\n6.556572 -0.000000 -0.000000\n-3.278286 5.678158 0.000000\n-0.000000 -0.000000 4.642485\nTh Al\n2 6\ndirect\n0.333333 0.666667 0.250000 Th\n0.666667 0.333333 0.750001 Th\n0.859423 0.718848 0.250000 Al\n0.140576 0.859424 0.750001 Al\n0.718847 0.859424 0.750001 Al\n0.281152 0.140576 0.250000 Al\n0.859423 0.140576 0.250000 Al\n0.140576 0.281153 0.750001 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Th",
"Al"
],
"chemical_system": "Al-Th",
"density": 6.014015947376784,
"density_atomic": 0.046286588211862496,
"volume": 172.83624283091427,
"volume_molar": 13.010552284466332,
"formula_full": "Th2 Al6",
"formula_reduced": "ThAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0023885000000003,
"spacegroup": 194
},
{
"id": "jvasp-42552",
"created_at": "2022-09-04T14:35:47.643827Z",
"updated_at": "2022-09-04T14:35:47.643860Z",
"structure_string": "Mn6 O7 F5\n1.0\n4.530531 -0.015064 0.015042\n0.074127 5.506425 0.001196\n0.102275 0.389827 7.566477\nMn O F\n6 7 5\ndirect\n0.462596 0.480437 0.986322 Mn\n0.518393 0.160373 0.333159 Mn\n0.522613 0.819830 0.663697 Mn\n0.990923 0.678583 0.323128 Mn\n0.960291 0.347356 0.673877 Mn\n0.012727 0.009670 0.019126 Mn\n0.206188 0.709724 0.104360 O\n0.304284 0.199048 0.115076 O\n0.302369 0.538380 0.759207 O\n0.803680 0.285711 0.904843 O\n0.807625 0.970986 0.230947 O\n0.792305 0.631475 0.544070 O\n0.692257 0.123384 0.564876 O\n0.202691 0.373079 0.429362 F\n0.727742 0.794940 0.912532 F\n0.700609 0.480722 0.216774 F\n0.273945 0.872271 0.436260 F\n0.218773 0.024036 0.782388 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.720675507168094,
"density_atomic": 0.09535947886827774,
"volume": 188.75942081084375,
"volume_molar": 6.315198899438747,
"formula_full": "Mn6 O7 F5",
"formula_reduced": "Mn6O7F5",
"formula_anonymous": "A5B6C7",
"energy_above_hull": 2.789069964487547,
"spacegroup": 1
},
{
"id": "jvasp-68966",
"created_at": "2022-09-04T14:35:47.641899Z",
"updated_at": "2022-09-04T14:35:47.641928Z",
"structure_string": "Ba1 Li1 Pd2\n1.0\n4.524716 0.000000 0.000000\n0.000000 4.524716 -0.000000\n0.000000 -0.000000 4.236174\nBa Li Pd\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Ba\n0.000000 0.000000 0.499999 Li\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Pd"
],
"chemical_system": "Ba-Li-Pd",
"density": 6.83741965281899,
"density_atomic": 0.04612151349025594,
"volume": 86.72742278600803,
"volume_molar": 13.057118694234292,
"formula_full": "Ba1 Li1 Pd2",
"formula_reduced": "BaLiPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8648943425000001,
"spacegroup": 123
}
]
}