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=-formula_anonymous&page=604",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=602",
"results": [
{
"id": "jvasp-11167",
"created_at": "2022-09-04T14:37:20.104402Z",
"updated_at": "2022-09-04T14:37:20.104428Z",
"structure_string": "Ti2 Zn2 O6\n1.0\n4.532498 -0.004463 3.153947\n1.645341 4.223318 3.153947\n-0.006535 -0.004463 5.521855\nTi Zn O\n2 2 6\ndirect\n0.145947 0.145947 0.145947 Ti\n0.854053 0.854054 0.854053 Ti\n0.361595 0.361596 0.361595 Zn\n0.638405 0.638406 0.638405 Zn\n0.775304 0.437062 0.050803 O\n0.437062 0.050804 0.775304 O\n0.050803 0.775305 0.437061 O\n0.224696 0.562940 0.949197 O\n0.949198 0.224697 0.562939 O\n0.562939 0.949198 0.224696 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"O"
],
"chemical_system": "O-Ti-Zn",
"density": 5.05913801859281,
"density_atomic": 0.0944566498632828,
"volume": 105.86867112558056,
"volume_molar": 6.375560395923939,
"formula_full": "Ti2 Zn2 O6",
"formula_reduced": "TiZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.5022398466666664,
"spacegroup": 148
},
{
"id": "jvasp-40996",
"created_at": "2022-09-04T14:37:32.988813Z",
"updated_at": "2022-09-04T14:37:32.988838Z",
"structure_string": "Ac1 Fe1 O3\n1.0\n3.930235 -0.000000 0.000000\n0.000000 3.930235 -0.000000\n0.000000 0.000000 3.930235\nAc Fe O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.499999 0.499999 0.499999 Fe\n0.499999 0.499999 0.000000 O\n0.000000 0.499999 0.499999 O\n0.499999 0.000000 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ac",
"Fe",
"O"
],
"chemical_system": "Ac-Fe-O",
"density": 9.049315994169064,
"density_atomic": 0.08235964154233515,
"volume": 60.70934630561573,
"volume_molar": 7.312004578000078,
"formula_full": "Ac1 Fe1 O3",
"formula_reduced": "AcFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8989092,
"spacegroup": 221
},
{
"id": "jvasp-36624",
"created_at": "2022-09-04T14:37:29.860262Z",
"updated_at": "2022-09-04T14:37:29.860272Z",
"structure_string": "Ca1 Os1 O3\n1.0\n3.942119 -0.000000 -0.000000\n-0.000000 3.942119 -0.000000\n0.000000 -0.000000 3.942119\nCa Os O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Os\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Os",
"O"
],
"chemical_system": "Ca-O-Os",
"density": 7.543671855561509,
"density_atomic": 0.08161703508067931,
"volume": 61.26172060841767,
"volume_molar": 7.3785340940736805,
"formula_full": "Ca1 Os1 O3",
"formula_reduced": "CaOsO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.361831184,
"spacegroup": 221
},
{
"id": "jvasp-35819",
"created_at": "2022-09-04T14:37:31.252045Z",
"updated_at": "2022-09-04T14:37:31.252074Z",
"structure_string": "Tm3 Al1 N1\n1.0\n4.671399 0.000000 -0.000000\n0.000000 4.671399 0.000000\n-0.000000 0.000000 4.671399\nTm Al N\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Tm\n0.500000 0.000000 0.500000 Tm\n0.000000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tm",
"Al",
"N"
],
"chemical_system": "Al-N-Tm",
"density": 8.923248664807227,
"density_atomic": 0.0490488821508274,
"volume": 101.93912237642414,
"volume_molar": 12.277834878033836,
"formula_full": "Tm3 Al1 N1",
"formula_reduced": "Tm3AlN",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.10980976,
"spacegroup": 221
},
{
"id": "jvasp-36623",
"created_at": "2022-09-04T14:37:30.279662Z",
"updated_at": "2022-09-04T14:37:30.279679Z",
"structure_string": "Mg1 V1 O3\n1.0\n3.750238 0.000000 -0.000000\n0.000000 3.750238 -0.000000\n0.000000 0.000000 3.750238\nMg V O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 V\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 3.8800816011274573,
"density_atomic": 0.09479676436532626,
"volume": 52.74441626225848,
"volume_molar": 6.352685980707074,
"formula_full": "Mg1 V1 O3",
"formula_reduced": "MgVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.81378875,
"spacegroup": 221
},
{
"id": "jvasp-17949",
"created_at": "2022-09-04T14:37:33.382451Z",
"updated_at": "2022-09-04T14:37:33.382484Z",
"structure_string": "Mn3 In1 C1\n1.0\n5.024112 0.000000 0.000000\n-0.000000 5.024112 0.000000\n-0.000000 -0.000000 5.024112\nMn In C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"In",
"C"
],
"chemical_system": "C-In-Mn",
"density": 3.818760939499805,
"density_atomic": 0.039426848793327945,
"volume": 126.81713484660055,
"volume_molar": 15.27421273652259,
"formula_full": "Mn3 In1 C1",
"formula_reduced": "Mn3InC",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.374182338827586,
"spacegroup": 221
},
{
"id": "jvasp-36599",
"created_at": "2022-09-04T14:37:20.014214Z",
"updated_at": "2022-09-04T14:37:20.014242Z",
"structure_string": "Ti1 Hg1 O3\n1.0\n3.910085 -0.000000 0.000000\n0.000000 3.910085 -0.000000\n-0.000000 0.000000 3.910085\nTi Hg O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Hg\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ti",
"Hg",
"O"
],
"chemical_system": "Hg-O-Ti",
"density": 8.234733990443502,
"density_atomic": 0.08363949633662145,
"volume": 59.780369550249866,
"volume_molar": 7.200116002328452,
"formula_full": "Ti1 Hg1 O3",
"formula_reduced": "TiHgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.6264646866666663,
"spacegroup": 221
},
{
"id": "jvasp-57174",
"created_at": "2022-09-04T14:37:33.806856Z",
"updated_at": "2022-09-04T14:37:33.806876Z",
"structure_string": "Na4 Ni4 F12\n1.0\n5.346565 0.000000 0.000000\n0.000000 5.576620 0.000000\n0.000000 0.000000 7.686630\nNa Ni F\n4 4 12\ndirect\n0.018534 0.935800 0.750000 Na\n0.518534 0.564200 0.250000 Na\n0.481467 0.435800 0.750000 Na\n0.981467 0.064200 0.250000 Na\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.610476 0.038486 0.750000 F\n0.110475 0.461514 0.250000 F\n0.692962 0.301950 0.056907 F\n0.192962 0.198050 0.943093 F\n0.807039 0.801950 0.443093 F\n0.192962 0.198050 0.556907 F\n0.307039 0.698050 0.943093 F\n0.807039 0.801950 0.056907 F\n0.389525 0.961514 0.250000 F\n0.692962 0.301950 0.443093 F\n0.307039 0.698050 0.556907 F\n0.889525 0.538486 0.750000 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Ni",
"F"
],
"chemical_system": "F-Na-Ni",
"density": 4.019166199558492,
"density_atomic": 0.08726661212590268,
"volume": 229.1827253605913,
"volume_molar": 6.900853159409513,
"formula_full": "Na4 Ni4 F12",
"formula_reduced": "NaNiF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-21946",
"created_at": "2022-09-04T14:37:30.026236Z",
"updated_at": "2022-09-04T14:37:30.026267Z",
"structure_string": "K4 Ag4 F12\n1.0\n6.143128 0.000000 0.000000\n0.000000 6.146372 0.000000\n0.000000 0.000000 8.691436\nK Ag F\n4 4 12\ndirect\n0.000000 0.000000 0.750000 K\n0.500000 0.500000 0.250000 K\n0.500000 0.500000 0.750000 K\n0.000000 0.000000 0.250000 K\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.000000 Ag\n0.000000 0.500000 0.000000 Ag\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500000 0.750000 F\n0.500000 0.000000 0.250000 F\n0.750000 0.250000 0.500000 F\n0.750000 0.250000 0.000000 F\n0.250000 0.250000 0.000000 F\n0.750000 0.750000 0.500000 F\n0.250000 0.750000 0.500000 F\n0.250000 0.750000 0.000000 F\n0.750000 0.750000 0.000000 F\n0.250000 0.250000 0.500000 F\n0.000000 0.500000 0.250000 F\n0.500000 0.000000 0.750000 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Ag",
"F"
],
"chemical_system": "Ag-F-K",
"density": 4.128172054173637,
"density_atomic": 0.06094387336004959,
"volume": 328.17080532184485,
"volume_molar": 9.881453914853534,
"formula_full": "K4 Ag4 F12",
"formula_reduced": "KAgF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-36503",
"created_at": "2022-09-04T14:37:29.991734Z",
"updated_at": "2022-09-04T14:37:29.991762Z",
"structure_string": "Ba3 Sb1 P1\n1.0\n6.424083 0.000000 0.000000\n0.000000 6.424083 0.000000\n-0.000000 0.000000 6.424083\nBa Sb P\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"P"
],
"chemical_system": "Ba-P-Sb",
"density": 3.5370793903272424,
"density_atomic": 0.0188597778989942,
"volume": 265.1144688329894,
"volume_molar": 31.931132976497903,
"formula_full": "Ba3 Sb1 P1",
"formula_reduced": "Ba3SbP",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.759325902,
"spacegroup": 221
},
{
"id": "jvasp-36480",
"created_at": "2022-09-04T14:37:33.191446Z",
"updated_at": "2022-09-04T14:37:33.191469Z",
"structure_string": "Sr3 Bi1 As1\n1.0\n5.839592 0.000000 0.000000\n-0.000000 5.839592 0.000000\n-0.000000 -0.000000 5.839592\nSr Bi As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Bi",
"As"
],
"chemical_system": "As-Bi-Sr",
"density": 4.559318230986902,
"density_atomic": 0.025108599505932944,
"volume": 199.13496166198132,
"volume_molar": 23.9843753873131,
"formula_full": "Sr3 Bi1 As1",
"formula_reduced": "Sr3BiAs",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1370009959999999,
"spacegroup": 221
},
{
"id": "jvasp-41248",
"created_at": "2022-09-04T14:37:32.686432Z",
"updated_at": "2022-09-04T14:37:32.686462Z",
"structure_string": "Ce1 Fe1 O3\n1.0\n3.762087 -0.000000 0.000000\n0.000000 3.762087 -0.000000\n0.000000 0.000000 3.762087\nCe Fe O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Fe",
"O"
],
"chemical_system": "Ce-Fe-O",
"density": 7.608162749769925,
"density_atomic": 0.09390387208175931,
"volume": 53.2459406535084,
"volume_molar": 6.413090990280679,
"formula_full": "Ce1 Fe1 O3",
"formula_reduced": "CeFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.2422343,
"spacegroup": 221
}
]
}