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=1066",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=1064",
"results": [
{
"id": "jvasp-95728",
"created_at": "2022-09-04T14:36:16.182659Z",
"updated_at": "2022-09-04T14:36:16.182691Z",
"structure_string": "Th1 Mn4 Cu3 O12\n1.0\n6.015930 -0.000036 -2.126863\n-3.008040 5.209918 -2.126987\n0.000086 -0.000004 6.380831\nTh Mn Cu O\n1 4 3 12\ndirect\n-0.000001 -0.000002 -0.000002 Th\n-0.000001 -0.000001 0.500001 Mn\n0.500001 0.000001 0.000003 Mn\n0.500002 0.500000 0.500001 Mn\n-0.000003 0.499999 -0.000003 Mn\n0.500001 0.000001 0.500000 Cu\n0.500001 0.500001 0.000000 Cu\n0.000000 0.500001 0.500001 Cu\n0.524565 0.821934 0.702632 O\n0.880700 0.178067 0.702632 O\n0.475434 0.178067 0.297367 O\n0.178051 0.702640 0.880689 O\n0.702624 0.880681 0.178058 O\n0.702622 0.524564 0.821943 O\n0.178051 0.297362 0.475410 O\n0.821950 0.702638 0.524589 O\n0.119302 0.821933 0.297369 O\n0.297377 0.119321 0.821943 O\n0.297376 0.475435 0.178057 O\n0.821952 0.297361 0.119312 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Th",
"Mn",
"Cu",
"O"
],
"chemical_system": "Cu-Mn-O-Th",
"density": 6.928241812660325,
"density_atomic": 0.10000430341396123,
"volume": 199.99139354244903,
"volume_molar": 6.021881613505916,
"formula_full": "Th1 Mn4 Cu3 O12",
"formula_reduced": "ThMn4(CuO4)3",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.9398183957758617,
"spacegroup": 204
},
{
"id": "jvasp-71060",
"created_at": "2022-09-04T14:36:16.183166Z",
"updated_at": "2022-09-04T14:36:16.183191Z",
"structure_string": "Be1 Ni2 Bi1\n1.0\n3.166283 0.000000 0.000000\n0.000000 3.166283 0.000000\n0.000000 -0.000000 5.924672\nBe Ni Bi\n1 2 1\ndirect\n0.000000 0.000000 0.388267 Be\n0.000000 0.000000 0.037398 Ni\n0.499999 0.499999 0.300864 Ni\n0.499999 0.499999 0.773472 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ni",
"Bi"
],
"chemical_system": "Be-Bi-Ni",
"density": 9.376088267191568,
"density_atomic": 0.06734358326502601,
"volume": 59.39689879967148,
"volume_molar": 8.942412131977418,
"formula_full": "Be1 Ni2 Bi1",
"formula_reduced": "BeNi2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2449138,
"spacegroup": 99
},
{
"id": "jvasp-88222",
"created_at": "2022-09-04T14:36:16.184413Z",
"updated_at": "2022-09-04T14:36:16.184437Z",
"structure_string": "Rb8 Zn4 Cl16\n1.0\n7.138152 0.000000 0.000000\n0.000000 9.295348 0.000000\n0.000000 0.000000 12.560125\nRb Zn Cl\n8 4 16\ndirect\n0.750000 0.371958 0.588301 Rb\n0.750000 0.521405 0.173124 Rb\n0.750000 0.021405 0.326876 Rb\n0.750000 0.871958 0.911700 Rb\n0.250000 0.628042 0.411700 Rb\n0.250000 0.478595 0.826876 Rb\n0.250000 0.978595 0.673124 Rb\n0.250000 0.128042 0.088301 Rb\n0.750000 0.773246 0.576856 Zn\n0.250000 0.726754 0.076856 Zn\n0.250000 0.226754 0.423145 Zn\n0.750000 0.273246 0.923145 Zn\n0.007226 0.673883 0.654046 Cl\n0.750000 0.686338 0.406193 Cl\n0.992773 0.826117 0.154045 Cl\n0.492773 0.173883 0.845955 Cl\n0.507226 0.326117 0.345955 Cl\n0.750000 0.016685 0.592919 Cl\n0.492773 0.673883 0.654046 Cl\n0.507226 0.826117 0.154045 Cl\n0.007226 0.173883 0.845955 Cl\n0.750000 0.186338 0.093807 Cl\n0.250000 0.813663 0.906193 Cl\n0.250000 0.313662 0.593808 Cl\n0.750000 0.516685 0.907082 Cl\n0.250000 0.983315 0.407081 Cl\n0.250000 0.483315 0.092919 Cl\n0.992773 0.326117 0.345955 Cl\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Rb",
"Zn",
"Cl"
],
"chemical_system": "Cl-Rb-Zn",
"density": 3.013945304013257,
"density_atomic": 0.03359793802088038,
"volume": 833.3844768270784,
"volume_molar": 17.924137952327232,
"formula_full": "Rb8 Zn4 Cl16",
"formula_reduced": "Rb2ZnCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-93431",
"created_at": "2022-09-04T14:36:16.189056Z",
"updated_at": "2022-09-04T14:36:16.189073Z",
"structure_string": "U2 Mn4\n1.0\n3.832509 0.000000 2.075163\n1.210142 4.331144 2.341664\n-0.263047 0.096787 5.062419\nU Mn\n2 4\ndirect\n0.134265 0.115734 0.615734 U\n0.865734 0.884265 0.384265 U\n0.500000 0.000000 -0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.500000 -0.000000 Mn\n-0.000000 0.500000 -0.000000 Mn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"Mn"
],
"chemical_system": "Mn-U",
"density": 13.471059807020163,
"density_atomic": 0.0699541125068241,
"volume": 85.77051133933968,
"volume_molar": 8.608701539044661,
"formula_full": "U2 Mn4",
"formula_reduced": "UMn2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.24772016091954,
"spacegroup": 74
},
{
"id": "jvasp-68616",
"created_at": "2022-09-04T14:36:16.189636Z",
"updated_at": "2022-09-04T14:36:16.189663Z",
"structure_string": "K1 Li2 Be1\n1.0\n-2.291997 2.291997 4.666883\n2.291997 -2.291997 4.666883\n2.291997 2.291997 -4.666883\nK Li Be\n1 2 1\ndirect\n0.750000 0.250000 0.500001 K\n0.000000 0.000000 0.000000 Li\n0.250000 0.750000 0.500001 Li\n0.500000 0.500000 0.000000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Li",
"Be"
],
"chemical_system": "Be-K-Li",
"density": 1.0497191688504202,
"density_atomic": 0.040789182117096284,
"volume": 98.06521710871593,
"volume_molar": 14.76406352721619,
"formula_full": "K1 Li2 Be1",
"formula_reduced": "KLi2Be",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.714063525,
"spacegroup": 119
},
{
"id": "jvasp-64643",
"created_at": "2022-09-04T14:36:16.189791Z",
"updated_at": "2022-09-04T14:36:16.189818Z",
"structure_string": "Ba4 V1 Hg1\n1.0\n-0.000000 4.942571 4.942571\n4.942571 -0.000000 4.942571\n4.942571 4.942571 -0.000000\nBa V Hg\n4 1 1\ndirect\n0.124553 0.625148 0.625148 Ba\n0.625148 0.625148 0.625148 Ba\n0.625148 0.124553 0.625148 Ba\n0.625148 0.625148 0.124553 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"V",
"Hg"
],
"chemical_system": "Ba-Hg-V",
"density": 5.506882849230678,
"density_atomic": 0.024846344625876347,
"volume": 241.48421388920409,
"volume_molar": 24.237532122645568,
"formula_full": "Ba4 V1 Hg1",
"formula_reduced": "Ba4VHg",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.48506378,
"spacegroup": 216
},
{
"id": "jvasp-14942",
"created_at": "2022-09-04T14:36:16.190563Z",
"updated_at": "2022-09-04T14:36:16.190580Z",
"structure_string": "Pr2 Rh4\n1.0\n4.701345 -0.000000 2.714323\n1.567115 4.432470 2.714323\n-0.000000 -0.000000 5.428645\nPr Rh\n2 4\ndirect\n0.125000 0.125000 0.125000 Pr\n0.875002 0.875000 0.874997 Pr\n0.500001 0.000000 0.499999 Rh\n0.000001 0.500000 0.499999 Rh\n0.500001 0.500000 0.499999 Rh\n0.500001 0.500000 -0.000001 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Rh"
],
"chemical_system": "Pr-Rh",
"density": 10.178808095613336,
"density_atomic": 0.05303857909748529,
"volume": 113.12520248651376,
"volume_molar": 11.354264881288131,
"formula_full": "Pr2 Rh4",
"formula_reduced": "PrRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.98978195,
"spacegroup": 227
},
{
"id": "jvasp-67720",
"created_at": "2022-09-04T14:36:16.196513Z",
"updated_at": "2022-09-04T14:36:16.196538Z",
"structure_string": "Be1 Cd1 Te1\n1.0\n-1.811525 1.811525 5.989227\n1.811525 -1.811525 5.989227\n1.811525 1.811525 -5.989227\nBe Cd Te\n1 1 1\ndirect\n0.115221 0.115221 0.000000 Be\n0.318948 0.318948 0.000000 Cd\n0.565832 0.565832 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Te"
],
"chemical_system": "Be-Cd-Te",
"density": 5.259802616388079,
"density_atomic": 0.03815942533814173,
"volume": 78.61753612419817,
"volume_molar": 15.78152895814354,
"formula_full": "Be1 Cd1 Te1",
"formula_reduced": "BeCdTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7330301333333333,
"spacegroup": 107
},
{
"id": "jvasp-65630",
"created_at": "2022-09-04T14:36:16.197886Z",
"updated_at": "2022-09-04T14:36:16.197913Z",
"structure_string": "Ba1 Sr1 Cd2\n1.0\n4.245541 0.000000 -0.000000\n0.000000 4.245541 0.000000\n-0.000000 0.000000 8.319920\nBa Sr Cd\n1 1 2\ndirect\n0.500000 0.500000 0.810914 Ba\n0.000000 0.000000 0.426321 Sr\n0.000000 0.000000 0.029884 Cd\n0.500000 0.500000 0.232883 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Cd"
],
"chemical_system": "Ba-Cd-Sr",
"density": 4.980275722193693,
"density_atomic": 0.026673177949592477,
"volume": 149.96338297443532,
"volume_molar": 22.577515027945925,
"formula_full": "Ba1 Sr1 Cd2",
"formula_reduced": "BaSrCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-70845",
"created_at": "2022-09-04T14:36:16.200670Z",
"updated_at": "2022-09-04T14:36:16.200700Z",
"structure_string": "Be1 V2 Fe1\n1.0\n2.796023 -0.000000 0.000000\n0.000000 2.796023 -0.000000\n-0.000000 0.000000 5.806771\nBe V Fe\n1 2 1\ndirect\n0.000000 0.000000 0.530834 Be\n0.000000 0.000000 0.968001 V\n0.499999 0.499999 0.266455 V\n0.499999 0.499999 0.734709 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Fe"
],
"chemical_system": "Be-Fe-V",
"density": 6.099204433107757,
"density_atomic": 0.08811377603722206,
"volume": 45.39585272466672,
"volume_molar": 6.834505375704312,
"formula_full": "Be1 V2 Fe1",
"formula_reduced": "BeV2Fe",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4680675,
"spacegroup": 99
},
{
"id": "jvasp-65090",
"created_at": "2022-09-04T14:36:16.213438Z",
"updated_at": "2022-09-04T14:36:16.213467Z",
"structure_string": "Li4 Be1 W1\n1.0\n-0.000000 3.389692 3.389692\n3.389692 -0.000000 3.389692\n3.389692 3.389692 -0.000000\nLi Be W\n4 1 1\ndirect\n0.124480 0.625173 0.625173 Li\n0.625173 0.625173 0.625173 Li\n0.625173 0.124480 0.625173 Li\n0.625173 0.625173 0.124480 Li\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Be",
"W"
],
"chemical_system": "Be-Li-W",
"density": 4.703008363066716,
"density_atomic": 0.07702656653073388,
"volume": 77.89520252867533,
"volume_molar": 7.818264569273179,
"formula_full": "Li4 Be1 W1",
"formula_reduced": "Li4BeW",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4320326833333343,
"spacegroup": 216
},
{
"id": "jvasp-70265",
"created_at": "2022-09-04T14:36:16.218235Z",
"updated_at": "2022-09-04T14:36:16.218253Z",
"structure_string": "Be2 Fe1 Ir1\n1.0\n3.839770 0.000000 0.000000\n-0.000000 3.839770 -0.000000\n-0.000000 -0.000000 2.795518\nBe Fe Ir\n2 1 1\ndirect\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Ir"
],
"chemical_system": "Be-Fe-Ir",
"density": 10.720104063555127,
"density_atomic": 0.09704815336555438,
"volume": 41.21665236568771,
"volume_molar": 6.205312055053959,
"formula_full": "Be2 Fe1 Ir1",
"formula_reduced": "Be2FeIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8408347,
"spacegroup": 123
}
]
}