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_reduced&page=3547",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3545",
"results": [
{
"id": "jvasp-29601",
"created_at": "2022-09-04T14:38:17.955201Z",
"updated_at": "2022-09-04T14:38:17.955228Z",
"structure_string": "Cr6 Cl18\n1.0\n5.972620 -0.000000 -0.000000\n-2.986310 5.172440 0.000000\n0.000000 0.000000 17.352296\nCr Cl\n6 18\ndirect\n0.999836 0.000164 0.666667 Cr\n0.666506 0.333494 0.666667 Cr\n0.999836 0.999673 0.333333 Cr\n0.666506 0.333011 0.333333 Cr\n0.666989 0.333494 0.000000 Cr\n0.000327 0.000164 0.000000 Cr\n0.333164 0.018458 0.589912 Cl\n0.684803 0.666822 0.589911 Cl\n0.684803 0.017981 0.410089 Cl\n0.333658 0.315136 0.076771 Cl\n0.982019 0.666822 0.076756 Cl\n0.981478 0.666343 0.410104 Cl\n0.982019 0.315197 0.923244 Cl\n0.684864 0.018522 0.743438 Cl\n0.981542 0.666836 0.743422 Cl\n0.333164 0.314706 0.410088 Cl\n0.981542 0.314706 0.256578 Cl\n0.333178 0.315197 0.743423 Cl\n0.333178 0.017981 0.256577 Cl\n0.685294 0.018458 0.076755 Cl\n0.981478 0.315136 0.589896 Cl\n0.685294 0.666836 0.923245 Cl\n0.684864 0.666343 0.256562 Cl\n0.333658 0.018522 0.923229 Cl\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 2.943168383696843,
"density_atomic": 0.04477070657813781,
"volume": 536.0648029557691,
"volume_molar": 13.45107374950544,
"formula_full": "Cr6 Cl18",
"formula_reduced": "CrCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.981834900625,
"spacegroup": 162
},
{
"id": "jvasp-8556",
"created_at": "2022-09-04T14:36:51.442564Z",
"updated_at": "2022-09-04T14:36:51.442584Z",
"structure_string": "Cr2 Cl4\n1.0\n3.592068 0.000000 0.000000\n0.000000 5.808808 0.000000\n0.000000 -0.000000 6.191867\nCr Cl\n2 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.500000 0.777024 0.164340 Cl\n0.500000 0.222976 0.835660 Cl\n0.000000 0.722976 0.664341 Cl\n0.000000 0.277024 0.335660 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 3.1592588165598734,
"density_atomic": 0.04644062541771715,
"volume": 129.19722648073972,
"volume_molar": 12.967398061143566,
"formula_full": "Cr2 Cl4",
"formula_reduced": "CrCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1580351783333338,
"spacegroup": 58
},
{
"id": "jvasp-93450",
"created_at": "2022-09-04T14:35:48.764311Z",
"updated_at": "2022-09-04T14:35:48.764333Z",
"structure_string": "Cr2 Cl4\n1.0\n0.000000 0.000000 -3.592874\n0.000000 -5.808651 0.000000\n-6.190166 -0.000000 0.000000\nCr Cl\n2 4\ndirect\n0.499999 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.499999 0.777155 0.164531 Cl\n0.499999 0.222845 0.835469 Cl\n0.000000 0.722845 0.664532 Cl\n0.000000 0.277155 0.335469 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 3.1595034257030714,
"density_atomic": 0.046444221135020676,
"volume": 129.18722401560044,
"volume_molar": 12.966394123593306,
"formula_full": "Cr2 Cl4",
"formula_reduced": "CrCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1580518450000004,
"spacegroup": 58
},
{
"id": "jvasp-35733",
"created_at": "2022-09-04T14:37:35.610844Z",
"updated_at": "2022-09-04T14:37:35.610862Z",
"structure_string": "Cr1 Cd1 Te2\n1.0\n4.542143 0.000000 0.000000\n0.000000 4.542143 0.000000\n0.000000 0.000000 6.357962\nCr Cd Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cd\n0.500000 0.000000 0.771547 Te\n0.000000 0.500000 0.228452 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"Te"
],
"chemical_system": "Cd-Cr-Te",
"density": 5.3119305921091655,
"density_atomic": 0.030494425612994938,
"volume": 131.17151477991553,
"volume_molar": 19.748333142676795,
"formula_full": "Cr1 Cd1 Te2",
"formula_reduced": "CrCdTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1580056708333333,
"spacegroup": 115
},
{
"id": "jvasp-11664",
"created_at": "2022-09-04T14:37:32.201238Z",
"updated_at": "2022-09-04T14:37:32.201269Z",
"structure_string": "Cr2 Cd2 O8\n1.0\n5.221120 0.035515 -0.000000\n-2.080981 4.788619 0.000000\n0.000000 0.000000 6.984171\nCr Cd O\n2 2 8\ndirect\n0.635466 0.364535 0.250000 Cr\n0.364535 0.635466 0.750000 Cr\n0.000000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.717540 0.766808 0.750000 O\n0.282461 0.233194 0.250000 O\n0.766807 0.717540 0.250000 O\n0.233193 0.282461 0.750000 O\n0.258172 0.741829 0.942935 O\n0.741829 0.258172 0.442935 O\n0.741829 0.258172 0.057065 O\n0.258172 0.741829 0.557065 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"O"
],
"chemical_system": "Cd-Cr-O",
"density": 4.331251683343286,
"density_atomic": 0.06851892446983993,
"volume": 175.13409751903004,
"volume_molar": 8.78901822612638,
"formula_full": "Cr2 Cd2 O8",
"formula_reduced": "CrCdO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0321168583333327,
"spacegroup": 63
},
{
"id": "jvasp-22612",
"created_at": "2022-09-04T14:37:03.391073Z",
"updated_at": "2022-09-04T14:37:03.391094Z",
"structure_string": "Cr1 Cd1 F6\n1.0\n4.546499 0.036592 3.230519\n1.687245 4.221990 3.230518\n0.053565 0.036594 5.577099\nCr Cd F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.499999 0.500001 Cd\n0.377227 0.062052 0.785716 F\n0.062053 0.785715 0.377227 F\n0.214285 0.622773 0.937948 F\n0.937948 0.214283 0.622775 F\n0.622774 0.937947 0.214286 F\n0.785715 0.377225 0.062053 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"F"
],
"chemical_system": "Cd-Cr-F",
"density": 4.375783969041798,
"density_atomic": 0.07572362593388435,
"volume": 105.64734455511868,
"volume_molar": 7.952789747889303,
"formula_full": "Cr1 Cd1 F6",
"formula_reduced": "CrCdF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.01318875,
"spacegroup": 148
},
{
"id": "jvasp-91975",
"created_at": "2022-09-04T14:35:49.973045Z",
"updated_at": "2022-09-04T14:35:49.973068Z",
"structure_string": "Cr1 Cd1 F6\n1.0\n4.550405 0.035196 3.230747\n1.687364 4.226136 3.230746\n0.051521 0.035198 5.580435\nCr Cd F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500001 0.500001 Cd\n0.377163 0.062974 0.785279 F\n0.062972 0.785280 0.377164 F\n0.214720 0.622838 0.937028 F\n0.937027 0.214723 0.622837 F\n0.622836 0.937029 0.214722 F\n0.785279 0.377164 0.062973 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"F"
],
"chemical_system": "Cd-Cr-F",
"density": 4.362843180601914,
"density_atomic": 0.07549968356606085,
"volume": 105.96070900085489,
"volume_molar": 7.976378807906838,
"formula_full": "Cr1 Cd1 F6",
"formula_reduced": "CrCdF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-24254",
"created_at": "2022-09-04T14:37:48.600842Z",
"updated_at": "2022-09-04T14:37:48.600863Z",
"structure_string": "Cr1 Cd1 F6\n1.0\n4.546499 0.036592 3.230519\n1.687245 4.221990 3.230518\n0.053565 0.036594 5.577099\nCr Cd F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.499999 0.500001 Cd\n0.377227 0.062052 0.785716 F\n0.062053 0.785715 0.377227 F\n0.214285 0.622773 0.937948 F\n0.937948 0.214283 0.622775 F\n0.622774 0.937947 0.214286 F\n0.785715 0.377225 0.062053 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"F"
],
"chemical_system": "Cd-Cr-F",
"density": 4.375783969041798,
"density_atomic": 0.07572362593388435,
"volume": 105.64734455511868,
"volume_molar": 7.952789747889303,
"formula_full": "Cr1 Cd1 F6",
"formula_reduced": "CrCdF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.01318875,
"spacegroup": 148
},
{
"id": "jvasp-104832",
"created_at": "2022-09-04T14:36:58.819161Z",
"updated_at": "2022-09-04T14:36:58.819177Z",
"structure_string": "Cr1 Cd1 Cu3 Se4\n1.0\n5.832145 -0.000000 0.000000\n0.000000 5.832145 0.000000\n0.000000 -0.000000 5.832145\nCr Cd Cu Se\n1 1 3 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.237465 0.237465 0.237465 Se\n0.762536 0.762536 0.237465 Se\n0.237465 0.762536 0.762536 Se\n0.762536 0.237465 0.762536 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Cr",
"Cd",
"Cu",
"Se"
],
"chemical_system": "Cd-Cr-Cu-Se",
"density": 5.615808697162921,
"density_atomic": 0.045368829059567815,
"volume": 198.3740860532964,
"volume_molar": 13.27374077054782,
"formula_full": "Cr1 Cd1 Cu3 Se4",
"formula_reduced": "CrCdCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.920685774074074,
"spacegroup": 215
},
{
"id": "jvasp-91535",
"created_at": "2022-09-04T14:36:06.182666Z",
"updated_at": "2022-09-04T14:36:06.182690Z",
"structure_string": "Cr1 Cd3 Te4\n1.0\n6.494055 -0.000000 -0.000000\n0.000000 6.494055 0.000000\n0.000000 -0.000000 6.494055\nCr Cd Te\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cd\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.759663 0.759663 0.240338 Te\n0.759663 0.240338 0.759663 Te\n0.240338 0.759663 0.759663 Te\n0.240338 0.240338 0.240338 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"Te"
],
"chemical_system": "Cd-Cr-Te",
"density": 5.454622568251481,
"density_atomic": 0.029210709088921084,
"volume": 273.87216022887327,
"volume_molar": 20.616208739294354,
"formula_full": "Cr1 Cd3 Te4",
"formula_reduced": "CrCd3Te4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.3711959645833334,
"spacegroup": 215
},
{
"id": "jvasp-14794",
"created_at": "2022-09-04T14:36:02.325539Z",
"updated_at": "2022-09-04T14:36:02.325564Z",
"structure_string": "Cr1 C1\n1.0\n2.511190 0.000000 1.449836\n0.837063 2.367573 1.449836\n-0.000000 -0.000000 2.899672\nCr C\n1 1\ndirect\n0.499999 0.499999 0.500001 Cr\n0.000000 0.000000 0.000000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cr",
"C"
],
"chemical_system": "C-Cr",
"density": 6.165146286864192,
"density_atomic": 0.11601073247941761,
"volume": 17.239784261812467,
"volume_molar": 5.191020374833369,
"formula_full": "Cr1 C1",
"formula_reduced": "CrC",
"formula_anonymous": "AB",
"energy_above_hull": 3.6492337,
"spacegroup": 225
},
{
"id": "jvasp-35703",
"created_at": "2022-09-04T14:37:28.747814Z",
"updated_at": "2022-09-04T14:37:28.747836Z",
"structure_string": "Cr1 C1\n1.0\n1.354410 -2.345906 0.000000\n1.354410 2.345906 0.000000\n0.000000 -0.000000 2.621233\nCr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Cr\n0.333333 0.666667 0.499999 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cr",
"C"
],
"chemical_system": "C-Cr",
"density": 6.3808543661822865,
"density_atomic": 0.12006975251220076,
"volume": 16.656984445743504,
"volume_molar": 5.015535248469898,
"formula_full": "Cr1 C1",
"formula_reduced": "CrC",
"formula_anonymous": "AB",
"energy_above_hull": 3.5655037000000007,
"spacegroup": 187
}
]
}