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=3424",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=3422",
"results": [
{
"id": "jvasp-106597",
"created_at": "2022-09-04T14:36:59.259399Z",
"updated_at": "2022-09-04T14:36:59.259416Z",
"structure_string": "Sc2 Pt1 Rh1\n1.0\n3.990119 -0.000000 2.303696\n1.330040 3.761921 2.303696\n-0.000000 -0.000000 4.607393\nSc Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.750001 Sc\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh-Sc",
"density": 9.313642891357896,
"density_atomic": 0.05783746022946132,
"volume": 69.15933002816183,
"volume_molar": 10.412180507422132,
"formula_full": "Sc2 Pt1 Rh1",
"formula_reduced": "Sc2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.381906225,
"spacegroup": 225
},
{
"id": "jvasp-81678",
"created_at": "2022-09-04T14:37:08.618065Z",
"updated_at": "2022-09-04T14:37:08.618089Z",
"structure_string": "Sc2 Pt1 Rh1\n1.0\n-10.766869 3.063143 -1.214170\n-7.755480 0.847215 1.487160\n-6.432975 4.587829 -0.803489\nSc Pt Rh\n2 1 1\ndirect\n0.750108 -0.000034 -0.000035 Sc\n0.249893 0.000034 0.000034 Sc\n0.500001 -0.000000 -0.000001 Pt\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh-Sc",
"density": 9.337691739029998,
"density_atomic": 0.057986802896667314,
"volume": 68.98121296888904,
"volume_molar": 10.385364357354684,
"formula_full": "Sc2 Pt1 Rh1",
"formula_reduced": "Sc2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.387301225,
"spacegroup": 225
},
{
"id": "jvasp-39110",
"created_at": "2022-09-04T14:37:52.344214Z",
"updated_at": "2022-09-04T14:37:52.344233Z",
"structure_string": "Sc2 Ru1 Au1\n1.0\n0.000008 3.290074 3.290097\n3.290082 0.000007 3.290099\n3.290080 3.290074 0.000009\nSc Ru Au\n2 1 1\ndirect\n-0.000000 0.000001 0.999998 Sc\n0.500000 0.500000 0.499999 Sc\n0.749998 0.750000 0.749999 Ru\n0.250000 0.249999 0.249999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"Au"
],
"chemical_system": "Au-Ru-Sc",
"density": 9.044270699451069,
"density_atomic": 0.05615785215273232,
"volume": 71.22779534233634,
"volume_molar": 10.723595239400545,
"formula_full": "Sc2 Ru1 Au1",
"formula_reduced": "Sc2RuAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3467671425,
"spacegroup": 225
},
{
"id": "jvasp-41879",
"created_at": "2022-09-04T14:37:34.795523Z",
"updated_at": "2022-09-04T14:37:34.795551Z",
"structure_string": "Sc2 Ru1 Pt1\n1.0\n-0.000000 3.235903 3.235903\n3.235903 0.000000 3.235903\n3.235903 3.235903 0.000000\nSc Ru Pt\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.499999 0.499999 0.499999 Sc\n0.749999 0.749999 0.749999 Ru\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"Pt"
],
"chemical_system": "Pt-Ru-Sc",
"density": 9.460061849317523,
"density_atomic": 0.05902602150516548,
"volume": 67.76672216761132,
"volume_molar": 10.202518493429192,
"formula_full": "Sc2 Ru1 Pt1",
"formula_reduced": "Sc2RuPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8235056000000003,
"spacegroup": 225
},
{
"id": "jvasp-41880",
"created_at": "2022-09-04T14:37:31.962146Z",
"updated_at": "2022-09-04T14:37:31.962157Z",
"structure_string": "Sc2 Ru1 Rh1\n1.0\n0.000000 3.206031 3.206031\n3.206031 0.000000 3.206031\n3.206031 3.206031 -0.000000\nSc Ru Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.750000 0.750000 0.750000 Ru\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"Rh"
],
"chemical_system": "Rh-Ru-Sc",
"density": 7.404518186652716,
"density_atomic": 0.06069135638584035,
"volume": 65.90724343958185,
"volume_molar": 9.922567427418711,
"formula_full": "Sc2 Ru1 Rh1",
"formula_reduced": "Sc2RuRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9289210000000008,
"spacegroup": 225
},
{
"id": "jvasp-22684",
"created_at": "2022-09-04T14:38:17.713389Z",
"updated_at": "2022-09-04T14:38:17.713412Z",
"structure_string": "Sc4 S6\n1.0\n3.132831 0.000081 5.515837\n-0.026612 5.521603 18.218359\n-0.017677 0.000208 12.145654\nSc S\n4 6\ndirect\n0.001796 0.003225 0.995174 Sc\n0.001795 0.333586 0.999608 Sc\n0.001777 0.668411 0.997365 Sc\n0.501807 0.668403 0.497384 Sc\n0.260663 0.994623 0.256923 S\n0.260614 0.342195 0.235594 S\n0.237342 0.668434 0.256553 S\n0.742990 0.342215 0.737770 S\n0.766234 0.668378 0.738228 S\n0.743034 0.994596 0.759176 S\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sc",
"S"
],
"chemical_system": "S-Sc",
"density": 2.9344818605135345,
"density_atomic": 0.04747774006337944,
"volume": 210.62502104461385,
"volume_molar": 12.684135243086269,
"formula_full": "Sc4 S6",
"formula_reduced": "Sc2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.9039481,
"spacegroup": 12
},
{
"id": "jvasp-19089",
"created_at": "2022-09-04T14:37:03.114734Z",
"updated_at": "2022-09-04T14:37:03.114769Z",
"structure_string": "Sc8 S12\n1.0\n6.261234 0.006332 -1.173503\n-2.350894 5.803136 -1.173503\n0.001975 0.002933 11.631551\nSc S\n8 12\ndirect\n0.127254 0.377254 0.754508 Sc\n0.872746 0.622746 0.245492 Sc\n0.377254 0.127254 0.254508 Sc\n0.791315 0.041316 0.082631 Sc\n0.958683 0.208684 0.417369 Sc\n0.208684 0.958684 0.917369 Sc\n0.041316 0.791316 0.582631 Sc\n0.622746 0.872746 0.745492 Sc\n0.540354 0.283626 0.087702 S\n0.195925 0.952653 0.412298 S\n0.882500 0.632501 0.750000 S\n0.459645 0.716374 0.912298 S\n0.804074 0.047347 0.587702 S\n0.283625 0.540354 0.587702 S\n0.952651 0.195924 0.912298 S\n0.632501 0.882501 0.250000 S\n0.117499 0.367499 0.250000 S\n0.367498 0.117498 0.750000 S\n0.047348 0.804076 0.087702 S\n0.716374 0.459646 0.412298 S\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Sc",
"S"
],
"chemical_system": "S-Sc",
"density": 2.9234046957233164,
"density_atomic": 0.047298519752759706,
"volume": 422.8462138888198,
"volume_molar": 12.7321970993577,
"formula_full": "Sc8 S12",
"formula_reduced": "Sc2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.9033861,
"spacegroup": 70
},
{
"id": "jvasp-15773",
"created_at": "2022-09-04T14:36:57.718454Z",
"updated_at": "2022-09-04T14:36:57.718478Z",
"structure_string": "Sc4 Sb2\n1.0\n4.206704 0.000000 -0.000000\n0.000000 4.206704 0.000000\n0.000000 0.000000 7.829249\nSc Sb\n4 2\ndirect\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.343192 Sc\n0.500000 0.000000 0.656808 Sc\n0.000000 0.500000 0.718888 Sb\n0.500000 0.000000 0.281112 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sc",
"Sb"
],
"chemical_system": "Sb-Sc",
"density": 5.07385592363176,
"density_atomic": 0.04330591667972245,
"volume": 138.54919743124702,
"volume_molar": 13.906046151933333,
"formula_full": "Sc4 Sb2",
"formula_reduced": "Sc2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7495355333333331,
"spacegroup": 129
},
{
"id": "jvasp-100643",
"created_at": "2022-09-04T14:36:36.531491Z",
"updated_at": "2022-09-04T14:36:36.531512Z",
"structure_string": "Sc2 Se3\n1.0\n4.932911 -0.013043 -4.604051\n-0.477109 3.621230 -5.673635\n0.011480 0.013043 6.747650\nSc Se\n2 3\ndirect\n0.662190 0.162190 0.500000 Sc\n0.337810 0.837810 0.499999 Sc\n0.500000 0.500000 0.000000 Se\n0.176829 0.176830 0.000000 Se\n0.823170 0.823171 0.000000 Se\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sc",
"Se"
],
"chemical_system": "Sc-Se",
"density": 4.481804040706657,
"density_atomic": 0.04129548663555219,
"volume": 121.07860706732515,
"volume_molar": 14.583048295683257,
"formula_full": "Sc2 Se3",
"formula_reduced": "Sc2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.6448941200000002,
"spacegroup": 71
},
{
"id": "jvasp-96481",
"created_at": "2022-09-04T14:36:01.853395Z",
"updated_at": "2022-09-04T14:36:01.853415Z",
"structure_string": "Sc4 Se6 O18\n1.0\n8.095862 -0.000000 -0.000000\n-4.047931 7.011222 0.000000\n-0.000000 -0.000000 7.702280\nSc Se O\n4 6 18\ndirect\n0.333333 0.666667 0.454534 Sc\n0.666667 0.333333 0.954534 Sc\n0.666667 0.333333 0.545466 Sc\n0.333333 0.666667 0.045466 Sc\n0.705098 0.967054 0.750000 Se\n0.967054 0.261956 0.250000 Se\n0.032946 0.738044 0.750000 Se\n0.294902 0.032946 0.250000 Se\n0.261956 0.294902 0.750000 Se\n0.738044 0.705098 0.250000 Se\n0.236213 0.411903 0.577220 O\n0.411903 0.175690 0.077220 O\n0.877368 0.490451 0.750000 O\n0.386919 0.877368 0.250000 O\n0.411903 0.175690 0.422780 O\n0.613081 0.122631 0.750000 O\n0.122631 0.509549 0.250000 O\n0.175690 0.763787 0.577220 O\n0.824309 0.236213 0.077220 O\n0.763787 0.588097 0.077220 O\n0.588097 0.824309 0.577220 O\n0.588097 0.824309 0.922780 O\n0.763787 0.588097 0.422780 O\n0.824309 0.236213 0.422780 O\n0.175690 0.763787 0.922780 O\n0.236213 0.411903 0.922780 O\n0.509549 0.386919 0.750000 O\n0.490451 0.613081 0.250000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sc",
"Se",
"O"
],
"chemical_system": "O-Sc-Se",
"density": 3.576242055621781,
"density_atomic": 0.06404451093840421,
"volume": 437.1959374774433,
"volume_molar": 9.403055268533297,
"formula_full": "Sc4 Se6 O18",
"formula_reduced": "Sc2(SeO3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 2.6071630071428573,
"spacegroup": 176
},
{
"id": "jvasp-97834",
"created_at": "2022-09-04T14:35:48.298928Z",
"updated_at": "2022-09-04T14:35:48.298946Z",
"structure_string": "Sc4 Se6 O18\n1.0\n8.066422 0.000000 -0.000000\n-4.033211 6.985726 0.000000\n0.000000 0.000000 7.692224\nSc Se O\n4 6 18\ndirect\n0.333334 0.666667 0.454688 Sc\n0.666667 0.333333 0.954688 Sc\n0.666667 0.333333 0.545311 Sc\n0.333334 0.666667 0.045312 Sc\n0.706142 0.967026 0.750000 Se\n0.967026 0.260884 0.250000 Se\n0.032975 0.739117 0.750000 Se\n0.293858 0.032974 0.250000 Se\n0.260884 0.293858 0.750000 Se\n0.739116 0.706142 0.250000 Se\n0.232589 0.410140 0.576484 O\n0.410140 0.177551 0.076484 O\n0.878435 0.489422 0.750000 O\n0.389013 0.878436 0.250000 O\n0.410140 0.177551 0.423516 O\n0.610987 0.121565 0.750000 O\n0.121565 0.510578 0.250000 O\n0.177552 0.767411 0.576484 O\n0.822449 0.232589 0.076484 O\n0.767411 0.589860 0.076484 O\n0.589860 0.822449 0.576484 O\n0.589860 0.822449 0.923515 O\n0.767411 0.589860 0.423516 O\n0.822449 0.232589 0.423516 O\n0.177552 0.767411 0.923515 O\n0.232589 0.410140 0.923515 O\n0.510578 0.389013 0.750000 O\n0.489422 0.610987 0.250000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sc",
"Se",
"O"
],
"chemical_system": "O-Sc-Se",
"density": 3.6071035942167784,
"density_atomic": 0.06459718945271682,
"volume": 433.45539081843725,
"volume_molar": 9.322604916748004,
"formula_full": "Sc4 Se6 O18",
"formula_reduced": "Sc2(SeO3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 2.60637015,
"spacegroup": 176
},
{
"id": "jvasp-9725",
"created_at": "2022-09-04T14:37:19.460217Z",
"updated_at": "2022-09-04T14:37:19.460249Z",
"structure_string": "Sc2 Si2 O7\n1.0\n4.688281 0.001333 -0.634526\n-0.921840 5.113208 -1.402450\n-0.002214 0.003898 5.381592\nSc Si O\n2 2 7\ndirect\n0.000001 0.309475 0.690525 Sc\n0.000000 0.690526 0.309475 Sc\n0.408217 0.224835 0.224835 Si\n0.591783 0.775165 0.775164 Si\n0.786904 0.922086 0.605193 O\n0.213097 0.394806 0.077914 O\n0.213097 0.077914 0.394806 O\n0.786904 0.605194 0.922085 O\n0.500000 -0.000000 -0.000000 O\n0.278743 0.604756 0.604755 O\n0.721258 0.395245 0.395244 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Sc",
"Si",
"O"
],
"chemical_system": "O-Sc-Si",
"density": 3.3211709410055295,
"density_atomic": 0.08524772199589685,
"volume": 129.03570608642718,
"volume_molar": 7.064283501076848,
"formula_full": "Sc2 Si2 O7",
"formula_reduced": "Sc2Si2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8125674727272725,
"spacegroup": 12
}
]
}