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=density&page=1521",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1519",
"results": [
{
"id": "jvasp-25660",
"created_at": "2022-09-04T14:38:15.265421Z",
"updated_at": "2022-09-04T14:38:15.265448Z",
"structure_string": "Mo2 F6\n1.0\n4.667247 0.069182 3.422627\n1.772287 4.318214 3.422627\n0.101542 0.069182 5.786818\nMo F\n2 6\ndirect\n0.500001 0.499999 0.500001 Mo\n0.000000 0.000000 0.000000 Mo\n0.370769 0.749999 0.129233 F\n0.750001 0.129231 0.370768 F\n0.870768 0.629232 0.250001 F\n0.250001 0.870766 0.629234 F\n0.629234 0.249999 0.870768 F\n0.129232 0.370767 0.750001 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"F"
],
"chemical_system": "F-Mo",
"density": 4.464873754092241,
"density_atomic": 0.0703254621414925,
"volume": 113.7568066585082,
"volume_molar": 8.56324377632052,
"formula_full": "Mo2 F6",
"formula_reduced": "MoF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.8484541868750001,
"spacegroup": 167
},
{
"id": "jvasp-23185",
"created_at": "2022-09-04T14:37:50.897950Z",
"updated_at": "2022-09-04T14:37:50.897977Z",
"structure_string": "Y4 Be4 Fe2 Si4 O20\n1.0\n0.000000 4.696276 -0.062320\n7.447212 0.000000 0.000000\n0.000000 0.036441 -9.950011\nY Be Fe Si O\n4 4 2 4 20\ndirect\n-0.003224 0.611212 0.174365 Y\n0.003224 0.111212 0.325635 Y\n0.003223 0.388787 0.825635 Y\n-0.003224 0.888787 0.674365 Y\n0.544349 0.914455 0.160279 Be\n0.455652 0.414455 0.339721 Be\n0.455652 0.085545 0.839721 Be\n0.544348 0.585545 0.660279 Be\n0.000000 0.000000 0.000000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.484937 0.720886 0.922233 Si\n0.515063 0.220886 0.577767 Si\n0.515063 0.279114 0.077767 Si\n0.484937 0.779114 0.422233 Si\n0.304546 0.159204 0.702927 O\n0.695455 0.659204 0.797073 O\n0.699970 0.796960 0.039691 O\n0.300031 0.296960 0.460309 O\n0.751595 0.422405 0.025455 O\n0.699970 0.703040 0.539691 O\n0.248405 0.922405 0.474545 O\n0.695455 0.840796 0.297073 O\n0.751595 0.077595 0.525455 O\n0.706610 0.392105 0.634624 O\n0.300031 0.203040 0.960309 O\n0.208450 0.589057 0.666052 O\n0.208450 0.910943 0.166052 O\n0.791551 0.410943 0.333948 O\n0.293391 0.892105 0.865376 O\n0.304546 0.340796 0.202927 O\n0.706610 0.107895 0.134624 O\n0.293391 0.607894 0.365376 O\n0.248405 0.577595 0.974544 O\n0.791551 0.089057 0.833948 O\n",
"nsites": 34,
"nelements": 5,
"elements": [
"Y",
"Be",
"Fe",
"Si",
"O"
],
"chemical_system": "Be-Fe-O-Si-Y",
"density": 4.465111314332199,
"density_atomic": 0.09770777733968121,
"volume": 347.97639375009993,
"volume_molar": 6.163420071530253,
"formula_full": "Y4 Be4 Fe2 Si4 O20",
"formula_reduced": "Y2Be2Fe(SiO5)2",
"formula_anonymous": "AB2C2D2E10",
"energy_above_hull": 3.012561223529412,
"spacegroup": 14
},
{
"id": "jvasp-99473",
"created_at": "2022-09-04T14:36:06.413435Z",
"updated_at": "2022-09-04T14:36:06.413463Z",
"structure_string": "Pm1 Sc3\n1.0\n4.303660 -0.037056 -3.732615\n-0.920272 4.204279 -3.732615\n0.030086 0.037056 5.696753\nPm Sc\n1 3\ndirect\n0.000000 0.000000 0.000000 Pm\n0.750001 0.250000 0.500001 Sc\n0.250001 0.750000 0.500001 Sc\n0.500000 0.500000 0.000001 Sc\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pm",
"Sc"
],
"chemical_system": "Pm-Sc",
"density": 4.465117503769862,
"density_atomic": 0.038431819989331525,
"volume": 104.08042088848198,
"volume_molar": 15.669673623762069,
"formula_full": "Pm1 Sc3",
"formula_reduced": "PmSc3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.36148173125,
"spacegroup": 139
},
{
"id": "jvasp-11395",
"created_at": "2022-09-04T14:38:33.203280Z",
"updated_at": "2022-09-04T14:38:33.203305Z",
"structure_string": "Al8 Sb8\n1.0\n7.620413 0.000000 -0.000000\n-0.000000 7.620413 0.000000\n-0.000000 -0.000000 7.620413\nAl Sb\n8 8\ndirect\n0.344077 0.344077 0.344077 Al\n0.155922 0.655922 0.844077 Al\n0.844077 0.155922 0.655922 Al\n0.655922 0.844077 0.155922 Al\n0.655922 0.655922 0.655922 Al\n0.844077 0.344077 0.155922 Al\n0.155922 0.844077 0.344077 Al\n0.344077 0.155922 0.844077 Al\n0.142094 0.142094 0.142094 Sb\n0.357905 0.857905 0.642094 Sb\n0.642094 0.357905 0.857905 Sb\n0.857905 0.642094 0.357905 Sb\n0.857905 0.857905 0.857905 Sb\n0.642094 0.142094 0.357905 Sb\n0.357905 0.642094 0.142094 Sb\n0.142094 0.357905 0.642094 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Al",
"Sb"
],
"chemical_system": "Al-Sb",
"density": 4.465147670042804,
"density_atomic": 0.036156339440307925,
"volume": 442.5226736908778,
"volume_molar": 16.655836440362595,
"formula_full": "Al8 Sb8",
"formula_reduced": "AlSb",
"formula_anonymous": "AB",
"energy_above_hull": 1.0296294500000005,
"spacegroup": 205
},
{
"id": "jvasp-113716",
"created_at": "2022-09-04T14:38:48.557020Z",
"updated_at": "2022-09-04T14:38:48.557036Z",
"structure_string": "Si1 Sb1 O1\n1.0\n3.031305 0.000000 -0.000000\n-0.000000 3.031305 0.000000\n-0.000000 -0.000000 6.711804\nSi Sb O\n1 1 1\ndirect\n0.000000 0.000000 0.044001 Si\n0.000000 0.000000 0.589624 Sb\n0.000000 0.000000 0.285013 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Si",
"Sb",
"O"
],
"chemical_system": "O-Sb-Si",
"density": 4.465320962143435,
"density_atomic": 0.04864326496967819,
"volume": 61.67349173354321,
"volume_molar": 12.38021494600312,
"formula_full": "Si1 Sb1 O1",
"formula_reduced": "SiSbO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9412094,
"spacegroup": 99
},
{
"id": "jvasp-44250",
"created_at": "2022-09-04T14:38:09.565488Z",
"updated_at": "2022-09-04T14:38:09.565508Z",
"structure_string": "Fe6 O4 F8\n1.0\n4.719128 0.023225 0.001694\n-0.041502 5.619021 -0.034219\n-0.046560 -0.575301 7.731181\nFe O F\n6 4 8\ndirect\n0.457332 0.664508 0.186869 Fe\n0.542669 0.335493 0.813131 Fe\n0.500000 0.000001 0.500000 Fe\n0.998643 0.144428 0.137255 Fe\n0.000000 0.500000 0.500000 Fe\n0.001358 0.855573 0.862744 Fe\n0.797959 0.142469 0.925431 O\n0.703141 0.298723 0.589236 O\n0.202042 0.857532 0.074568 O\n0.296860 0.701278 0.410763 O\n0.800372 0.800777 0.618159 F\n0.199629 0.199224 0.381841 F\n0.200314 0.544527 0.744723 F\n0.290629 0.042803 0.730103 F\n0.310469 0.361363 0.055037 F\n0.709372 0.957197 0.269896 F\n0.689532 0.638638 0.944963 F\n0.799687 0.455474 0.255276 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.465351065057879,
"density_atomic": 0.08783835754617397,
"volume": 204.92186446607843,
"volume_molar": 6.855935070090925,
"formula_full": "Fe6 O4 F8",
"formula_reduced": "Fe3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.708587181111111,
"spacegroup": 2
},
{
"id": "jvasp-65032",
"created_at": "2022-09-04T14:35:58.444713Z",
"updated_at": "2022-09-04T14:35:58.444739Z",
"structure_string": "Be1 P4 Rh1\n1.0\n-0.000000 3.526185 3.526185\n3.526185 0.000000 3.526185\n3.526185 3.526185 0.000000\nBe P Rh\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.115819 0.628061 0.628061 P\n0.628061 0.628061 0.115819 P\n0.628061 0.628061 0.628061 P\n0.628061 0.115819 0.628061 P\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"P",
"Rh"
],
"chemical_system": "Be-P-Rh",
"density": 4.465510007143002,
"density_atomic": 0.0684236084391976,
"volume": 87.68903214643676,
"volume_molar": 8.80126157823345,
"formula_full": "Be1 P4 Rh1",
"formula_reduced": "BeP4Rh",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.2195118500000004,
"spacegroup": 216
},
{
"id": "jvasp-50228",
"created_at": "2022-09-04T14:37:02.250295Z",
"updated_at": "2022-09-04T14:37:02.250319Z",
"structure_string": "Rb6 In2 O6\n1.0\n3.846407 5.923820 0.093028\n-3.846407 5.923820 -0.093028\n-1.484320 0.000000 6.804663\nRb In O\n6 2 6\ndirect\n0.367695 0.632305 0.647548 Rb\n0.808533 0.808533 0.500000 Rb\n0.191467 0.191467 0.500000 Rb\n0.259241 0.259241 0.000000 Rb\n0.740759 0.740759 -0.000000 Rb\n0.632305 0.367695 0.352451 Rb\n0.180448 0.819552 0.146365 In\n0.819551 0.180448 0.853634 In\n0.095391 0.904609 0.833702 O\n0.161070 0.552301 0.271161 O\n0.447699 0.838930 0.271161 O\n0.838930 0.447699 0.728839 O\n0.552301 0.161070 0.728839 O\n0.904609 0.095391 0.166298 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"In",
"O"
],
"chemical_system": "In-O-Rb",
"density": 4.466237195469451,
"density_atomic": 0.04491063000768958,
"volume": 311.7302072494402,
"volume_molar": 13.409165622857866,
"formula_full": "Rb6 In2 O6",
"formula_reduced": "Rb3InO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.4218672100000001,
"spacegroup": 12
},
{
"id": "jvasp-11211",
"created_at": "2022-09-04T14:37:16.524074Z",
"updated_at": "2022-09-04T14:37:16.524090Z",
"structure_string": "Ag1 Sb2 F12\n1.0\n-5.100478 0.017879 0.013460\n2.182815 4.996273 -0.020594\n-0.189428 -2.240405 -8.432594\nAg Sb F\n1 2 12\ndirect\n0.500000 0.499999 0.500000 Ag\n0.264088 0.023541 0.772728 Sb\n0.735911 0.976457 0.227271 Sb\n0.798420 0.761289 0.368934 F\n0.201579 0.238709 0.631065 F\n0.340635 0.754869 0.226694 F\n0.319809 0.773380 0.871545 F\n0.680191 0.226618 0.128454 F\n0.860641 0.801106 0.722394 F\n0.139358 0.198892 0.277605 F\n0.296921 0.781873 0.564862 F\n0.703079 0.218125 0.435137 F\n0.199300 0.254863 0.953074 F\n0.800699 0.745135 0.046925 F\n0.659365 0.245130 0.773305 F\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"F"
],
"chemical_system": "Ag-F-Sb",
"density": 4.4663609688633,
"density_atomic": 0.06963710346786754,
"volume": 215.40241125797843,
"volume_molar": 8.647890937593031,
"formula_full": "Ag1 Sb2 F12",
"formula_reduced": "AgSb2F12",
"formula_anonymous": "AB2C12",
"energy_above_hull": 0.0620305196666666,
"spacegroup": 2
},
{
"id": "jvasp-118826",
"created_at": "2022-09-04T14:38:47.810938Z",
"updated_at": "2022-09-04T14:38:47.810968Z",
"structure_string": "As2 C1\n1.0\n4.679008 0.734917 0.247761\n-3.763008 -5.393157 -0.346142\n-0.645286 -1.028471 -2.740653\nAs C\n2 1\ndirect\n0.560303 0.913060 0.494620 As\n0.453146 0.359605 0.993854 As\n0.904435 0.085155 -0.005699 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"As",
"C"
],
"chemical_system": "As-C",
"density": 4.46637416352883,
"density_atomic": 0.04985446858350576,
"volume": 60.17514748903659,
"volume_molar": 12.079440281091296,
"formula_full": "As2 C1",
"formula_reduced": "As2C",
"formula_anonymous": "AB2",
"energy_above_hull": 3.405121166666666,
"spacegroup": 44
},
{
"id": "jvasp-45398",
"created_at": "2022-09-04T14:36:51.300532Z",
"updated_at": "2022-09-04T14:36:51.300562Z",
"structure_string": "Ba3 B3 As3 O15\n1.0\n3.686674 -6.385508 0.000000\n3.686674 6.385508 -0.000000\n0.000000 -0.000000 7.179174\nBa B As O\n3 3 3 15\ndirect\n0.333337 0.058058 0.836240 Ba\n0.724721 0.666662 0.502907 Ba\n0.941941 0.275278 0.169574 Ba\n0.333270 0.569865 0.836271 B\n0.236594 0.666729 0.502939 B\n0.430134 0.763405 0.169605 B\n0.936519 0.269974 0.669559 As\n0.333456 0.063480 0.336226 As\n0.730024 0.666543 0.002893 As\n0.511513 0.521521 0.857445 O\n0.897597 0.080202 0.517885 O\n0.182606 0.102403 0.184552 O\n0.919796 0.817393 0.851219 O\n0.155104 0.343260 0.814861 O\n0.188155 0.844895 0.481528 O\n0.306490 0.666460 0.003041 O\n0.768549 0.515528 0.154694 O\n0.484471 0.253021 0.488028 O\n0.746978 0.231450 0.821361 O\n0.478478 0.989993 0.190778 O\n0.359969 0.693509 0.669708 O\n0.333539 0.640029 0.336374 O\n0.656739 0.811843 0.148194 O\n0.010006 0.488486 0.524112 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Ba",
"B",
"As",
"O"
],
"chemical_system": "As-B-Ba-O",
"density": 4.466418711490021,
"density_atomic": 0.07100298012446758,
"volume": 338.0139813558278,
"volume_molar": 8.481532394053378,
"formula_full": "Ba3 B3 As3 O15",
"formula_reduced": "BaBAsO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.4181809754166665,
"spacegroup": 152
},
{
"id": "jvasp-55193",
"created_at": "2022-09-04T14:38:30.170119Z",
"updated_at": "2022-09-04T14:38:30.170150Z",
"structure_string": "Ca2 In4\n1.0\n2.696336 -4.670190 0.000000\n2.696336 4.670190 0.000000\n0.000000 -0.000000 7.963121\nCa In\n2 4\ndirect\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333334 0.439043 In\n0.333334 0.666668 0.560957 In\n0.333334 0.666668 0.939043 In\n0.666668 0.333334 0.060957 In\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"In"
],
"chemical_system": "Ca-In",
"density": 4.466431858947961,
"density_atomic": 0.029917781085329217,
"volume": 200.54963243722042,
"volume_molar": 20.12896859838672,
"formula_full": "Ca2 In4",
"formula_reduced": "CaIn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1403166666666666,
"spacegroup": 194
}
]
}