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=-chemical_system&page=1567",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1565",
"results": [
{
"id": "jvasp-93280",
"created_at": "2022-09-04T14:35:43.190050Z",
"updated_at": "2022-09-04T14:35:43.190081Z",
"structure_string": "Rb1 V1 F3\n1.0\n4.193491 0.000000 0.000000\n0.000000 4.193491 0.000000\n0.000000 0.000000 4.193491\nRb V F\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 V\n0.000000 0.500000 0.500000 F\n0.500000 0.000000 0.500000 F\n0.500000 0.500000 0.000000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"V",
"F"
],
"chemical_system": "F-Rb-V",
"density": 4.355003896434214,
"density_atomic": 0.06780205523123593,
"volume": 73.74407726945326,
"volume_molar": 8.88194427065928,
"formula_full": "Rb1 V1 F3",
"formula_reduced": "RbVF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1891334200000001,
"spacegroup": 221
},
{
"id": "jvasp-110374",
"created_at": "2022-09-04T14:38:39.120279Z",
"updated_at": "2022-09-04T14:38:39.120298Z",
"structure_string": "Rb2 Y1 Tl1 F6\n1.0\n5.868704 -0.000000 3.388297\n1.956235 5.533066 3.388297\n0.000000 -0.000000 6.776594\nRb Y Tl F\n2 1 1 6\ndirect\n0.749999 0.750001 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.499999 0.500000 0.500000 Tl\n0.773826 0.226173 0.226173 F\n0.226172 0.226173 0.773827 F\n0.226172 0.773828 0.773827 F\n0.226172 0.773828 0.226173 F\n0.773826 0.226173 0.773827 F\n0.773826 0.773828 0.226174 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Tl",
"F"
],
"chemical_system": "F-Rb-Tl-Y",
"density": 4.3633399997585665,
"density_atomic": 0.04544441078521103,
"volume": 220.04906273874053,
"volume_molar": 13.251664299187668,
"formula_full": "Rb2 Y1 Tl1 F6",
"formula_reduced": "Rb2YTlF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-92505",
"created_at": "2022-09-04T14:36:14.217255Z",
"updated_at": "2022-09-04T14:36:14.217275Z",
"structure_string": "Rb1 Tl1 F3\n1.0\n-0.012580 -4.698367 -0.062333\n-4.698945 0.011822 -0.032655\n0.034087 0.062923 -4.698901\nRb Tl F\n1 1 3\ndirect\n0.989919 0.997616 0.991079 Rb\n0.488281 0.499652 0.496920 Tl\n0.486470 0.999818 0.502175 F\n0.988149 0.501133 0.502427 F\n0.487187 0.501777 0.997398 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"F"
],
"chemical_system": "F-Rb-Tl",
"density": 5.5506088119799335,
"density_atomic": 0.04818639647563233,
"volume": 103.7637251527717,
"volume_molar": 12.497595173038873,
"formula_full": "Rb1 Tl1 F3",
"formula_reduced": "RbTlF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.011834,
"spacegroup": 99
},
{
"id": "jvasp-10148",
"created_at": "2022-09-04T14:36:48.506693Z",
"updated_at": "2022-09-04T14:36:48.506710Z",
"structure_string": "Rb3 Tl1 F6\n1.0\n5.900530 -0.000000 -3.359176\n-1.912380 5.582030 -3.359176\n0.013106 0.018344 6.884871\nRb Tl F\n3 1 6\ndirect\n0.750000 0.250000 0.499999 Rb\n0.250000 0.750000 0.499999 Rb\n0.500000 0.500000 -0.000001 Rb\n0.000000 0.000000 0.000000 Tl\n0.683962 0.000000 -0.000000 F\n0.000000 0.683962 -0.000000 F\n0.000000 0.316038 -0.000000 F\n0.316038 0.000000 -0.000000 F\n0.232840 0.232840 0.465680 F\n0.767160 0.767160 0.534319 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"F"
],
"chemical_system": "F-Rb-Tl",
"density": 4.195455493617771,
"density_atomic": 0.043957253515551485,
"volume": 227.49373994583476,
"volume_molar": 13.699993239726517,
"formula_full": "Rb3 Tl1 F6",
"formula_reduced": "Rb3TlF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-106457",
"created_at": "2022-09-04T14:36:46.622637Z",
"updated_at": "2022-09-04T14:36:46.622656Z",
"structure_string": "Rb2 Tl2 F6\n1.0\n5.816028 -0.000000 3.357885\n1.938676 5.483404 3.357885\n-0.000000 -0.000000 6.715771\nRb Tl F\n2 2 6\ndirect\n0.750001 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.768964 0.231036 0.231037 F\n0.231036 0.231036 0.768964 F\n0.231037 0.768963 0.768964 F\n0.231037 0.768963 0.231037 F\n0.768964 0.231036 0.768964 F\n0.768965 0.768963 0.231037 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"F"
],
"chemical_system": "F-Rb-Tl",
"density": 5.37828186738757,
"density_atomic": 0.046690377794287,
"volume": 214.17689195103478,
"volume_molar": 12.898033908684424,
"formula_full": "Rb2 Tl2 F6",
"formula_reduced": "RbTlF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-45301",
"created_at": "2022-09-04T14:38:35.194622Z",
"updated_at": "2022-09-04T14:38:35.194645Z",
"structure_string": "Rb6 Ti2 F14\n1.0\n8.080440 0.000000 0.000000\n0.000000 8.080440 0.000000\n0.000000 0.000000 5.982473\nRb Ti F\n6 2 14\ndirect\n0.188986 0.688986 0.500000 Rb\n0.688986 0.811014 0.500000 Rb\n0.311014 0.188986 0.500000 Rb\n0.811014 0.311014 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Rb\n0.000000 0.500000 0.000000 Ti\n0.500000 0.000000 0.000000 Ti\n0.334787 0.165213 0.000000 F\n0.834787 0.334787 0.000000 F\n0.500000 0.500000 0.500000 F\n0.000000 0.000000 0.500000 F\n0.614611 0.114611 0.227568 F\n0.114611 0.385389 0.227568 F\n0.114611 0.385389 0.772432 F\n0.385389 0.885389 0.227568 F\n0.885389 0.614611 0.772432 F\n0.665213 0.834787 0.000000 F\n0.614611 0.114611 0.772432 F\n0.385389 0.885389 0.772432 F\n0.885389 0.614611 0.227568 F\n0.165213 0.665213 0.000000 F\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Rb",
"Ti",
"F"
],
"chemical_system": "F-Rb-Ti",
"density": 3.717639760765164,
"density_atomic": 0.056321201874417345,
"volume": 390.6166642014259,
"volume_molar": 10.692493341012,
"formula_full": "Rb6 Ti2 F14",
"formula_reduced": "Rb3TiF7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 0.0,
"spacegroup": 127
},
{
"id": "jvasp-99726",
"created_at": "2022-09-04T14:36:33.331806Z",
"updated_at": "2022-09-04T14:36:33.331829Z",
"structure_string": "Rb3 Ti1 F6\n1.0\n5.626000 0.000000 3.248173\n1.875333 5.304243 3.248173\n0.000000 0.000000 6.496346\nRb Ti F\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ti\n0.784212 0.215788 0.215788 F\n0.215788 0.215788 0.784212 F\n0.215788 0.784211 0.784212 F\n0.215788 0.784211 0.215788 F\n0.784212 0.215788 0.784212 F\n0.784211 0.784211 0.215788 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Ti",
"F"
],
"chemical_system": "F-Rb-Ti",
"density": 3.582646791621833,
"density_atomic": 0.05158313255645485,
"volume": 193.86182080073482,
"volume_molar": 11.67463172851921,
"formula_full": "Rb3 Ti1 F6",
"formula_reduced": "Rb3TiF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-95440",
"created_at": "2022-09-04T14:36:21.708373Z",
"updated_at": "2022-09-04T14:36:21.708405Z",
"structure_string": "Rb2 Th6 F26\n1.0\n7.479155 0.000000 0.000000\n0.000000 8.197057 0.000000\n0.000000 0.000000 8.699620\nRb Th F\n2 6 26\ndirect\n0.894868 0.500000 0.306382 Rb\n0.105133 0.500000 0.806382 Rb\n0.602403 0.253250 0.665133 Th\n0.602403 0.746750 0.665133 Th\n0.397598 0.746750 0.165133 Th\n0.397598 0.253250 0.165133 Th\n0.108213 0.000000 0.499610 Th\n0.891788 0.000000 0.999610 Th\n0.302925 0.826204 0.637054 F\n0.227713 0.500000 0.132172 F\n0.824517 0.256735 0.857450 F\n0.175484 0.743266 0.357450 F\n0.175484 0.256735 0.357450 F\n0.403084 0.000000 0.039327 F\n0.697076 0.173796 0.137054 F\n0.637122 0.000000 0.820479 F\n0.596917 0.000000 0.539327 F\n0.115899 0.195720 0.042449 F\n0.302925 0.173796 0.637054 F\n0.547755 0.694759 0.402705 F\n0.968987 0.000000 0.263224 F\n0.772287 0.500000 0.632172 F\n0.452246 0.694759 0.902705 F\n0.547755 0.305241 0.402705 F\n0.434849 0.500000 0.650723 F\n0.884101 0.195720 0.542449 F\n0.031014 0.000000 0.763224 F\n0.362878 0.000000 0.320479 F\n0.824517 0.743266 0.857450 F\n0.115899 0.804280 0.042449 F\n0.565151 0.500000 0.150723 F\n0.697076 0.826204 0.137054 F\n0.452246 0.305241 0.902705 F\n0.884101 0.804280 0.542449 F\n",
"nsites": 34,
"nelements": 3,
"elements": [
"Rb",
"Th",
"F"
],
"chemical_system": "F-Rb-Th",
"density": 6.404695222685523,
"density_atomic": 0.06374823210397924,
"volume": 533.3481239847226,
"volume_molar": 9.446757284464505,
"formula_full": "Rb2 Th6 F26",
"formula_reduced": "RbTh3F13",
"formula_anonymous": "AB3C13",
"energy_above_hull": 0.3782901073529413,
"spacegroup": 26
},
{
"id": "jvasp-21974",
"created_at": "2022-09-04T14:37:35.047339Z",
"updated_at": "2022-09-04T14:37:35.047363Z",
"structure_string": "Rb2 Th1 F6\n1.0\n3.423156 -5.929081 0.000000\n3.423156 5.929081 -0.000000\n0.000000 0.000000 3.839451\nRb Th F\n2 1 6\ndirect\n0.333334 0.666668 0.500000 Rb\n0.666668 0.333334 0.500000 Rb\n0.000000 0.000000 0.000000 Th\n0.000000 0.221375 0.500000 F\n0.778626 0.778626 0.500000 F\n0.221375 0.000000 0.500000 F\n0.662507 0.000000 0.000000 F\n0.337494 0.337494 0.000000 F\n0.000000 0.662507 0.000000 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Th",
"F"
],
"chemical_system": "F-Rb-Th",
"density": 5.508029596995122,
"density_atomic": 0.05774698436597339,
"volume": 155.85229425942327,
"volume_molar": 10.428493931102077,
"formula_full": "Rb2 Th1 F6",
"formula_reduced": "Rb2ThF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-9376",
"created_at": "2022-09-04T14:38:32.573953Z",
"updated_at": "2022-09-04T14:38:32.573978Z",
"structure_string": "Rb4 Tb2 F12\n1.0\n7.100639 -0.000000 0.196580\n3.550319 5.889234 0.098290\n0.030901 -0.000000 7.411844\nTb Rb F\n2 4 12\ndirect\n0.959146 0.081709 0.750000 Tb\n0.040854 0.918291 0.250000 Tb\n0.679136 0.684542 0.000510 Rb\n0.636322 0.684542 0.499489 Rb\n0.363678 0.315458 0.500510 Rb\n0.320864 0.315458 0.999489 Rb\n0.390743 0.608455 0.225415 F\n0.000802 0.608455 0.274585 F\n0.704688 0.981529 0.728817 F\n0.933098 0.206536 0.044761 F\n0.686217 0.018470 0.228817 F\n0.999198 0.391544 0.725414 F\n0.609257 0.391544 0.774585 F\n0.139634 0.793464 0.544761 F\n0.066902 0.793464 0.955238 F\n0.860366 0.206536 0.455239 F\n0.295312 0.018470 0.271183 F\n0.313783 0.981529 0.771182 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Tb",
"Rb",
"F"
],
"chemical_system": "F-Rb-Tb",
"density": 4.756464644232637,
"density_atomic": 0.05808180720981753,
"volume": 309.907712323343,
"volume_molar": 10.368377034559765,
"formula_full": "Rb4 Tb2 F12",
"formula_reduced": "Rb2TbF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 15
},
{
"id": "jvasp-110077",
"created_at": "2022-09-04T14:37:59.007172Z",
"updated_at": "2022-09-04T14:37:59.007192Z",
"structure_string": "Rb3 Tb1 F6\n1.0\n6.060573 0.131809 -3.315337\n-2.071098 5.697234 -3.315337\n-0.090212 -0.131809 6.907523\nTb Rb F\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.750000 0.250000 0.499999 Rb\n0.249999 0.749999 0.499999 Rb\n0.499999 0.500000 -0.000001 Rb\n-0.000000 0.311212 0.311212 F\n-0.000000 0.688787 0.688786 F\n0.311213 -0.000000 0.311212 F\n0.688787 -0.000000 0.688787 F\n0.230580 0.230580 -0.000000 F\n0.769419 0.769420 -0.000001 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tb",
"Rb",
"F"
],
"chemical_system": "F-Rb-Tb",
"density": 3.7374656285991406,
"density_atomic": 0.04252168713799159,
"volume": 235.17411168442,
"volume_molar": 14.162516036715383,
"formula_full": "Rb3 Tb1 F6",
"formula_reduced": "Rb3TbF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-119152",
"created_at": "2022-09-04T14:38:51.680417Z",
"updated_at": "2022-09-04T14:38:51.680433Z",
"structure_string": "Rb4 Ta2 F14\n1.0\n5.866817 -0.000000 0.000000\n0.000000 5.793084 0.000000\n-0.000000 -0.000000 10.546762\nRb Ta F\n4 2 14\ndirect\n-0.000000 0.500000 0.365096 Rb\n0.500000 0.000000 0.634904 Rb\n0.500000 0.500000 -0.006301 Rb\n0.000000 0.000000 0.006301 Rb\n-0.000000 0.500000 0.756796 Ta\n0.500000 0.000000 0.243204 Ta\n0.794182 0.500000 0.607975 F\n0.205819 0.500000 0.607975 F\n0.500000 0.000000 0.049915 F\n-0.000000 0.500000 0.950085 F\n0.781208 0.253608 0.798808 F\n0.281208 0.753607 0.201191 F\n0.781208 0.746392 0.798808 F\n0.218793 0.746392 0.798808 F\n0.294181 0.000000 0.392025 F\n0.718793 0.753607 0.201191 F\n0.281208 0.246392 0.201191 F\n0.218793 0.253608 0.798808 F\n0.718793 0.246392 0.201191 F\n0.705819 0.000000 0.392025 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Rb",
"Ta",
"F"
],
"chemical_system": "F-Rb-Ta",
"density": 4.492364184809882,
"density_atomic": 0.05579541116609043,
"volume": 358.4524171793355,
"volume_molar": 10.793254560081001,
"formula_full": "Rb4 Ta2 F14",
"formula_reduced": "Rb2TaF7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 0.1205831177500006,
"spacegroup": 59
}
]
}