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=elements&page=4137",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4135",
"results": [
{
"id": "jvasp-112526",
"created_at": "2022-09-04T14:38:41.815924Z",
"updated_at": "2022-09-04T14:38:41.815956Z",
"structure_string": "K4 Ti2 O4 F8\n1.0\n5.994923 -0.053961 0.000000\n-1.003891 5.910517 0.000000\n-0.000000 -0.000000 7.563753\nK Ti O F\n4 2 4 8\ndirect\n0.976755 0.501492 0.250000 K\n0.498508 0.023244 0.750000 K\n0.023244 0.498508 0.750000 K\n0.501492 0.976756 0.250000 K\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.542581 0.542581 0.750000 O\n0.457419 0.457420 0.250000 O\n0.003864 0.003864 0.250000 O\n-0.003864 -0.003864 0.750000 O\n0.251448 0.251448 -0.006176 F\n0.789422 0.210578 0.500000 F\n0.789422 0.210578 -0.000000 F\n0.210578 0.789422 0.500000 F\n0.210578 0.789422 -0.000000 F\n0.251448 0.251448 0.506176 F\n0.748552 0.748553 0.493824 F\n0.748552 0.748553 0.006176 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Ti",
"O",
"F"
],
"chemical_system": "F-K-O-Ti",
"density": 2.904804743674384,
"density_atomic": 0.06726521809522727,
"volume": 267.59743757193246,
"volume_molar": 8.952830200408277,
"formula_full": "K4 Ti2 O4 F8",
"formula_reduced": "K2Ti(OF2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 0.523553607037037,
"spacegroup": 63
},
{
"id": "jvasp-57086",
"created_at": "2022-09-04T14:37:49.646889Z",
"updated_at": "2022-09-04T14:37:49.646914Z",
"structure_string": "K2 Ti2 P2 S10\n1.0\n6.273909 0.001589 -0.812425\n-0.343538 6.583012 -2.640069\n0.001493 -0.021940 9.494851\nK Ti P S\n2 2 2 10\ndirect\n0.729919 0.229700 0.459401 K\n0.270080 0.770300 0.540599 K\n0.500000 0.777469 0.000000 Ti\n0.500000 0.222530 0.000000 Ti\n0.715627 0.634063 0.268127 P\n0.284372 0.365937 0.731873 P\n0.163600 0.648560 0.828528 S\n0.239148 0.251174 0.502349 S\n0.836399 0.351440 0.171472 S\n0.392960 0.586465 0.172930 S\n0.836399 0.820032 0.171472 S\n0.326009 0.063263 0.126527 S\n0.673990 0.936737 0.873474 S\n0.607040 0.413535 0.827070 S\n0.163600 0.179968 0.828529 S\n0.760851 0.748826 0.497651 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"K",
"Ti",
"P",
"S"
],
"chemical_system": "K-P-S-Ti",
"density": 2.3587398440665175,
"density_atomic": 0.04083793864001841,
"volume": 391.7925471468603,
"volume_molar": 14.746436672733305,
"formula_full": "K2 Ti2 P2 S10",
"formula_reduced": "KTiPS5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.1084889791666668,
"spacegroup": 12
},
{
"id": "jvasp-55008",
"created_at": "2022-09-04T14:37:30.360196Z",
"updated_at": "2022-09-04T14:37:30.360213Z",
"structure_string": "K2 Ti2 P2 Se10\n1.0\n6.553757 0.005552 -0.848917\n-0.360892 6.851276 -2.741332\n0.010767 -0.008414 9.933503\nK Ti P Se\n2 2 2 10\ndirect\n0.764954 0.268117 0.536232 K\n0.235047 0.731884 0.463768 K\n0.000000 0.723927 0.000000 Ti\n0.000000 0.276073 0.000000 Ti\n0.214419 0.137942 0.275882 P\n0.785582 0.862059 0.724118 P\n0.117588 0.914417 0.828834 Se\n0.187897 0.438223 0.876443 Se\n0.660597 0.156368 0.827703 Se\n0.882413 0.085584 0.171166 Se\n0.339404 0.843633 0.172297 Se\n0.660597 0.671336 0.827703 Se\n0.812104 0.561778 0.123557 Se\n0.257722 0.257260 0.514517 Se\n0.339404 0.328665 0.172297 Se\n0.742280 0.742741 0.485483 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"K",
"Ti",
"P",
"Se"
],
"chemical_system": "K-P-Se-Ti",
"density": 3.818394375842844,
"density_atomic": 0.03587775556131045,
"volume": 445.958777233377,
"volume_molar": 16.785165810355497,
"formula_full": "K2 Ti2 P2 Se10",
"formula_reduced": "KTiPSe5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 1.7716860833333334,
"spacegroup": 12
},
{
"id": "jvasp-25792",
"created_at": "2022-09-04T14:38:14.907220Z",
"updated_at": "2022-09-04T14:38:14.907243Z",
"structure_string": "K4 Ti2 Si6 O18\n1.0\n7.572172 -0.019698 1.002666\n0.876080 7.521347 1.002666\n-0.022184 -0.019698 7.638236\nK Ti Si O\n4 2 6 18\ndirect\n0.774899 0.222247 0.991061 K\n0.991059 0.774899 0.222248 K\n0.222247 0.991060 0.774900 K\n0.501133 0.501133 0.501134 K\n0.219052 0.219052 0.219052 Ti\n0.740406 0.740406 0.740407 Ti\n0.441840 0.542382 0.018821 Si\n0.018821 0.441840 0.542382 Si\n0.542382 0.018820 0.441840 Si\n0.887929 0.101373 0.511287 Si\n0.511286 0.887929 0.101374 Si\n0.101374 0.511286 0.887929 Si\n0.246853 0.627945 0.949528 O\n0.005719 0.105046 0.317523 O\n0.430858 0.343947 0.120532 O\n0.120532 0.430858 0.343947 O\n0.676066 0.162145 0.479887 O\n0.550916 0.846656 0.590745 O\n0.631856 0.906362 0.911308 O\n0.590744 0.550916 0.846656 O\n0.479887 0.676066 0.162146 O\n0.911307 0.631855 0.906363 O\n0.846656 0.590744 0.550917 O\n0.627945 0.949527 0.246853 O\n0.949527 0.246852 0.627946 O\n0.343947 0.120531 0.430858 O\n0.162146 0.479887 0.676067 O\n0.105046 0.317523 0.005720 O\n0.906362 0.911307 0.631856 O\n0.317523 0.005719 0.105047 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"K",
"Ti",
"Si",
"O"
],
"chemical_system": "K-O-Si-Ti",
"density": 2.7022668182664003,
"density_atomic": 0.06889397119129415,
"volume": 435.4517453595559,
"volume_molar": 8.741172349143074,
"formula_full": "K4 Ti2 Si6 O18",
"formula_reduced": "K2Ti(SiO3)3",
"formula_anonymous": "AB2C3D9",
"energy_above_hull": 2.5464714422222223,
"spacegroup": 146
},
{
"id": "jvasp-109844",
"created_at": "2022-09-04T14:38:00.458537Z",
"updated_at": "2022-09-04T14:38:00.458558Z",
"structure_string": "K2 Tl1 Ag1 Cl6\n1.0\n6.421143 -0.000000 3.707249\n2.140381 6.053912 3.707249\n0.000000 -0.000000 7.414497\nK Tl Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500001 Ag\n0.748428 0.251571 0.251572 Cl\n0.251571 0.251571 0.748429 Cl\n0.251571 0.748428 0.748429 Cl\n0.251571 0.748428 0.251572 Cl\n0.748428 0.251571 0.748429 Cl\n0.748428 0.748428 0.251572 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-K-Tl",
"density": 3.475008592614923,
"density_atomic": 0.034695237172925476,
"volume": 288.22399887796496,
"volume_molar": 17.357254916531872,
"formula_full": "K2 Tl1 Ag1 Cl6",
"formula_reduced": "K2TlAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110359",
"created_at": "2022-09-04T14:38:38.274555Z",
"updated_at": "2022-09-04T14:38:38.274570Z",
"structure_string": "K2 Tl1 Ag1 F6\n1.0\n5.528553 0.000000 3.191911\n1.842851 5.212370 3.191911\n0.000000 0.000000 6.383824\nK Tl Ag F\n2 1 1 6\ndirect\n0.749999 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Ag\n0.755650 0.244350 0.244350 F\n0.244350 0.244350 0.755650 F\n0.244350 0.755650 0.755650 F\n0.244350 0.755650 0.244350 F\n0.755650 0.244350 0.755650 F\n0.755650 0.755650 0.244350 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Ag",
"F"
],
"chemical_system": "Ag-F-K-Tl",
"density": 4.553336226483768,
"density_atomic": 0.05435911543086725,
"volume": 183.96178673506532,
"volume_molar": 11.078437741796641,
"formula_full": "K2 Tl1 Ag1 F6",
"formula_reduced": "K2TlAgF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110354",
"created_at": "2022-09-04T14:38:37.278079Z",
"updated_at": "2022-09-04T14:38:37.278101Z",
"structure_string": "K2 Tl1 Ag1 I6\n1.0\n7.284119 -0.000000 4.205488\n2.428040 6.867533 4.205488\n-0.000000 -0.000000 8.410976\nK Tl Ag I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Ag\n0.743151 0.256849 0.256850 I\n0.256849 0.256849 0.743151 I\n0.256850 0.743150 0.743151 I\n0.256850 0.743150 0.256850 I\n0.743151 0.256849 0.743151 I\n0.743151 0.743150 0.256850 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Ag",
"I"
],
"chemical_system": "Ag-I-K-Tl",
"density": 4.546008452897118,
"density_atomic": 0.023767079509776183,
"volume": 420.75005454021687,
"volume_molar": 25.338160532188628,
"formula_full": "K2 Tl1 Ag1 I6",
"formula_reduced": "K2TlAgI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107808",
"created_at": "2022-09-04T14:36:34.558340Z",
"updated_at": "2022-09-04T14:36:34.558368Z",
"structure_string": "K2 Tl1 As1 Br6\n1.0\n6.970426 -0.000000 4.024377\n2.323475 6.571781 4.024377\n-0.000000 -0.000000 8.048755\nK Tl As Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.766396 0.233605 0.233605 Br\n0.233605 0.233605 0.766395 Br\n0.233606 0.766395 0.766395 Br\n0.233606 0.766395 0.233605 Br\n0.766396 0.233605 0.766395 Br\n0.766396 0.766395 0.233605 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"Br"
],
"chemical_system": "As-Br-K-Tl",
"density": 3.769335429338987,
"density_atomic": 0.027122448216691766,
"volume": 368.69827974621313,
"volume_molar": 22.20352938601553,
"formula_full": "K2 Tl1 As1 Br6",
"formula_reduced": "K2TlAsBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110346",
"created_at": "2022-09-04T14:38:39.000007Z",
"updated_at": "2022-09-04T14:38:39.000031Z",
"structure_string": "K2 Tl1 As1 Cl6\n1.0\n6.650644 -0.000000 3.839751\n2.216882 6.270287 3.839751\n0.000000 0.000000 7.679502\nK Tl As Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.769725 0.230274 0.230274 Cl\n0.230274 0.230274 0.769726 Cl\n0.230274 0.769726 0.769726 Cl\n0.230274 0.769726 0.230274 Cl\n0.769725 0.230274 0.769726 Cl\n0.769725 0.769726 0.230274 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"Cl"
],
"chemical_system": "As-Cl-K-Tl",
"density": 2.9566981104572085,
"density_atomic": 0.0312259616027733,
"volume": 320.2463426814648,
"volume_molar": 19.285685535029767,
"formula_full": "K2 Tl1 As1 Cl6",
"formula_reduced": "K2TlAsCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-102062",
"created_at": "2022-09-04T14:37:02.994891Z",
"updated_at": "2022-09-04T14:37:02.994918Z",
"structure_string": "K2 Tl1 As1 F6\n1.0\n5.686296 -0.000000 3.282985\n1.895432 5.361091 3.282985\n-0.000000 -0.000000 6.565969\nK Tl As F\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 As\n0.778130 0.221871 0.221870 F\n0.221871 0.221871 0.778129 F\n0.221871 0.778129 0.778129 F\n0.221871 0.778129 0.221870 F\n0.778130 0.221871 0.778129 F\n0.778130 0.778129 0.221869 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"F"
],
"chemical_system": "As-F-K-Tl",
"density": 3.911486909697325,
"density_atomic": 0.04995955137301745,
"volume": 200.16192550121417,
"volume_molar": 12.054032901609453,
"formula_full": "K2 Tl1 As1 F6",
"formula_reduced": "K2TlAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107803",
"created_at": "2022-09-04T14:36:33.876497Z",
"updated_at": "2022-09-04T14:36:33.876519Z",
"structure_string": "K2 Tl1 As1 I6\n1.0\n7.437597 -0.000000 4.294099\n2.479199 7.012234 4.294099\n-0.000000 -0.000000 8.588197\nK Tl As I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.763569 0.236431 0.236431 I\n0.236431 0.236431 0.763569 I\n0.236432 0.763568 0.763569 I\n0.236432 0.763568 0.236431 I\n0.763569 0.236431 0.763569 I\n0.763569 0.763568 0.236431 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"I"
],
"chemical_system": "As-I-K-Tl",
"density": 4.1482060688804605,
"density_atomic": 0.022325899175487232,
"volume": 447.9102911554631,
"volume_molar": 26.973788211907817,
"formula_full": "K2 Tl1 As1 I6",
"formula_reduced": "K2TlAsI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100902",
"created_at": "2022-09-04T14:37:08.290462Z",
"updated_at": "2022-09-04T14:37:08.290482Z",
"structure_string": "K2 Tl1 Au1 Cl6\n1.0\n6.460601 0.000000 3.730030\n2.153534 6.091113 3.730030\n0.000000 0.000000 7.460060\nK Tl Au Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Au\n0.742947 0.257052 0.257053 Cl\n0.257052 0.257052 0.742948 Cl\n0.257052 0.742947 0.742948 Cl\n0.257052 0.742947 0.257053 Cl\n0.742947 0.257052 0.742948 Cl\n0.742947 0.742947 0.257053 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Au",
"Cl"
],
"chemical_system": "Au-Cl-K-Tl",
"density": 3.9156984752814146,
"density_atomic": 0.034063408503508086,
"volume": 293.5701516473353,
"volume_molar": 17.679207761547993,
"formula_full": "K2 Tl1 Au1 Cl6",
"formula_reduced": "K2TlAuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}