{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=512","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=510","results":[{"id":"jvasp-88049","created_at":"2022-09-04T14:35:47.140506Z","updated_at":"2022-09-04T14:35:47.140544Z","structure_string":"Rb10 Co4 O8\n1.0\n6.970522 0.012241 0.044657\n2.911784 7.566104 4.353746\n-0.040095 0.051503 9.568298\nRb Co O\n10 4 8\ndirect\n0.903529 0.829050 0.779845 Rb\n0.096472 0.170949 0.220157 Rb\n0.897277 0.437620 0.781367 Rb\n0.102723 0.562379 0.218634 Rb\n0.730483 0.050055 0.024409 Rb\n0.269518 0.949944 0.975593 Rb\n0.375536 0.363615 0.634526 Rb\n0.624464 0.636384 0.365476 Rb\n0.619308 0.172487 0.380359 Rb\n0.380693 0.827512 0.619642 Rb\n0.013850 0.209391 0.576445 Co\n0.986150 0.790608 0.423557 Co\n0.616401 0.575866 0.030969 Co\n0.383599 0.424133 0.969033 Co\n0.806012 0.206688 0.680473 O\n0.688792 0.737599 0.045032 O\n0.311208 0.262400 0.954969 O\n0.230793 0.205277 0.483230 O\n0.769207 0.794722 0.516771 O\n0.318691 0.644516 0.952046 O\n0.681309 0.355483 0.047955 O\n0.193989 0.793311 0.319528 O\n","nsites":22,"nelements":3,"elements":["Rb","Co","O"],"chemical_system":"Co-O-Rb","density":4.024342557765892,"density_atomic":0.04375991833767882,"volume":502.7431685368853,"volume_molar":13.761773304806939,"formula_full":"Rb10 Co4 O8","formula_reduced":"Rb5(CoO2)2","formula_anonymous":"A2B4C5","energy_above_hull":1.1569223454545454,"spacegroup":2},{"id":"jvasp-88080","created_at":"2022-09-04T14:35:44.842419Z","updated_at":"2022-09-04T14:35:44.842451Z","structure_string":"Ba8 Br12 O2\n1.0\n10.412649 0.000000 0.000000\n-5.206325 9.017619 -0.000000\n0.000000 -0.000000 7.902812\nBa Br O\n8 12 2\ndirect\n0.198366 0.801634 -0.000917 Ba\n0.333333 0.666667 0.420931 Ba\n0.603268 0.801634 -0.000917 Ba\n0.801634 0.198366 0.499083 Ba\n0.396732 0.198366 0.499083 Ba\n0.801634 0.603268 0.499083 Ba\n0.666667 0.333333 0.920930 Ba\n0.198366 0.396732 -0.000917 Ba\n0.940378 0.470189 0.207818 Br\n0.470189 0.529811 0.707818 Br\n0.529811 0.059622 0.207818 Br\n0.141650 0.858349 0.394846 Br\n0.470189 0.940378 0.707818 Br\n0.059621 0.529811 0.707818 Br\n0.141650 0.283301 0.394846 Br\n0.858349 0.716699 0.894846 Br\n0.283301 0.141651 0.894846 Br\n0.529811 0.470189 0.207818 Br\n0.716699 0.858349 0.394846 Br\n0.858349 0.141651 0.894846 Br\n0.333333 0.666667 0.099395 O\n0.666667 0.333333 0.599395 O\n","nsites":22,"nelements":3,"elements":["Ba","Br","O"],"chemical_system":"Ba-Br-O","density":4.675725201869476,"density_atomic":0.02964748916660778,"volume":742.0527207672881,"volume_molar":20.312481526370835,"formula_full":"Ba8 Br12 O2","formula_reduced":"Ba4Br6O","formula_anonymous":"AB4C6","energy_above_hull":0.0,"spacegroup":186},{"id":"jvasp-42733","created_at":"2022-09-04T14:35:41.873058Z","updated_at":"2022-09-04T14:35:41.873085Z","structure_string":"Li3 Mn5 Cr2 O12\n1.0\n5.003058 0.100319 -0.101636\n2.495485 4.337421 0.101636\n-0.817917 1.382053 9.703920\nLi Mn Cr O\n3 5 2 12\ndirect\n0.330741 0.827592 0.989494 Li\n0.827593 0.330741 0.510506 Li\n0.924019 0.924020 0.750000 Li\n0.064698 0.064698 0.250000 Mn\n0.415087 0.415087 0.250000 Mn\n0.577946 0.577946 0.750000 Mn\n0.507734 0.010840 0.511307 Mn\n0.010840 0.507733 0.988693 Mn\n0.255257 0.255257 0.750000 Cr\n0.764145 0.764146 0.250000 Cr\n0.709266 0.465349 0.144847 O\n0.612811 0.853326 0.864130 O\n0.465348 0.709266 0.355153 O\n0.779452 0.044821 0.374128 O\n0.232485 0.963982 0.635139 O\n0.131809 0.358991 0.360356 O\n0.298031 0.542850 0.860299 O\n0.358992 0.131810 0.139644 O\n0.044821 0.779452 0.125872 O\n0.963983 0.232486 0.864861 O\n0.542850 0.298031 0.639701 O\n0.853326 0.612812 0.635870 O\n","nsites":22,"nelements":4,"elements":["Li","Mn","Cr","O"],"chemical_system":"Cr-Li-Mn-O","density":4.751219477645286,"density_atomic":0.10642048413421225,"volume":206.72711817637185,"volume_molar":5.658817293487572,"formula_full":"Li3 Mn5 Cr2 O12","formula_reduced":"Li3Mn5Cr2O12","formula_anonymous":"A2B3C5D12","energy_above_hull":3.4809655912225703,"spacegroup":5},{"id":"jvasp-98204","created_at":"2022-09-04T14:35:42.758036Z","updated_at":"2022-09-04T14:35:42.758059Z","structure_string":"Sc10 In8 Rh4\n1.0\n3.348381 0.000000 0.000000\n0.000000 7.678378 -0.000000\n0.000000 -0.000000 17.563295\nSc In Rh\n10 8 4\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.000000 0.744439 0.779119 Sc\n0.000000 0.255561 0.220881 Sc\n0.000000 0.244439 0.720881 Sc\n0.000000 0.755561 0.279119 Sc\n0.000000 0.875670 0.586056 Sc\n0.000000 0.124330 0.413943 Sc\n0.000000 0.375670 0.913943 Sc\n0.000000 0.624330 0.086057 Sc\n0.500000 0.068534 0.851394 In\n0.500000 0.931466 0.148606 In\n0.500000 0.702824 0.934238 In\n0.500000 0.297176 0.065762 In\n0.500000 0.202824 0.565762 In\n0.500000 0.568534 0.648605 In\n0.500000 0.431466 0.351394 In\n0.500000 0.797176 0.434238 In\n0.500000 0.537541 0.194601 Rh\n0.500000 0.462459 0.805399 Rh\n0.500000 0.037541 0.305399 Rh\n0.500000 0.962459 0.694601 Rh\n","nsites":22,"nelements":3,"elements":["Sc","In","Rh"],"chemical_system":"In-Rh-Sc","density":6.544729096630071,"density_atomic":0.048720566304704116,"volume":451.5546856005209,"volume_molar":12.360572170563099,"formula_full":"Sc10 In8 Rh4","formula_reduced":"Sc5(In2Rh)2","formula_anonymous":"A2B4C5","energy_above_hull":1.7889874663636365,"spacegroup":55},{"id":"jvasp-44556","created_at":"2022-09-04T14:38:15.159908Z","updated_at":"2022-09-04T14:38:15.159936Z","structure_string":"K2 Ti2 P2 C2 O14\n1.0\n0.000000 5.216988 -0.438990\n6.358962 0.000000 0.000000\n0.000000 0.595946 -9.287602\nK Ti P C O\n2 2 2 2 14\ndirect\n0.907024 0.639664 0.153676 K\n0.092977 0.139664 0.846324 K\n0.264268 0.231270 0.338056 Ti\n0.735733 0.731270 0.661944 Ti\n0.296107 0.734411 0.439144 P\n0.703894 0.234411 0.560856 P\n0.473903 0.239125 0.084428 C\n0.526098 0.739125 0.915572 C\n0.399093 0.746625 0.803245 O\n0.735077 0.427834 0.656272 O\n0.738651 0.041246 0.654633 O\n0.088844 0.738302 0.575097 O\n0.434762 0.233213 0.511820 O\n0.565239 0.733213 0.488179 O\n0.600908 0.246625 0.196755 O\n0.261350 0.541245 0.345367 O\n0.264924 0.927834 0.343727 O\n0.783067 0.738142 0.869774 O\n0.216935 0.238142 0.130226 O\n0.429744 0.732313 0.044964 O\n0.911157 0.238303 0.424902 O\n0.570256 0.232313 -0.044964 O\n","nsites":22,"nelements":5,"elements":["K","Ti","P","C","O"],"chemical_system":"C-K-O-P-Ti","density":2.6220340818507446,"density_atomic":0.0717900506737431,"volume":306.44914989656644,"volume_molar":8.38854507481574,"formula_full":"K2 Ti2 P2 C2 O14","formula_reduced":"KTiPCO7","formula_anonymous":"ABCDE7","energy_above_hull":2.9529360303030296,"spacegroup":4},{"id":"jvasp-12087","created_at":"2022-09-04T14:38:18.225876Z","updated_at":"2022-09-04T14:38:18.225885Z","structure_string":"Nb6 Br16\n1.0\n6.875342 -0.006956 11.823066\n3.182436 6.094462 11.823066\n-0.011493 -0.006956 13.676808\nNb Br\n6 16\ndirect\n0.550567 0.145504 0.550567 Nb\n0.145505 0.550565 0.550566 Nb\n0.854496 0.449433 0.449435 Nb\n0.449435 0.854495 0.449434 Nb\n0.449435 0.449433 0.854496 Nb\n0.550567 0.550565 0.145505 Nb\n0.627709 0.118238 0.118239 Br\n0.372293 0.881760 0.881762 Br\n0.881762 0.881760 0.372292 Br\n0.881762 0.372290 0.881762 Br\n0.706139 0.706137 0.205713 Br\n0.635564 0.635562 0.635564 Br\n0.794288 0.293861 0.293863 Br\n0.293863 0.293861 0.794288 Br\n0.293863 0.794287 0.293862 Br\n0.118239 0.627708 0.118239 Br\n0.118239 0.118238 0.627709 Br\n0.214678 0.214678 0.214678 Br\n0.785323 0.785321 0.785323 Br\n0.364437 0.364436 0.364437 Br\n0.205714 0.706137 0.706138 Br\n0.706139 0.205712 0.706139 Br\n","nsites":22,"nelements":2,"elements":["Nb","Br"],"chemical_system":"Br-Nb","density":5.306371990336568,"density_atomic":0.03829320476463326,"volume":574.5144637337512,"volume_molar":15.72639531482075,"formula_full":"Nb6 Br16","formula_reduced":"Nb3Br8","formula_anonymous":"A3B8","energy_above_hull":1.649996458181818,"spacegroup":166},{"id":"jvasp-59276","created_at":"2022-09-04T14:38:08.886513Z","updated_at":"2022-09-04T14:38:08.886543Z","structure_string":"Li2 Ca2 Ta4 O12 F2\n1.0\n7.369841 0.038108 0.013081\n3.717923 6.439632 0.000000\n3.706601 2.153081 5.995125\nLi Ca Ta O F\n2 2 4 12 2\ndirect\n0.500000 0.500000 -0.000000 Li\n-0.000000 0.500000 0.500000 Li\n0.500000 -0.000000 0.500000 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.000000 -0.000000 Ta\n0.000000 0.000000 0.000000 Ta\n-0.000000 -0.000000 0.500000 Ta\n-0.000000 0.500000 0.000000 Ta\n0.677933 0.065998 0.074828 O\n0.074828 0.681239 0.677934 O\n0.074828 0.065998 0.677934 O\n0.324969 0.925030 0.324970 O\n0.677933 0.681239 0.074828 O\n0.675030 0.074970 0.675031 O\n0.925172 0.318760 0.322066 O\n0.322066 0.934001 0.925173 O\n0.925171 0.934002 0.322066 O\n0.934586 0.315413 0.934587 O\n0.065413 0.684586 0.065414 O\n0.322066 0.318759 0.925173 O\n0.632614 0.617385 0.632615 F\n0.367385 0.382614 0.367386 F\n","nsites":22,"nelements":5,"elements":["Li","Ca","Ta","O","F"],"chemical_system":"Ca-F-Li-O-Ta","density":6.138104748218685,"density_atomic":0.07761069226992987,"volume":283.46609670074884,"volume_molar":7.759421522816733,"formula_full":"Li2 Ca2 Ta4 O12 F2","formula_reduced":"LiCaTa2O6F","formula_anonymous":"ABCD2E6","energy_above_hull":2.7906309184090903,"spacegroup":74},{"id":"jvasp-44433","created_at":"2022-09-04T14:38:10.484726Z","updated_at":"2022-09-04T14:38:10.484756Z","structure_string":"Li10 W2 N2 O8\n1.0\n4.595018 2.455129 0.000000\n-4.595018 2.455129 0.000000\n0.000000 0.000000 9.626159\nLi W N O\n10 2 2 8\ndirect\n0.234708 0.800034 0.995572 Li\n0.199967 0.765292 0.495572 Li\n0.438163 0.823535 0.743201 Li\n0.176465 0.561837 0.243201 Li\n0.427176 0.427176 0.472946 Li\n0.572824 0.572824 0.972946 Li\n0.823535 0.438163 0.743201 Li\n0.561837 0.176465 0.243201 Li\n0.800034 0.234708 0.995572 Li\n0.765292 0.199967 0.495572 Li\n0.182590 0.182590 0.751036 W\n0.817410 0.817410 0.251036 W\n0.178533 0.178533 0.267556 N\n0.821467 0.821467 0.767556 N\n0.541908 0.837938 0.379622 O\n0.162062 0.458092 0.879622 O\n0.578772 0.871840 0.111071 O\n0.128160 0.421228 0.611071 O\n0.871840 0.578772 0.111071 O\n0.421228 0.128160 0.611071 O\n0.837938 0.541908 0.379622 O\n0.458092 0.162062 0.879622 O\n","nsites":22,"nelements":4,"elements":["Li","W","N","O"],"chemical_system":"Li-N-O-W","density":4.534521199582258,"density_atomic":0.101292693821155,"volume":217.19236768294238,"volume_molar":5.945286409928882,"formula_full":"Li10 W2 N2 O8","formula_reduced":"Li5WNO4","formula_anonymous":"ABC4D5","energy_above_hull":2.692517022727273,"spacegroup":36},{"id":"jvasp-52088","created_at":"2022-09-04T14:38:07.390258Z","updated_at":"2022-09-04T14:38:07.390282Z","structure_string":"Ho4 Ru4 O14\n1.0\n6.211430 -0.000000 3.586171\n2.070477 5.856193 3.586171\n-0.000000 -0.000000 7.172342\nHo Ru O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.500000 0.500000 Ho\n0.500000 0.000000 0.500000 Ho\n0.500000 0.500000 -0.000000 Ho\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.500000 0.000000 -0.000000 Ru\n0.000000 0.500000 -0.000000 Ru\n0.625000 0.625000 0.625000 O\n0.375000 0.375000 0.375000 O\n0.335490 0.914510 0.914510 O\n0.914511 0.335489 0.335489 O\n0.914511 0.914510 0.335489 O\n0.335490 0.335489 0.914510 O\n0.335490 0.914510 0.335489 O\n0.085490 0.664510 0.085489 O\n0.664511 0.085489 0.664510 O\n0.664511 0.085489 0.085489 O\n0.085489 0.085489 0.664510 O\n0.664511 0.664510 0.085489 O\n0.914511 0.335489 0.914510 O\n0.085490 0.664510 0.664510 O\n","nsites":22,"nelements":3,"elements":["Ho","Ru","O"],"chemical_system":"Ho-O-Ru","density":8.19774855627893,"density_atomic":0.08432468246542622,"volume":260.8963278221673,"volume_molar":7.141610954146344,"formula_full":"Ho4 Ru4 O14","formula_reduced":"Ho2Ru2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.935076057575757,"spacegroup":227},{"id":"jvasp-53210","created_at":"2022-09-04T14:38:13.522969Z","updated_at":"2022-09-04T14:38:13.522985Z","structure_string":"Nd2 Ti4 Cd2 O12 F2\n1.0\n6.254675 0.162243 3.692904\n2.184977 6.180049 3.784492\n0.070812 0.162243 7.263158\nNd Ti Cd O F\n2 4 2 12 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.500000 -0.000000 Nd\n0.000000 0.500000 0.500000 Ti\n0.500000 0.500000 -0.000000 Ti\n0.500000 -0.000000 0.500000 Ti\n0.500000 0.500000 0.500000 Ti\n-0.000000 -0.000000 0.500000 Cd\n0.500000 -0.000000 -0.000000 Cd\n0.824372 0.819970 0.419315 O\n0.832659 0.417340 0.832660 O\n0.419315 0.819970 0.824373 O\n0.824372 0.436341 0.419316 O\n0.409276 0.840724 0.409275 O\n0.419315 0.436341 0.824373 O\n0.175628 0.563659 0.580685 O\n0.590724 0.159275 0.590725 O\n0.580684 0.180029 0.175628 O\n0.175627 0.180029 0.580685 O\n0.167341 0.582660 0.167340 O\n0.580684 0.563659 0.175627 O\n0.122785 0.127215 0.122785 F\n0.877214 0.872785 0.877215 F\n","nsites":22,"nelements":5,"elements":["Nd","Ti","Cd","O","F"],"chemical_system":"Cd-F-Nd-O-Ti","density":5.663499218583471,"density_atomic":0.08027062284711287,"volume":274.0728702442264,"volume_molar":7.502297286854305,"formula_full":"Nd2 Ti4 Cd2 O12 F2","formula_reduced":"NdTi2CdO6F","formula_anonymous":"ABCD2E6","energy_above_hull":2.117915381742424,"spacegroup":74},{"id":"jvasp-29246","created_at":"2022-09-04T14:38:05.196581Z","updated_at":"2022-09-04T14:38:05.196609Z","structure_string":"Th6 Co1 Br15\n1.0\n9.418296 -0.000000 -3.329871\n-4.709147 8.156484 -3.329871\n0.000000 0.000000 9.989611\nTh Co Br\n6 1 15\ndirect\n-0.000000 0.240691 0.240691 Th\n0.759309 0.000000 0.759308 Th\n0.759308 0.759308 -0.000000 Th\n0.240692 0.240691 -0.000000 Th\n-0.000000 0.759308 0.759308 Th\n0.240692 0.000000 0.240692 Th\n0.000000 0.000000 0.000000 Co\n0.509144 0.254572 0.254573 Br\n-0.000000 0.254572 0.745427 Br\n0.745428 0.000000 0.254573 Br\n0.254572 0.745427 -0.000000 Br\n0.745428 0.254572 0.000000 Br\n0.254573 0.254572 0.509144 Br\n-0.000000 0.745427 0.254572 Br\n0.745427 0.745427 0.490856 Br\n0.490856 0.745427 0.745427 Br\n0.745428 0.490856 0.745427 Br\n-0.000000 0.500000 0.500000 Br\n0.500000 0.000000 0.500000 Br\n0.500000 0.500000 -0.000000 Br\n0.254572 0.509144 0.254572 Br\n0.254573 -0.000000 0.745427 Br\n","nsites":22,"nelements":3,"elements":["Th","Co","Br"],"chemical_system":"Br-Co-Th","density":5.733574173110812,"density_atomic":0.028668091364291905,"volume":767.4037214560619,"volume_molar":21.00642377434653,"formula_full":"Th6 Co1 Br15","formula_reduced":"Th6CoBr15","formula_anonymous":"AB6C15","energy_above_hull":1.2133639125000002,"spacegroup":229},{"id":"jvasp-55816","created_at":"2022-09-04T14:38:13.504475Z","updated_at":"2022-09-04T14:38:13.504496Z","structure_string":"Lu4 V4 O14\n1.0\n6.071406 -0.000000 3.505328\n2.023802 5.724176 3.505328\n-0.000000 -0.000000 7.010655\nLu V O\n4 4 14\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499999 0.000000 -0.000000 Lu\n0.000001 0.499999 1.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.500000 0.499999 0.500001 V\n0.500000 0.499999 0.000001 V\n0.000001 0.499999 0.500000 V\n0.499999 0.000000 0.500000 V\n0.582499 0.167502 0.582498 O\n0.167501 0.582498 0.167502 O\n0.167502 0.167502 0.582498 O\n0.875000 0.875002 0.875000 O\n0.417503 0.417503 0.832498 O\n0.832498 0.417503 0.417502 O\n0.417502 0.832499 0.417502 O\n0.832498 0.417503 0.832498 O\n0.417502 0.832499 0.832498 O\n0.582499 0.582498 0.167502 O\n0.832499 0.832499 0.417501 O\n0.125001 0.124999 0.124999 O\n0.582499 0.167502 0.167502 O\n0.167501 0.582498 0.582498 O\n","nsites":22,"nelements":3,"elements":["Lu","V","O"],"chemical_system":"Lu-O-V","density":7.6851646209726825,"density_atomic":0.09029461097724217,"volume":243.64687728202153,"volume_molar":6.669435412394455,"formula_full":"Lu4 V4 O14","formula_reduced":"Lu2V2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.8184576727272725,"spacegroup":227}]}