{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=79","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=77","results":[{"id":"jvasp-94903","created_at":"2022-09-04T14:36:31.868536Z","updated_at":"2022-09-04T14:36:31.868563Z","structure_string":"In2 Ni3 Se2\n1.0\n-4.814592 -0.000000 2.615198\n-3.117561 4.505594 0.000000\n-4.800564 0.009707 -3.098418\nIn Ni Se\n2 3 2\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 Ni\n-0.000000 0.500000 0.500000 Ni\n-0.000001 0.000000 0.500000 Ni\n0.716531 0.716531 0.850406 Se\n0.283469 0.283469 0.149593 Se\n","nsites":7,"nelements":3,"elements":["In","Ni","Se"],"chemical_system":"In-Ni-Se","density":7.5662854016316015,"density_atomic":0.05658909951896899,"volume":123.69873455317239,"volume_molar":10.641874161615425,"formula_full":"In2 Ni3 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O\n","nsites":14,"nelements":3,"elements":["K","Mn","O"],"chemical_system":"K-Mn-O","density":3.46782384865378,"density_atomic":0.06192464622930203,"volume":226.08122698285777,"volume_molar":9.724949800601996,"formula_full":"K4 Mn4 O6","formula_reduced":"K2Mn2O3","formula_anonymous":"A2B2C3","energy_above_hull":2.0525687118226603,"spacegroup":14},{"id":"jvasp-112035","created_at":"2022-09-04T14:38:41.176693Z","updated_at":"2022-09-04T14:38:41.176717Z","structure_string":"C6 S4 O4\n1.0\n4.414116 -0.089355 -0.200820\n-0.344800 5.024310 -0.371853\n-0.302712 -0.047335 10.424219\nC S O\n6 4 4\ndirect\n0.669943 0.150463 0.204693 C\n0.669945 0.650464 0.704693 C\n0.159960 0.612603 0.804055 C\n0.159961 0.112605 0.304055 C\n0.369931 0.264249 0.223772 C\n0.369934 0.764247 0.723773 C\n0.250384 0.380097 0.892045 S\n0.250383 0.880100 0.392046 S\n0.722035 0.971397 0.074114 S\n0.722037 0.471397 0.574114 S\n0.303338 0.468002 0.175405 O\n0.303340 0.968000 0.675406 O\n0.872379 0.216352 0.308622 O\n0.872379 0.716348 0.808623 O\n","nsites":14,"nelements":3,"elements":["C","S","O"],"chemical_system":"C-O-S","density":1.9044456167695119,"density_atomic":0.0607455586678063,"volume":230.46952414349374,"volume_molar":9.913713680588128,"formula_full":"C6 S4 O4","formula_reduced":"C3(SO)2","formula_anonymous":"A2B2C3","energy_above_hull":4.347975285714286,"spacegroup":1},{"id":"jvasp-59041","created_at":"2022-09-04T14:38:36.014975Z","updated_at":"2022-09-04T14:38:36.014987Z","structure_string":"Na8 Mn8 Se12\n1.0\n6.817322 0.014772 2.446672\n3.361555 9.779207 1.144312\n0.060287 -0.145229 10.402773\nNa Mn Se\n8 8 12\ndirect\n0.356929 0.191133 0.021843 Na\n0.143070 0.978158 0.808866 Na\n0.643070 0.808867 0.978157 Na\n0.856929 0.021842 0.191133 Na\n0.250000 0.280349 0.719651 Na\n0.749999 0.719651 0.280349 Na\n0.250000 0.569458 0.430542 Na\n0.750000 0.430542 0.569458 Na\n0.203089 0.634161 0.786428 Mn\n0.296911 0.213571 0.365839 Mn\n0.703089 0.786429 0.634160 Mn\n0.796910 0.365839 0.213571 Mn\n0.758040 0.082224 0.554881 Mn\n0.258040 0.554882 0.082225 Mn\n0.241959 0.917775 0.445118 Mn\n0.741960 0.445118 0.917775 Mn\n0.566425 0.279676 0.429950 Se\n0.450566 0.996240 0.224757 Se\n0.049433 0.775243 0.003760 Se\n0.549434 0.003759 0.775243 Se\n0.950567 0.224757 0.996240 Se\n0.448764 0.413697 0.852378 Se\n0.051236 0.147622 0.586303 Se\n0.551236 0.586303 0.147622 Se\n0.948763 0.852378 0.413697 Se\n0.433575 0.720324 0.570050 Se\n0.066424 0.429950 0.279676 Se\n0.933575 0.570050 0.720324 Se\n","nsites":28,"nelements":3,"elements":["Na","Mn","Se"],"chemical_system":"Mn-Na-Se","density":3.7723267005045713,"density_atomic":0.04049094738871505,"volume":691.512592461684,"volume_molar":14.872807746845629,"formula_full":"Na8 Mn8 Se12","formula_reduced":"Na2Mn2Se3","formula_anonymous":"A2B2C3","energy_above_hull":1.7328632261083747,"spacegroup":15},{"id":"jvasp-35446","created_at":"2022-09-04T14:37:55.334387Z","updated_at":"2022-09-04T14:37:55.334408Z","structure_string":"Pu2 W2 C3\n1.0\n0.000000 3.289951 0.000000\n-0.193470 0.000000 5.684308\n5.575675 -1.644976 -2.174520\nPu W C\n2 2 3\ndirect\n0.394981 0.192523 0.789965 Pu\n0.605017 0.807477 0.210036 Pu\n0.155979 0.327438 0.311960 W\n0.844019 0.672562 0.688041 W\n0.251111 0.744684 0.502223 C\n0.748888 0.255317 0.497778 C\n0.000000 0.000000 0.000000 C\n","nsites":7,"nelements":3,"elements":["Pu","W","C"],"chemical_system":"C-Pu-W","density":14.391720130402566,"density_atomic":0.06803572038961064,"volume":102.88712987698344,"volume_molar":8.851439693022796,"formula_full":"Pu2 W2 C3","formula_reduced":"Pu2W2C3","formula_anonymous":"A2B2C3","energy_above_hull":8.068265714285715,"spacegroup":12},{"id":"jvasp-16695","created_at":"2022-09-04T14:37:54.886425Z","updated_at":"2022-09-04T14:37:54.886443Z","structure_string":"Tm2 Al3 Si2\n1.0\n4.021032 0.000000 0.000000\n-2.010516 4.958907 -0.917088\n0.000000 -0.000312 6.588749\nTm Al Si\n2 3 2\ndirect\n0.381004 0.762011 0.678269 Tm\n0.618995 0.237990 0.321731 Tm\n0.695278 0.390558 0.866556 Al\n0.000000 0.000000 0.000000 Al\n0.304722 0.609444 0.133444 Al\n0.905242 0.810486 0.362112 Si\n0.094757 0.189515 0.637888 Si\n","nsites":7,"nelements":3,"elements":["Tm","Al","Si"],"chemical_system":"Al-Si-Tm","density":6.003513034267039,"density_atomic":0.05328137049683429,"volume":131.37800200570862,"volume_molar":11.302526012084853,"formula_full":"Tm2 Al3 Si2","formula_reduced":"Tm2Al3Si2","formula_anonymous":"A2B2C3","energy_above_hull":2.2125734428571424,"spacegroup":12},{"id":"jvasp-57760","created_at":"2022-09-04T14:37:10.160077Z","updated_at":"2022-09-04T14:37:10.160096Z","structure_string":"Cu4 Ag4 O6\n1.0\n5.369980 0.000000 -2.590306\n-1.249481 5.222593 -2.590306\n-0.024034 -0.030462 6.811598\nCu Ag O\n4 4 6\ndirect\n0.500000 0.500000 0.500000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.500000 0.500000 -0.000001 Cu\n0.000000 0.500000 0.500000 Cu\n-0.000000 0.500000 -0.000000 Ag\n0.000000 0.000000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n0.625000 0.375000 0.249999 O\n0.375001 0.625000 0.750000 O\n0.613809 0.863808 0.227616 O\n0.863809 0.613808 0.727617 O\n0.136192 0.386191 0.272383 O\n0.386192 0.136192 0.772383 O\n","nsites":14,"nelements":3,"elements":["Cu","Ag","O"],"chemical_system":"Ag-Cu-O","density":6.824741833967524,"density_atomic":0.0736124132602829,"volume":190.18531494814627,"volume_molar":8.180876693590493,"formula_full":"Cu4 Ag4 O6","formula_reduced":"Cu2Ag2O3","formula_anonymous":"A2B2C3","energy_above_hull":0.8839922742857145,"spacegroup":141},{"id":"jvasp-10263","created_at":"2022-09-04T14:38:32.118009Z","updated_at":"2022-09-04T14:38:32.118041Z","structure_string":"K4 Sn4 O6\n1.0\n6.827227 0.000000 -2.413789\n-3.413614 5.912552 -2.413789\n-0.000000 -0.000000 7.241368\nK Sn O\n4 4 6\ndirect\n0.474906 0.500000 -0.000000 K\n0.025095 0.025095 0.025095 K\n0.000000 0.474905 0.500000 K\n0.500000 0.000000 0.474906 K\n0.500000 -0.000000 0.002036 Sn\n0.000000 0.002036 0.500000 Sn\n0.497964 0.497964 0.497964 Sn\n0.002036 0.500000 -0.000000 Sn\n0.750001 0.975586 0.225587 O\n0.250000 0.524413 0.274413 O\n0.975587 0.225587 0.750000 O\n0.225587 0.750000 0.975587 O\n0.274414 0.250000 0.524414 O\n0.524414 0.274413 0.250000 O\n","nsites":14,"nelements":3,"elements":["K","Sn","O"],"chemical_system":"K-O-Sn","density":4.131242705507656,"density_atomic":0.04789477096757769,"volume":292.30748403572665,"volume_molar":12.573691529032848,"formula_full":"K4 Sn4 O6","formula_reduced":"K2Sn2O3","formula_anonymous":"A2B2C3","energy_above_hull":0.7801542714285715,"spacegroup":199},{"id":"jvasp-109155","created_at":"2022-09-04T14:38:20.149278Z","updated_at":"2022-09-04T14:38:20.149298Z","structure_string":"Ni3 Sb2 Te2\n1.0\n5.619420 0.014200 3.306186\n4.208398 3.723905 3.306186\n-0.002766 -0.001052 6.782741\nNi Sb Te\n3 2 2\ndirect\n0.254510 0.254511 0.736878 Ni\n0.746380 0.746379 0.262480 Ni\n0.996219 0.996216 0.002566 Ni\n0.876013 0.876012 0.463971 Sb\n0.369697 0.369698 0.964988 Sb\n0.126413 0.126413 0.532575 Te\n0.628009 0.628008 0.036549 Te\n","nsites":7,"nelements":3,"elements":["Ni","Sb","Te"],"chemical_system":"Ni-Sb-Te","density":7.915016663141946,"density_atomic":0.049445363436111764,"volume":141.57040243105268,"volume_molar":12.179384155566366,"formula_full":"Ni3 Sb2 Te2","formula_reduced":"Ni3(SbTe)2","formula_anonymous":"A2B2C3","energy_above_hull":1.2989364190476194,"spacegroup":8},{"id":"jvasp-46065","created_at":"2022-09-04T14:38:10.636276Z","updated_at":"2022-09-04T14:38:10.636292Z","structure_string":"K8 Mg8 O12\n1.0\n6.443983 -0.000000 -0.000000\n-0.000000 6.443983 -0.000000\n-0.000000 0.000000 10.306069\nK Mg O\n8 8 12\ndirect\n0.932411 0.735835 0.360195 K\n0.264165 0.067589 0.139805 K\n0.235835 0.567589 0.610195 K\n0.567589 0.235835 0.389805 K\n0.432411 0.764165 0.889805 K\n0.764165 0.432411 0.110195 K\n0.735835 0.932411 0.639805 K\n0.067589 0.264165 0.860195 K\n0.072138 0.222335 0.382513 Mg\n0.777664 0.927862 0.117487 Mg\n0.427862 0.722335 0.367487 Mg\n0.722335 0.427862 0.632513 Mg\n0.277665 0.572138 0.132513 Mg\n0.222335 0.072138 0.617487 Mg\n0.927862 0.777664 0.882513 Mg\n0.572138 0.277665 0.867487 Mg\n0.618670 0.618670 0.500000 O\n0.970405 0.263170 0.565587 O\n0.381329 0.381329 0.000000 O\n0.236830 0.470405 0.315587 O\n0.263170 0.970405 0.434414 O\n0.118671 0.881329 0.750000 O\n0.529595 0.763170 0.184414 O\n0.470405 0.236830 0.684414 O\n0.881329 0.118671 0.250000 O\n0.736830 0.029595 0.934414 O\n0.763170 0.529595 0.815587 O\n0.029595 0.736830 0.065587 O\n","nsites":28,"nelements":3,"elements":["K","Mg","O"],"chemical_system":"K-Mg-O","density":2.713067661436921,"density_atomic":0.06542688042866313,"volume":427.95865883486886,"volume_molar":9.204383153444278,"formula_full":"K8 Mg8 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