{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=589","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=587","results":[{"id":"jvasp-110085","created_at":"2022-09-04T14:38:19.750984Z","updated_at":"2022-09-04T14:38:19.751003Z","structure_string":"Nd1 P2 Pd2\n1.0\n3.894813 -0.010909 -4.302321\n-0.586529 3.850412 -4.302321\n0.009400 0.010909 5.803400\nNd P Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.387033 0.387033 -0.000000 P\n0.612966 0.612966 -0.000001 P\n0.749999 0.250000 0.500000 Pd\n0.250000 0.750000 0.500000 Pd\n","nsites":5,"nelements":3,"elements":["Nd","P","Pd"],"chemical_system":"Nd-P-Pd","density":7.9648390165136576,"density_atomic":0.05723389278980855,"volume":87.36082339117658,"volume_molar":10.52198350742332,"formula_full":"Nd1 P2 Pd2","formula_reduced":"Nd(PPd)2","formula_anonymous":"AB2C2","energy_above_hull":2.13554278,"spacegroup":139},{"id":"jvasp-110086","created_at":"2022-09-04T14:38:26.249330Z","updated_at":"2022-09-04T14:38:26.249350Z","structure_string":"Th2 Co2 Si4\n1.0\n8.495406 -0.005704 0.000000\n-7.488193 4.012346 0.000000\n-0.000000 0.000000 4.100953\nTh Co Si\n2 2 4\ndirect\n0.608125 0.391878 0.749999 Th\n0.391878 0.608124 0.250000 Th\n0.820318 0.179684 0.749999 Co\n0.179685 0.820318 0.250000 Co\n0.958790 0.041212 0.749999 Si\n0.041212 0.958790 0.250000 Si\n0.250402 0.749601 0.749999 Si\n0.749601 0.250401 0.250000 Si\n","nsites":8,"nelements":3,"elements":["Th","Co","Si"],"chemical_system":"Co-Si-Th","density":8.257789474696803,"density_atomic":0.05730166222519478,"volume":139.6120058186114,"volume_molar":10.509539385320211,"formula_full":"Th2 Co2 Si4","formula_reduced":"ThCoSi2","formula_anonymous":"ABC2","energy_above_hull":3.026150925,"spacegroup":63},{"id":"jvasp-110087","created_at":"2022-09-04T14:38:27.188774Z","updated_at":"2022-09-04T14:38:27.188784Z","structure_string":"Sr2 Ca1 Os1 O6\n1.0\n5.063115 -0.000000 2.923191\n1.687705 4.773551 2.923191\n-0.000000 -0.000000 5.846382\nSr Ca Os O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750001 0.750000 0.749999 Sr\n0.500001 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Os\n0.767044 0.232956 0.232956 O\n0.232957 0.767043 0.767043 O\n0.232957 0.767043 0.232956 O\n0.767044 0.232956 0.767043 O\n0.232957 0.232956 0.767043 O\n0.767045 0.767043 0.232955 O\n","nsites":10,"nelements":4,"elements":["Sr","Ca","Os","O"],"chemical_system":"Ca-O-Os-Sr","density":5.89402448864182,"density_atomic":0.07077069373270692,"volume":141.30142679919027,"volume_molar":8.5093708177356,"formula_full":"Sr2 Ca1 Os1 O6","formula_reduced":"Sr2CaOsO6","formula_anonymous":"ABC2D6","energy_above_hull":2.0122379040000005,"spacegroup":225},{"id":"jvasp-110088","created_at":"2022-09-04T14:38:17.970711Z","updated_at":"2022-09-04T14:38:17.970746Z","structure_string":"Pr2 Ag2 Ge2\n1.0\n4.569351 0.000000 0.000000\n-2.284675 3.957174 0.000000\n-0.000000 -0.000000 7.717705\nPr Ag Ge\n2 2 2\ndirect\n0.000000 0.000000 0.012790 Pr\n0.000000 0.000000 0.512789 Pr\n0.666666 0.333333 0.284881 Ag\n0.333332 0.666666 0.784881 Ag\n0.666666 0.333333 0.725129 Ge\n0.333332 0.666666 0.225129 Ge\n","nsites":6,"nelements":3,"elements":["Pr","Ag","Ge"],"chemical_system":"Ag-Ge-Pr","density":7.6492444696745565,"density_atomic":0.042995540126553274,"volume":139.5493574993958,"volume_molar":14.006431230482052,"formula_full":"Pr2 Ag2 Ge2","formula_reduced":"PrAgGe","formula_anonymous":"ABC","energy_above_hull":0.4415143533333332,"spacegroup":186},{"id":"jvasp-11009","created_at":"2022-09-04T14:37:10.167361Z","updated_at":"2022-09-04T14:37:10.167382Z","structure_string":"Y4 Cu4 S8\n1.0\n3.962986 0.000000 0.000000\n0.000000 6.272162 0.000000\n0.000000 0.000000 13.429740\nY Cu S\n4 4 8\ndirect\n0.249752 0.750724 0.633770 Y\n0.749752 0.749275 0.366230 Y\n0.750249 0.250724 0.866230 Y\n0.250249 0.249276 0.133770 Y\n0.750496 0.627907 0.046713 Cu\n0.249505 0.127907 0.453287 Cu\n0.250496 0.872093 0.953287 Cu\n0.749505 0.372093 0.546713 Cu\n0.749775 0.511380 0.705521 S\n0.249774 0.988620 0.294479 S\n0.250226 0.011380 0.794479 S\n0.750227 0.488620 0.205521 S\n0.749721 0.994730 0.539982 S\n0.750280 0.005270 0.039982 S\n0.250280 0.494730 0.960018 S\n0.249721 0.505270 0.460018 S\n","nsites":16,"nelements":3,"elements":["Y","Cu","S"],"chemical_system":"Cu-S-Y","density":4.309468771745185,"density_atomic":0.047930567687444435,"volume":333.81620064122984,"volume_molar":12.564300926436802,"formula_full":"Y4 Cu4 S8","formula_reduced":"YCuS2","formula_anonymous":"ABC2","energy_above_hull":1.1904739749999995,"spacegroup":62},{"id":"jvasp-110090","created_at":"2022-09-04T14:37:54.975069Z","updated_at":"2022-09-04T14:37:54.975092Z","structure_string":"Mn3 P3 Pd3\n1.0\n6.380357 -0.000000 0.000000\n-3.190177 5.525551 0.000000\n0.000000 -0.000000 3.623379\nMn P Pd\n3 3 3\ndirect\n0.602890 0.000000 -0.000000 Mn\n-0.000000 0.602889 -0.000000 Mn\n0.397111 0.397111 -0.000000 Mn\n0.333333 0.666666 0.500000 P\n0.666667 0.333333 0.500000 P\n0.000000 0.000000 0.000000 P\n0.267289 0.000000 0.500000 Pd\n-0.000000 0.267288 0.500000 Pd\n0.732712 0.732711 0.500000 Pd\n","nsites":9,"nelements":3,"elements":["Mn","P","Pd"],"chemical_system":"Mn-P-Pd","density":7.500446712578567,"density_atomic":0.07045440884611988,"volume":127.74218317063709,"volume_molar":8.547571200480885,"formula_full":"Mn3 P3 Pd3","formula_reduced":"MnPPd","formula_anonymous":"ABC","energy_above_hull":2.533662813793104,"spacegroup":189},{"id":"jvasp-110091","created_at":"2022-09-04T14:37:58.959170Z","updated_at":"2022-09-04T14:37:58.959191Z","structure_string":"K1 Co2 P2\n1.0\n3.522550 -0.033407 -6.085984\n-0.282864 3.511334 -6.085984\n0.031119 0.033407 7.031827\nK Co P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.750000 0.250000 0.500001 Co\n0.250001 0.749999 0.500001 Co\n0.342811 0.342810 0.000000 P\n0.657190 0.657189 0.000000 P\n","nsites":5,"nelements":3,"elements":["K","Co","P"],"chemical_system":"Co-K-P","density":4.11426170979939,"density_atomic":0.05659040830963521,"volume":88.35419551388338,"volume_molar":10.641628042423324,"formula_full":"K1 Co2 P2","formula_reduced":"K(CoP)2","formula_anonymous":"AB2C2","energy_above_hull":2.3391361600000007,"spacegroup":139},{"id":"jvasp-110092","created_at":"2022-09-04T14:38:01.707476Z","updated_at":"2022-09-04T14:38:01.707505Z","structure_string":"Ce1 In1 Ni4\n1.0\n4.340591 0.000000 2.506042\n1.446864 4.092349 2.506042\n0.000000 0.000000 5.012083\nCe In Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.250000 0.250000 0.250000 In\n0.623900 0.623901 0.623900 Ni\n0.623900 0.623901 0.128298 Ni\n0.623900 0.128298 0.623900 Ni\n0.128297 0.623901 0.623900 Ni\n","nsites":6,"nelements":3,"elements":["Ce","In","Ni"],"chemical_system":"Ce-In-Ni","density":9.133687697165021,"density_atomic":0.0673924843999354,"volume":89.03069909685287,"volume_molar":8.935923365374215,"formula_full":"Ce1 In1 Ni4","formula_reduced":"CeInNi4","formula_anonymous":"ABC4","energy_above_hull":1.0098441783333332,"spacegroup":216},{"id":"jvasp-110093","created_at":"2022-09-04T14:38:17.354890Z","updated_at":"2022-09-04T14:38:17.354917Z","structure_string":"Tb2 Cu2 Sn2\n1.0\n4.532513 0.000000 0.000000\n-2.266257 3.925271 0.000000\n-0.000000 -0.000000 7.302506\nTb Cu Sn\n2 2 2\ndirect\n0.000000 0.000000 0.036022 Tb\n0.000000 0.000000 0.536022 Tb\n0.666666 0.333333 0.713730 Cu\n0.333333 0.666667 0.213730 Cu\n0.666666 0.333333 0.305249 Sn\n0.333333 0.666667 0.805249 Sn\n","nsites":6,"nelements":3,"elements":["Tb","Cu","Sn"],"chemical_system":"Cu-Sn-Tb","density":8.721350685553546,"density_atomic":0.046181775290949655,"volume":129.92138050560897,"volume_molar":13.040080685638285,"formula_full":"Tb2 Cu2 Sn2","formula_reduced":"TbCuSn","formula_anonymous":"ABC","energy_above_hull":0.2086868500000001,"spacegroup":186},{"id":"jvasp-110095","created_at":"2022-09-04T14:38:18.284073Z","updated_at":"2022-09-04T14:38:18.284093Z","structure_string":"Sr2 As2 Au2\n1.0\n4.534924 0.000000 0.000000\n-2.267462 3.927360 0.000000\n-0.000000 -0.000000 8.455888\nSr As Au\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.333333 0.666667 0.250000 As\n0.666666 0.333333 0.750000 As\n0.333333 0.666667 0.750000 Au\n0.666666 0.333333 0.250000 Au\n","nsites":6,"nelements":3,"elements":["Sr","As","Au"],"chemical_system":"As-Au-Sr","density":7.927895346917478,"density_atomic":0.03984018098307942,"volume":150.60172549287034,"volume_molar":15.11574649361576,"formula_full":"Sr2 As2 Au2","formula_reduced":"SrAsAu","formula_anonymous":"ABC","energy_above_hull":0.3105385433333334,"spacegroup":194},{"id":"jvasp-110096","created_at":"2022-09-04T14:38:18.917310Z","updated_at":"2022-09-04T14:38:18.917343Z","structure_string":"Sr2 Cl2 O2\n1.0\n4.226384 0.000000 0.000000\n-2.113193 3.660156 0.000000\n-0.000000 -0.000000 9.499672\nSr Cl O\n2 2 2\ndirect\n0.666666 0.333334 0.437295 Sr\n0.333334 0.666667 0.937295 Sr\n0.666666 0.333334 0.747320 Cl\n0.333334 0.666667 0.247320 Cl\n0.000000 0.000000 0.988195 O\n0.000000 0.000000 0.488196 O\n","nsites":6,"nelements":3,"elements":["Sr","Cl","O"],"chemical_system":"Cl-O-Sr","density":3.1429891562499868,"density_atomic":0.04082950271793397,"volume":146.95256127536808,"volume_molar":14.749483484046527,"formula_full":"Sr2 Cl2 O2","formula_reduced":"SrClO","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":186},{"id":"jvasp-110097","created_at":"2022-09-04T14:38:20.193225Z","updated_at":"2022-09-04T14:38:20.193245Z","structure_string":"Rb2 Fe1 F4\n1.0\n4.060243 0.076815 -6.299346\n-0.287576 4.050774 -6.299346\n-0.070210 -0.076815 7.494158\nRb Fe F\n2 1 4\ndirect\n0.353294 0.353294 -0.000002 Rb\n0.646704 0.646704 -0.000003 Rb\n0.000000 0.000000 0.000000 Fe\n0.150757 0.150757 -0.000001 F\n0.849241 0.849241 -0.000004 F\n0.500000 -0.000000 0.500000 F\n-0.000001 0.500000 0.499999 F\n","nsites":7,"nelements":3,"elements":["Rb","Fe","F"],"chemical_system":"F-Fe-Rb","density":4.205103532763068,"density_atomic":0.05854728383723391,"volume":119.56148161305919,"volume_molar":10.285943882114204,"formula_full":"Rb2 Fe1 F4","formula_reduced":"Rb2FeF4","formula_anonymous":"AB2C4","energy_above_hull":0.0632245476190475,"spacegroup":139}]}