{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=81","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=79","results":[{"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-12525","created_at":"2022-09-04T14:36:47.808237Z","updated_at":"2022-09-04T14:36:47.808254Z","structure_string":"Hg6 S4 Cl4\n1.0\n7.392435 0.000000 -2.613621\n-3.696218 6.402037 -2.613621\n0.000000 0.000000 7.840862\nHg S Cl\n6 4 4\ndirect\n0.750000 0.945212 0.195212 Hg\n0.304789 0.250000 0.554788 Hg\n0.554789 0.304789 0.250000 Hg\n0.195212 0.750000 0.945212 Hg\n0.945212 0.195212 0.750000 Hg\n0.250000 0.554789 0.304789 Hg\n-0.000000 0.964441 0.500000 S\n0.500000 -0.000000 0.964440 S\n0.964441 0.500000 0.000000 S\n0.535560 0.535560 0.535560 S\n-0.000000 0.478691 0.500000 Cl\n0.500000 -0.000000 0.478691 Cl\n0.021309 0.021309 0.021309 Cl\n0.478691 0.500000 0.000000 Cl\n","nsites":14,"nelements":3,"elements":["Hg","S","Cl"],"chemical_system":"Cl-Hg-S","density":6.594209523888969,"density_atomic":0.037727543718781766,"volume":371.08167190408506,"volume_molar":15.96218615473241,"formula_full":"Hg6 S4 Cl4","formula_reduced":"Hg3(SCl)2","formula_anonymous":"A2B2C3","energy_above_hull":0.0,"spacegroup":199},{"id":"jvasp-5587","created_at":"2022-09-04T14:38:37.866190Z","updated_at":"2022-09-04T14:38:37.866216Z","structure_string":"U3 Si2 C2\n1.0\n3.596336 -0.000000 -0.668751\n-0.124357 3.594185 -0.668751\n-0.207040 -0.214328 8.890968\nU Si C\n3 2 2\ndirect\n0.826377 0.826378 0.652754 U\n0.173623 0.173623 0.347246 U\n0.000000 0.000000 0.000000 U\n0.584151 0.584151 0.168302 Si\n0.415849 0.415849 0.831699 Si\n0.695380 0.695380 0.390759 C\n0.304621 0.304621 0.609242 C\n","nsites":7,"nelements":3,"elements":["U","Si","C"],"chemical_system":"C-Si-U","density":11.58046481294881,"density_atomic":0.061461305719733086,"volume":113.89279674467677,"volume_molar":9.798263622093048,"formula_full":"U3 Si2 C2","formula_reduced":"U3(SiC)2","formula_anonymous":"A2B2C3","energy_above_hull":5.868032171428571,"spacegroup":139},{"id":"jvasp-50339","created_at":"2022-09-04T14:36:19.076547Z","updated_at":"2022-09-04T14:36:19.076569Z","structure_string":"Rb4 Be4 O6\n1.0\n0.000000 4.991001 0.022842\n8.645192 0.000000 0.000000\n0.000000 -2.788671 -5.851076\nRb Be O\n4 4 6\ndirect\n0.225185 0.346802 0.935312 Rb\n0.225185 0.153198 0.435312 Rb\n0.774816 0.846802 0.564689 Rb\n0.774815 0.653198 0.064689 Rb\n0.302467 0.508346 0.503345 Be\n0.697534 0.008346 0.996656 Be\n0.302467 0.991654 0.003345 Be\n0.697534 0.491654 0.496656 Be\n0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.393991 0.942371 0.807321 O\n0.606010 0.442371 0.692681 O\n0.393991 0.557628 0.307320 O\n0.606009 0.057629 0.192681 O\n","nsites":14,"nelements":3,"elements":["Rb","Be","O"],"chemical_system":"Be-O-Rb","density":3.1239284291947014,"density_atomic":0.05557485544956462,"volume":251.9124860829427,"volume_molar":10.836088931378729,"formula_full":"Rb4 Be4 O6","formula_reduced":"Rb2Be2O3","formula_anonymous":"A2B2C3","energy_above_hull":1.1465746714285716,"spacegroup":14},{"id":"jvasp-34327","created_at":"2022-09-04T14:37:11.233375Z","updated_at":"2022-09-04T14:37:11.233394Z","structure_string":"Tl2 Ni3 S2\n1.0\n4.825805 -0.011051 2.935257\n1.644832 4.536852 2.935257\n-0.015800 -0.011051 5.648352\nTl Ni S\n2 3 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500001 Tl\n-0.000000 0.500000 0.500000 Ni\n0.499999 0.500000 0.000001 Ni\n0.499999 0.000000 0.500000 Ni\n0.772594 0.772595 0.772596 S\n0.227405 0.227405 0.227405 S\n","nsites":7,"nelements":3,"elements":["Tl","Ni","S"],"chemical_system":"Ni-S-Tl","density":8.685022510297731,"density_atomic":0.0564144968744634,"volume":124.08158164694404,"volume_molar":10.674810720018998,"formula_full":"Tl2 Ni3 S2","formula_reduced":"Tl2Ni3S2","formula_anonymous":"A2B2C3","energy_above_hull":0.8702946285714288,"spacegroup":166},{"id":"jvasp-35486","created_at":"2022-09-04T14:37:53.651984Z","updated_at":"2022-09-04T14:37:53.651991Z","structure_string":"Dy2 Cr2 C3\n1.0\n0.000000 -3.389055 0.000000\n-4.984875 1.694527 1.430699\n-0.027019 0.000000 -5.559028\nDy Cr C\n2 2 3\ndirect\n0.394954 0.789909 0.683286 Dy\n0.605044 0.210092 0.316714 Dy\n0.157023 0.314047 0.889598 Cr\n0.842975 0.685954 0.110403 Cr\n0.712901 0.425806 0.770788 C\n0.287097 0.574195 0.229212 C\n0.000000 0.000000 0.000000 C\n","nsites":7,"nelements":3,"elements":["Dy","Cr","C"],"chemical_system":"C-Cr-Dy","density":8.210839997753073,"density_atomic":0.0744322048739741,"volume":94.04531293748647,"volume_molar":8.09077303325418,"formula_full":"Dy2 Cr2 C3","formula_reduced":"Dy2Cr2C3","formula_anonymous":"A2B2C3","energy_above_hull":4.912862542857143,"spacegroup":12},{"id":"jvasp-8127","created_at":"2022-09-04T14:36:48.096428Z","updated_at":"2022-09-04T14:36:48.096445Z","structure_string":"K2 Sn2 O3\n1.0\n5.166002 -0.042690 2.779347\n1.641570 4.898434 2.779347\n-0.059848 -0.042690 5.865899\nK Sn O\n2 2 3\ndirect\n0.500000 0.500000 0.500001 K\n0.000000 0.000000 0.000000 K\n0.244311 0.244311 0.244311 Sn\n0.755689 0.755688 0.755691 Sn\n0.000000 0.500000 0.000000 O\n-0.000000 -0.000000 0.500000 O\n0.500000 -0.000000 0.000000 O\n","nsites":7,"nelements":3,"elements":["K","Sn","O"],"chemical_system":"K-O-Sn","density":4.022907575981853,"density_atomic":0.046638808394992994,"volume":150.08959793131206,"volume_molar":12.912295505059516,"formula_full":"K2 Sn2 O3","formula_reduced":"K2Sn2O3","formula_anonymous":"A2B2C3","energy_above_hull":0.7825099857142859,"spacegroup":166},{"id":"jvasp-44231","created_at":"2022-09-04T14:38:08.931809Z","updated_at":"2022-09-04T14:38:08.931837Z","structure_string":"Na4 Ni4 O6\n1.0\n0.000000 5.741578 -0.057673\n5.393984 0.000000 0.000000\n0.000000 -2.939537 -5.376154\nNa Ni O\n4 4 6\ndirect\n0.151844 0.344855 0.892431 Na\n0.151845 0.155145 0.392431 Na\n0.848154 0.844854 0.607568 Na\n0.848155 0.655145 0.107568 Na\n0.341055 0.640966 0.589065 Ni\n0.658944 0.140967 0.910933 Ni\n0.341055 0.859033 0.089066 Ni\n0.658944 0.359033 0.410933 Ni\n-0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.340732 0.930554 0.766310 O\n0.340733 0.569445 0.266310 O\n0.659266 0.430555 0.733688 O\n0.659267 0.069445 0.233689 O\n","nsites":14,"nelements":3,"elements":["Na","Ni","O"],"chemical_system":"Na-Ni-O","density":4.192951873155848,"density_atomic":0.08362510850951403,"volume":167.41383359050852,"volume_molar":7.20135479323756,"formula_full":"Na4 Ni4 O6","formula_reduced":"Na2Ni2O3","formula_anonymous":"A2B2C3","energy_above_hull":1.1346204714285717,"spacegroup":14},{"id":"jvasp-35442","created_at":"2022-09-04T14:37:52.921190Z","updated_at":"2022-09-04T14:37:52.921203Z","structure_string":"U2 W2 C3\n1.0\n0.000000 3.164954 0.000000\n0.210438 0.000000 5.573588\n5.515259 -1.582477 -1.709271\nU W C\n2 2 3\ndirect\n0.603281 0.335534 0.206564 U\n0.396717 0.664467 0.793436 U\n0.845872 0.131513 0.691749 W\n0.154126 0.868487 0.308252 W\n0.252085 0.261234 0.504173 C\n0.747913 0.738767 0.495827 C\n0.000000 0.000000 0.000000 C\n","nsites":7,"nelements":3,"elements":["U","W","C"],"chemical_system":"C-U-W","density":14.842180858601107,"density_atomic":0.071117675451706,"volume":98.42841397077865,"volume_molar":8.467853767365424,"formula_full":"U2 W2 C3","formula_reduced":"U2W2C3","formula_anonymous":"A2B2C3","energy_above_hull":7.442040285714287,"spacegroup":12},{"id":"jvasp-7915","created_at":"2022-09-04T14:37:05.857634Z","updated_at":"2022-09-04T14:37:05.857655Z","structure_string":"In2 Co3 S2\n1.0\n4.651959 -0.011416 2.899941\n1.603827 4.366760 2.899941\n-0.016397 -0.011416 5.481799\nIn Co S\n2 3 2\ndirect\n0.500000 0.499999 0.500000 In\n0.000000 0.000000 0.000000 In\n-0.000000 -0.000000 0.500000 Co\n0.500000 -0.000000 -0.000000 Co\n0.000000 0.500000 -0.000000 Co\n0.722108 0.722106 0.722108 S\n0.277893 0.277892 0.277893 S\n","nsites":7,"nelements":3,"elements":["In","Co","S"],"chemical_system":"Co-In-S","density":6.991284428880429,"density_atomic":0.06263048169348108,"volume":111.76666394262456,"volume_molar":9.615351179115738,"formula_full":"In2 Co3 S2","formula_reduced":"In2Co3S2","formula_anonymous":"A2B2C3","energy_above_hull":2.011690377142857,"spacegroup":166},{"id":"jvasp-7668","created_at":"2022-09-04T14:37:06.371185Z","updated_at":"2022-09-04T14:37:06.371196Z","structure_string":"Sr3 Al2 Ge2\n1.0\n4.150311 -0.000000 -0.883882\n-0.247337 4.693394 -1.161384\n-0.005292 0.017061 10.161096\nSr Al Ge\n3 2 2\ndirect\n0.815120 0.815150 0.630240 Sr\n0.500000 -0.000000 0.000000 Sr\n0.184880 0.184849 0.369761 Sr\n0.933402 0.433432 0.866805 Al\n0.066598 0.566567 0.133195 Al\n0.358070 0.358159 0.716141 Ge\n0.641929 0.641840 0.283860 Ge\n","nsites":7,"nelements":3,"elements":["Sr","Al","Ge"],"chemical_system":"Al-Ge-Sr","density":3.875603284813888,"density_atomic":0.03535488242663719,"volume":197.99245590832564,"volume_molar":17.03340626997187,"formula_full":"Sr3 Al2 Ge2","formula_reduced":"Sr3(AlGe)2","formula_anonymous":"A2B2C3","energy_above_hull":0.4488609185714287,"spacegroup":71},{"id":"jvasp-51658","created_at":"2022-09-04T14:38:28.847890Z","updated_at":"2022-09-04T14:38:28.847913Z","structure_string":"Ni6 Bi4 S4\n1.0\n6.576314 -0.000000 -2.325078\n-3.288158 5.695255 -2.325078\n-0.000000 -0.000000 6.975235\nNi Bi S\n6 4 4\ndirect\n0.520650 0.270651 0.250000 Ni\n0.979349 0.229350 0.749999 Ni\n0.750000 0.979350 0.229349 Ni\n0.229349 0.750001 0.979349 Ni\n0.250000 0.520651 0.270650 Ni\n0.270650 0.250000 0.520650 Ni\n0.005674 0.005674 0.005674 Bi\n0.494326 0.500000 -0.000000 Bi\n0.000000 0.494326 0.500000 Bi\n0.500000 0.000000 0.494326 Bi\n0.000000 0.959954 0.500000 S\n0.959953 0.500000 -0.000000 S\n0.500000 0.000000 0.959952 S\n0.540046 0.540047 0.540046 S\n","nsites":14,"nelements":3,"elements":["Ni","Bi","S"],"chemical_system":"Bi-Ni-S","density":8.366874921636457,"density_atomic":0.053588731441790736,"volume":261.2489533402579,"volume_molar":11.237699788697896,"formula_full":"Ni6 Bi4 S4","formula_reduced":"Ni3(BiS)2","formula_anonymous":"A2B2C3","energy_above_hull":1.369463685714286,"spacegroup":199}]}