{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=87","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=85","results":[{"id":"jvasp-10205","created_at":"2022-09-04T14:38:12.311692Z","updated_at":"2022-09-04T14:38:12.311717Z","structure_string":"Na4 Zn4 O6\n1.0\n0.000000 5.862666 -0.003267\n5.909937 0.000000 0.000000\n0.000000 -2.840637 -5.277494\nNa Zn O\n4 4 6\ndirect\n0.865687 0.343122 0.099083 Na\n0.865687 0.156879 0.599083 Na\n0.134313 0.656879 0.900916 Na\n0.134313 0.843122 0.400917 Na\n0.341558 0.124005 0.081051 Zn\n0.341557 0.375995 0.581050 Zn\n0.658442 0.875995 0.918949 Zn\n0.658443 0.624006 0.418949 Zn\n-0.000000 0.500000 0.500000 O\n0.646106 0.584663 0.756351 O\n0.353893 0.084662 0.743648 O\n0.353894 0.415338 0.243649 O\n0.000000 0.000000 0.000000 O\n0.646107 0.915338 0.256351 O\n","nsites":14,"nelements":3,"elements":["Na","Zn","O"],"chemical_system":"Na-O-Zn","density":4.081606846796214,"density_atomic":0.07654063100588618,"volume":182.9093883341955,"volume_molar":7.867900591957338,"formula_full":"Na4 Zn4 O6","formula_reduced":"Na2Zn2O3","formula_anonymous":"A2B2C3","energy_above_hull":0.2090013285714287,"spacegroup":14},{"id":"jvasp-85374","created_at":"2022-09-04T14:36:21.841817Z","updated_at":"2022-09-04T14:36:21.841836Z","structure_string":"Te4 Pd6 Pb4\n1.0\n6.038574 -0.000000 0.000000\n-0.000000 6.530267 0.000000\n0.000000 0.000000 8.705158\nTe Pd Pb\n4 6 4\ndirect\n0.250000 0.672431 0.540631 Te\n0.750000 0.327570 0.040631 Te\n0.250000 0.672431 0.959369 Te\n0.750000 0.327570 0.459369 Te\n0.000000 0.000000 0.500000 Pd\n0.750000 0.203547 0.750000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.000000 0.000000 Pd\n0.250000 0.796453 0.250000 Pd\n0.250000 0.250651 0.250000 Pb\n0.750000 0.749350 0.750000 Pb\n0.250000 0.201130 0.750000 Pb\n0.750000 0.798870 0.250000 Pb\n","nsites":14,"nelements":3,"elements":["Te","Pd","Pb"],"chemical_system":"Pb-Pd-Te","density":9.566914962609005,"density_atomic":0.04078364580889514,"volume":343.2748525132229,"volume_molar":14.76606772287763,"formula_full":"Te4 Pd6 Pb4","formula_reduced":"Te2Pd3Pb2","formula_anonymous":"A2B2C3","energy_above_hull":1.142219181904762,"spacegroup":59},{"id":"jvasp-9413","created_at":"2022-09-04T14:37:01.510592Z","updated_at":"2022-09-04T14:37:01.510618Z","structure_string":"S6 N4 O4\n1.0\n4.313372 0.000000 -1.203265\n-0.235004 6.547962 -0.842424\n0.020086 -0.107530 8.404763\nS N O\n6 4 4\ndirect\n0.352872 0.128580 0.311219 S\n0.041654 0.371419 0.688781 S\n0.647129 0.871419 0.688782 S\n0.958347 0.628580 0.311219 S\n0.361957 0.250000 0.000000 S\n0.638043 0.750000 0.000001 S\n0.804876 0.803171 0.858637 N\n0.053762 0.303172 0.858636 N\n0.195126 0.196828 0.141364 N\n0.946239 0.696828 0.141365 N\n0.659110 0.603333 0.350093 O\n0.690982 0.103333 0.350093 O\n0.309019 0.896667 0.649908 O\n0.340891 0.396667 0.649908 O\n","nsites":14,"nelements":3,"elements":["S","N","O"],"chemical_system":"N-O-S","density":2.187826178503909,"density_atomic":0.05904195227199254,"volume":237.1195304570089,"volume_molar":10.19976563826582,"formula_full":"S6 N4 O4","formula_reduced":"S3(NO)2","formula_anonymous":"A2B2C3","energy_above_hull":3.3672076428571422,"spacegroup":15},{"id":"jvasp-109194","created_at":"2022-09-04T14:38:26.908982Z","updated_at":"2022-09-04T14:38:26.909001Z","structure_string":"Cr3 Te2 Se2\n1.0\n6.389627 -0.002309 3.108755\n5.209025 3.700459 3.108755\n-0.001999 -0.000637 6.642084\nCr Te Se\n3 2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.261434 0.261432 0.774749 Cr\n0.738568 0.738567 0.225249 Cr\n0.370399 0.370398 0.301473 Te\n0.629603 0.629601 0.698524 Te\n0.127217 0.127217 0.192348 Se\n0.872784 0.872782 0.807650 Se\n","nsites":7,"nelements":3,"elements":["Cr","Te","Se"],"chemical_system":"Cr-Se-Te","density":6.013365909542588,"density_atomic":0.04454219903806677,"volume":157.1543424252054,"volume_molar":13.520079587568956,"formula_full":"Cr3 Te2 Se2","formula_reduced":"Cr3(TeSe)2","formula_anonymous":"A2B2C3","energy_above_hull":3.04740920952381,"spacegroup":12},{"id":"jvasp-52372","created_at":"2022-09-04T14:36:33.290650Z","updated_at":"2022-09-04T14:36:33.290683Z","structure_string":"K4 Mg4 O6\n1.0\n0.000000 5.899884 -0.010319\n6.233598 0.000000 0.000000\n0.000000 -2.571395 -5.792291\nK Mg O\n4 4 6\ndirect\n0.179497 0.370826 0.927901 K\n0.820501 0.870826 0.572099 K\n0.179498 0.129174 0.427901 K\n0.820501 0.629174 0.072099 K\n0.336762 0.607694 0.575632 Mg\n0.336763 0.892306 0.075633 Mg\n0.663236 0.107694 0.924367 Mg\n0.663236 0.392306 0.424368 Mg\n-0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.416478 0.858346 0.793615 O\n0.583520 0.358346 0.706385 O\n0.416478 0.641655 0.293615 O\n0.583521 0.141655 0.206385 O\n","nsites":14,"nelements":3,"elements":["K","Mg","O"],"chemical_system":"K-Mg-O","density":2.7230946306908894,"density_atomic":0.06566868542592363,"volume":213.1914155003521,"volume_molar":9.170490806905473,"formula_full":"K4 Mg4 O6","formula_reduced":"K2Mg2O3","formula_anonymous":"A2B2C3","energy_above_hull":0.277324942857143,"spacegroup":14},{"id":"jvasp-94837","created_at":"2022-09-04T14:35:55.873193Z","updated_at":"2022-09-04T14:35:55.873223Z","structure_string":"In2 Rh3 S2\n1.0\n2.839945 1.639644 4.570413\n-2.839945 1.639644 4.570413\n-0.000000 -3.279286 4.570413\nIn Rh S\n2 3 2\ndirect\n0.000000 0.000000 0.000000 In\n0.499999 0.499999 0.500001 In\n-0.000000 -0.000000 0.500000 Rh\n-0.000001 0.500000 0.000000 Rh\n0.500000 -0.000001 0.000000 Rh\n0.714945 0.714945 0.714947 S\n0.285054 0.285054 0.285055 S\n","nsites":7,"nelements":3,"elements":["In","Rh","S"],"chemical_system":"In-Rh-S","density":7.834792890153537,"density_atomic":0.05481911580565393,"volume":127.69268342117321,"volume_molar":10.985475908348906,"formula_full":"In2 Rh3 S2","formula_reduced":"In2Rh3S2","formula_anonymous":"A2B2C3","energy_above_hull":1.7978855628571428,"spacegroup":166},{"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-16126","created_at":"2022-09-04T14:36:43.665258Z","updated_at":"2022-09-04T14:36:43.665276Z","structure_string":"Y2 Al3 Si2\n1.0\n4.060429 0.000000 -0.000000\n-2.030214 5.022469 -0.996421\n-0.000000 0.022390 6.661954\nY Al Si\n2 3 2\ndirect\n0.380403 0.760804 0.678825 Y\n0.619598 0.239196 0.321175 Y\n0.694599 0.389197 0.866233 Al\n0.000000 0.000000 0.000000 Al\n0.305402 0.610803 0.133767 Al\n0.906576 0.813148 0.360822 Si\n0.093426 0.186852 0.639178 Si\n","nsites":7,"nelements":3,"elements":["Y","Al","Si"],"chemical_system":"Al-Si-Y","density":3.846618662583993,"density_atomic":0.05148938982856668,"volume":135.95033895927722,"volume_molar":11.695886822606848,"formula_full":"Y2 Al3 Si2","formula_reduced":"Y2Al3Si2","formula_anonymous":"A2B2C3","energy_above_hull":2.715046642857143,"spacegroup":12},{"id":"jvasp-94851","created_at":"2022-09-04T14:36:19.141670Z","updated_at":"2022-09-04T14:36:19.141691Z","structure_string":"Tm2 Mo2 C3\n1.0\n-0.000000 3.355373 0.000000\n0.139848 0.000000 5.629032\n5.289983 -1.677686 -1.931437\nTm Mo C\n2 2 3\ndirect\n0.614911 0.819158 0.229823 Tm\n0.385087 0.180841 0.770176 Tm\n0.851537 0.631466 0.703078 Mo\n0.148461 0.368533 0.296923 Mo\n0.000000 0.500000 0.000000 C\n0.269800 0.745750 0.539601 C\n0.730198 0.254249 0.460399 C\n","nsites":7,"nelements":3,"elements":["Tm","Mo","C"],"chemical_system":"C-Mo-Tm","density":9.318513110671061,"density_atomic":0.06943006512849133,"volume":100.8208761873605,"volume_molar":8.67367868495453,"formula_full":"Tm2 Mo2 C3","formula_reduced":"Tm2Mo2C3","formula_anonymous":"A2B2C3","energy_above_hull":5.279130042857143,"spacegroup":12},{"id":"jvasp-94890","created_at":"2022-09-04T14:36:08.914460Z","updated_at":"2022-09-04T14:36:08.914486Z","structure_string":"Sm2 Cr2 C3\n1.0\n0.000000 -3.487174 -0.000000\n-4.979662 1.743586 1.387751\n-0.031606 -0.000000 -5.695394\nSm Cr C\n2 2 3\ndirect\n0.398328 0.796659 0.181830 Sm\n0.601670 0.203341 0.818170 Sm\n0.159066 0.318135 0.396338 Cr\n0.840932 0.681866 0.603661 Cr\n0.294734 0.589471 0.717886 C\n0.705264 0.410530 0.282114 C\n0.000000 0.000000 0.500000 C\n","nsites":7,"nelements":3,"elements":["Sm","Cr","C"],"chemical_system":"C-Cr-Sm","density":7.388689491101202,"density_atomic":0.07066911520785335,"volume":99.05317166362514,"volume_molar":8.521602035468485,"formula_full":"Sm2 Cr2 C3","formula_reduced":"Sm2Cr2C3","formula_anonymous":"A2B2C3","energy_above_hull":4.962178935714286,"spacegroup":12},{"id":"jvasp-87211","created_at":"2022-09-04T14:38:17.839324Z","updated_at":"2022-09-04T14:38:17.839348Z","structure_string":"Pb12 Br8 O8\n1.0\n5.943695 -0.000000 0.000000\n-0.000000 9.911420 0.000000\n0.000000 0.000000 12.317916\nPb Br O\n12 8 8\ndirect\n0.250000 0.077421 0.079299 Pb\n0.749999 0.922579 0.920702 Pb\n0.749999 0.577421 0.420701 Pb\n0.250000 0.422579 0.579299 Pb\n0.250000 0.366103 0.287357 Pb\n0.749999 0.633897 0.712643 Pb\n0.749999 0.866103 0.212643 Pb\n0.250000 0.133897 0.787357 Pb\n0.250000 0.790468 0.556369 Pb\n0.749999 0.209532 0.443631 Pb\n0.749999 0.290468 0.943631 Pb\n0.250000 0.709531 0.056369 Pb\n0.250000 0.693629 0.309971 Br\n0.749999 0.306371 0.690029 Br\n0.749999 0.193629 0.190029 Br\n0.250000 0.806371 0.809972 Br\n0.749999 0.927276 0.629386 Br\n0.749999 0.572724 0.129385 Br\n0.250000 0.072724 0.370615 Br\n0.250000 0.427276 0.870615 Br\n0.996457 0.112330 0.922692 O\n0.996457 0.387670 0.422692 O\n0.496457 0.612330 0.577309 O\n0.003542 0.887670 0.077308 O\n0.503542 0.112330 0.922692 O\n0.003542 0.612330 0.577309 O\n0.503542 0.387670 0.422692 O\n0.496457 0.887670 0.077308 O\n","nsites":28,"nelements":3,"elements":["Pb","Br","O"],"chemical_system":"Br-O-Pb","density":7.445386610074302,"density_atomic":0.038585878967064224,"volume":725.6540669683844,"volume_molar":15.607110479821705,"formula_full":"Pb12 Br8 O8","formula_reduced":"Pb3(BrO)2","formula_anonymous":"A2B2C3","energy_above_hull":0.708533952857143,"spacegroup":62},{"id":"jvasp-98449","created_at":"2022-09-04T14:38:12.983898Z","updated_at":"2022-09-04T14:38:12.983920Z","structure_string":"K4 Al4 Si6 O20\n1.0\n0.000000 0.000000 6.504003\n-8.392941 0.000000 3.252002\n0.000000 -9.087943 3.252002\nK Al Si O\n4 4 6 20\ndirect\n0.744058 0.393216 0.867335 K\n0.004610 0.606784 0.132665 K\n0.887275 0.106784 0.367335 K\n0.361394 0.893216 0.632665 K\n0.298306 0.432743 0.697638 Al\n0.428687 0.567257 0.302362 Al\n0.481049 0.067257 0.197638 Al\n0.745944 0.932743 0.802362 Al\n0.987190 0.715819 0.553590 Si\n0.256600 0.284181 0.446410 Si\n0.453010 0.784181 0.053590 Si\n0.995887 0.000000 0.000000 Si\n0.745887 0.500000 0.500000 Si\n0.290781 0.215819 0.946410 Si\n0.273168 0.202111 0.119369 O\n0.169332 0.864785 0.079630 O\n0.113747 0.135215 0.920370 O\n0.146198 0.628504 0.658311 O\n0.433013 0.371496 0.341689 O\n0.524702 0.871496 0.158311 O\n0.554510 0.128504 0.841688 O\n0.594647 0.797889 0.880631 O\n0.142536 0.702111 0.380631 O\n0.756445 0.087604 0.127704 O\n0.849644 0.901682 0.608679 O\n0.360007 0.098317 0.391320 O\n0.501327 0.598317 0.108679 O\n0.208324 0.401682 0.891320 O\n0.971753 0.912396 0.872296 O\n-0.001038 0.364785 0.420370 O\n0.634149 0.587604 0.372296 O\n0.594049 0.412396 0.627704 O\n0.225279 0.297889 0.619368 O\n0.784116 0.635215 0.579630 O\n","nsites":34,"nelements":4,"elements":["K","Al","Si","O"],"chemical_system":"Al-K-O-Si","density":2.519880540585553,"density_atomic":0.06853594723251273,"volume":496.09002826870915,"volume_molar":8.786835234901606,"formula_full":"K4 Al4 Si6 O20","formula_reduced":"K2Al2Si3O10","formula_anonymous":"A2B2C3D10","energy_above_hull":2.4068389647058823,"spacegroup":43}]}