{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-updated_at&page=3602","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-updated_at&page=3600","results":[{"id":"jvasp-15401","created_at":"2022-09-04T14:36:15.501555Z","updated_at":"2022-09-04T14:36:15.501584Z","structure_string":"Y1 Cu2 Ge2\n1.0\n3.817885 0.000000 -1.392250\n-0.507705 3.783977 -1.392250\n-0.002170 -0.002481 5.924956\nY Cu Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.249999 0.750001 0.500000 Cu\n0.749999 0.250000 0.500000 Cu\n0.619166 0.619168 0.238335 Ge\n0.380832 0.380833 0.761665 Ge\n","nsites":5,"nelements":3,"elements":["Y","Cu","Ge"],"chemical_system":"Cu-Ge-Y","density":7.01080367025555,"density_atomic":0.05843154591070819,"volume":85.57021591796868,"volume_molar":10.306317702432,"formula_full":"Y1 Cu2 Ge2","formula_reduced":"Y(CuGe)2","formula_anonymous":"AB2C2","energy_above_hull":0.6797976499999998,"spacegroup":139},{"id":"jvasp-69157","created_at":"2022-09-04T14:36:15.500610Z","updated_at":"2022-09-04T14:36:15.500619Z","structure_string":"Ba1 Sr1 Mg2\n1.0\n6.021969 0.000000 0.000000\n0.000000 6.021969 0.000000\n0.000000 -0.000000 4.218740\nBa Sr Mg\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.500000 Sr\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n","nsites":4,"nelements":3,"elements":["Ba","Sr","Mg"],"chemical_system":"Ba-Mg-Sr","density":2.9691841806954336,"density_atomic":0.026145695536495005,"volume":152.9888541085729,"volume_molar":23.033010353823254,"formula_full":"Ba1 Sr1 Mg2","formula_reduced":"BaSrMg2","formula_anonymous":"ABC2","energy_above_hull":0.00187,"spacegroup":123},{"id":"jvasp-86478","created_at":"2022-09-04T14:36:15.494526Z","updated_at":"2022-09-04T14:36:15.494549Z","structure_string":"U2 Te2 As2\n1.0\n4.068188 0.000000 -0.950826\n-0.222229 4.062113 -0.950826\n-0.010897 -0.011510 9.131820\nU Te As\n2 2 2\ndirect\n0.118830 0.118830 0.237660 U\n0.881169 0.881169 0.762339 U\n0.313487 0.313487 0.626975 Te\n0.686512 0.686512 0.373024 Te\n0.500000 -0.000000 -0.000000 As\n-0.000000 0.500000 -0.000000 As\n","nsites":6,"nelements":3,"elements":["U","Te","As"],"chemical_system":"As-Te-U","density":9.701095373765195,"density_atomic":0.03978297191429059,"volume":150.81829514714354,"volume_molar":15.137483375988722,"formula_full":"U2 Te2 As2","formula_reduced":"UTeAs","formula_anonymous":"ABC","energy_above_hull":2.486398505555556,"spacegroup":139},{"id":"jvasp-96816","created_at":"2022-09-04T14:36:15.494047Z","updated_at":"2022-09-04T14:36:15.494080Z","structure_string":"Na3 Nd3 H6 S6 O27\n1.0\n6.972492 -0.000000 -0.000000\n-3.486246 6.038355 0.000000\n0.000000 0.000000 12.884591\nNa Nd H S O\n3 3 6 6 27\ndirect\n0.529221 0.529222 0.500000 Na\n0.470778 0.000000 0.833333 Na\n-0.000000 0.470779 0.166667 Na\n0.432926 0.000000 0.333333 Nd\n-0.000000 0.432927 0.666667 Nd\n0.567073 0.567074 0.000000 Nd\n0.043571 0.099855 0.372311 H\n0.099855 0.043571 0.627689 H\n0.943716 0.900146 0.294355 H\n0.956429 0.056284 0.961022 H\n0.900145 0.943717 0.705645 H\n0.056284 0.956430 0.038978 H\n0.545269 0.558283 0.244336 S\n0.441717 0.986987 0.577669 S\n0.013013 0.454731 0.911003 S\n0.986986 0.441717 0.422331 S\n0.558283 0.545270 0.755663 S\n0.454730 0.013013 0.088997 S\n0.388507 0.130048 0.511413 O\n0.869952 0.258460 0.844747 O\n0.167550 0.409401 0.970629 O\n0.241850 0.832450 0.637296 O\n0.132925 0.643385 0.838235 O\n0.643384 0.132925 0.161765 O\n0.121104 0.617886 0.346938 O\n0.617885 0.121105 0.653061 O\n0.510459 0.867076 0.504901 O\n0.832449 0.241850 0.362704 O\n0.496780 0.878896 0.013606 O\n0.758150 0.590600 0.696038 O\n0.077781 0.000000 0.333333 O\n0.590599 0.758151 0.303962 O\n0.356616 0.489541 0.171568 O\n0.867075 0.510459 0.495099 O\n0.503219 0.382115 0.319727 O\n0.382115 0.503220 0.680272 O\n0.409400 0.167551 0.029371 O\n0.130048 0.388508 0.488587 O\n0.878895 0.496781 0.986394 O\n0.922219 0.922220 0.000000 O\n0.611492 0.741541 0.821920 O\n-0.000000 0.077781 0.666667 O\n0.489541 0.356616 0.828432 O\n0.741540 0.611493 0.178080 O\n0.258459 0.869953 0.155253 O\n","nsites":45,"nelements":5,"elements":["Na","Nd","H","S","O"],"chemical_system":"H-Na-Nd-O-S","density":3.465476904230123,"density_atomic":0.08295359461976597,"volume":542.4719713023445,"volume_molar":7.259650154527554,"formula_full":"Na3 Nd3 H6 S6 O27","formula_reduced":"NaNdH2S2O9","formula_anonymous":"ABC2D2E9","energy_above_hull":2.4849481333333334,"spacegroup":152},{"id":"jvasp-68282","created_at":"2022-09-04T14:36:15.491896Z","updated_at":"2022-09-04T14:36:15.491923Z","structure_string":"Hf1 Mn2 Be1\n1.0\n-1.823853 1.823853 3.974348\n1.823853 -1.823853 3.974348\n1.823853 1.823853 -3.974348\nHf Mn Be\n1 2 1\ndirect\n0.749999 0.250000 0.499999 Hf\n0.000000 0.000000 0.000000 Mn\n0.250000 0.749999 0.499999 Mn\n0.500000 0.500000 0.000000 Be\n","nsites":4,"nelements":3,"elements":["Hf","Mn","Be"],"chemical_system":"Be-Hf-Mn","density":9.33797665792797,"density_atomic":0.07564050929325473,"volume":52.88171691827439,"volume_molar":7.961528572808047,"formula_full":"Hf1 Mn2 Be1","formula_reduced":"HfMn2Be","formula_anonymous":"ABC2","energy_above_hull":3.9756358956896554,"spacegroup":119},{"id":"jvasp-98306","created_at":"2022-09-04T14:36:15.490258Z","updated_at":"2022-09-04T14:36:15.490279Z","structure_string":"Pr2 Mo12 O24\n1.0\n7.959046 -0.039296 -2.261337\n-4.551207 6.529508 -2.261337\n0.020633 0.039296 8.274033\nPr Mo O\n2 12 24\ndirect\n0.793755 0.793755 -0.000001 Pr\n0.206245 0.206245 -0.000000 Pr\n0.815533 0.664440 0.479972 Mo\n0.335560 0.815533 0.151093 Mo\n0.184467 0.335560 0.520027 Mo\n0.523534 0.676175 0.523221 Mo\n0.676175 0.152953 0.152641 Mo\n0.664440 0.184467 0.848906 Mo\n0.152953 0.000312 0.476778 Mo\n0.476466 0.323825 0.476778 Mo\n0.323825 0.847047 0.847358 Mo\n0.999688 0.476466 0.152640 Mo\n0.847047 0.999688 0.523221 Mo\n0.000312 0.523535 0.847359 Mo\n0.164468 0.208058 0.702729 O\n0.505328 0.461739 0.297270 O\n0.208057 0.505328 0.043589 O\n0.836432 0.461006 0.297438 O\n0.163568 0.538994 0.702561 O\n0.538993 0.836432 0.375425 O\n0.159874 0.123490 0.283364 O\n0.123490 0.840126 0.963615 O\n0.461739 0.164469 0.956411 O\n0.461006 0.163568 0.624574 O\n0.791943 0.494672 0.956410 O\n0.502549 0.874859 0.711502 O\n0.835531 0.791942 0.297270 O\n0.538261 0.835531 0.043588 O\n0.163355 0.791047 0.288497 O\n0.791047 0.502550 0.627690 O\n0.874858 0.163355 0.372308 O\n0.876510 0.159874 0.036384 O\n0.836645 0.208953 0.711502 O\n0.208953 0.497451 0.372308 O\n0.125141 0.836645 0.627691 O\n0.497451 0.125142 0.288497 O\n0.494672 0.538261 0.702729 O\n0.840125 0.876510 0.716635 O\n","nsites":38,"nelements":3,"elements":["Pr","Mo","O"],"chemical_system":"Mo-O-Pr","density":7.018218013299614,"density_atomic":0.08838673486978027,"volume":429.9287676593689,"volume_molar":6.81339883057383,"formula_full":"Pr2 Mo12 O24","formula_reduced":"Pr(MoO2)6","formula_anonymous":"AB6C12","energy_above_hull":4.295589855263158,"spacegroup":87},{"id":"jvasp-97852","created_at":"2022-09-04T14:36:15.486763Z","updated_at":"2022-09-04T14:36:15.486793Z","structure_string":"Ce3 Ag4 Sn4\n1.0\n4.552377 0.000016 -1.240458\n-0.830721 6.668462 -3.049384\n-0.012579 -0.001518 8.929271\nCe Ag Sn\n3 4 4\ndirect\n0.000000 0.500000 0.000000 Ce\n0.129512 0.129580 0.259013 Ce\n0.870488 0.870420 0.740987 Ce\n0.330164 0.524982 0.660451 Ag\n0.669837 0.475018 0.339550 Ag\n0.669980 0.864762 0.339824 Ag\n0.330021 0.135238 0.660176 Ag\n0.214847 0.714666 0.429581 Sn\n0.785153 0.285334 0.570419 Sn\n0.499974 0.196201 0.999887 Sn\n0.500026 0.803799 0.000113 Sn\n","nsites":11,"nelements":3,"elements":["Ce","Ag","Sn"],"chemical_system":"Ag-Ce-Sn","density":8.130774609027055,"density_atomic":0.04059902585525074,"volume":270.9424615068036,"volume_molar":14.833214918680484,"formula_full":"Ce3 Ag4 Sn4","formula_reduced":"Ce3(AgSn)4","formula_anonymous":"A3B4C4","energy_above_hull":0.7403311218181818,"spacegroup":71},{"id":"jvasp-62815","created_at":"2022-09-04T14:36:15.483571Z","updated_at":"2022-09-04T14:36:15.483598Z","structure_string":"Dy4 Fe3 B6\n1.0\n7.313792 -2.639176 -0.068735\n7.313792 2.639176 -0.068735\n6.403547 -0.000000 4.410909\nDy Fe B\n4 3 6\ndirect\n0.742249 0.742249 0.742247 Dy\n0.257752 0.257752 0.257751 Dy\n0.590577 0.590577 0.590575 Dy\n0.409424 0.409424 0.409423 Dy\n0.000000 0.000000 0.000000 Fe\n0.891561 0.891561 0.891558 Fe\n0.108440 0.108440 0.108440 Fe\n0.167404 0.500001 0.832596 B\n0.500000 0.832597 0.167402 B\n0.832597 0.167404 0.499999 B\n0.832597 0.500000 0.167402 B\n0.500001 0.167404 0.832596 B\n0.167404 0.832597 0.499999 B\n","nsites":13,"nelements":3,"elements":["Dy","Fe","B"],"chemical_system":"B-Dy-Fe","density":8.489082803722372,"density_atomic":0.07531630977352918,"volume":172.60537643294103,"volume_molar":7.995799021630444,"formula_full":"Dy4 Fe3 B6","formula_reduced":"Dy4(FeB2)3","formula_anonymous":"A3B4C6","energy_above_hull":4.017046000000001,"spacegroup":166},{"id":"jvasp-70118","created_at":"2022-09-04T14:36:15.481122Z","updated_at":"2022-09-04T14:36:15.481153Z","structure_string":"Y1 Be2 P1\n1.0\n3.204053 0.000000 0.000000\n0.000000 3.204053 0.000000\n0.000000 0.000000 5.942560\nY Be P\n1 2 1\ndirect\n0.499999 0.499999 0.742796 Y\n0.000000 0.000000 0.077590 Be\n0.499999 0.499999 0.253446 Be\n0.000000 0.000000 0.426167 P\n","nsites":4,"nelements":3,"elements":["Y","Be","P"],"chemical_system":"Be-P-Y","density":3.753642668223889,"density_atomic":0.0655672596955378,"volume":61.0060572696501,"volume_molar":9.184676602261355,"formula_full":"Y1 Be2 P1","formula_reduced":"YBe2P","formula_anonymous":"ABC2","energy_above_hull":2.3663382875,"spacegroup":99},{"id":"jvasp-66630","created_at":"2022-09-04T14:36:15.480494Z","updated_at":"2022-09-04T14:36:15.480522Z","structure_string":"Ba4 Ge1 Mo1\n1.0\n-0.000000 4.899182 4.899182\n4.899182 0.000000 4.899182\n4.899182 4.899182 0.000000\nBa Ge Mo\n4 1 1\ndirect\n0.127083 0.624305 0.624305 Ba\n0.624305 0.624305 0.624305 Ba\n0.624305 0.127083 0.624305 Ba\n0.624305 0.624305 0.127083 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Mo\n","nsites":6,"nelements":3,"elements":["Ba","Ge","Mo"],"chemical_system":"Ba-Ge-Mo","density":5.068799065399616,"density_atomic":0.025512354127558954,"volume":235.18017859115088,"volume_molar":23.60480232396415,"formula_full":"Ba4 Ge1 Mo1","formula_reduced":"Ba4GeMo","formula_anonymous":"ABC4","energy_above_hull":1.2450226216666664,"spacegroup":216},{"id":"jvasp-85778","created_at":"2022-09-04T14:36:15.476963Z","updated_at":"2022-09-04T14:36:15.476984Z","structure_string":"Nd4 As4 Se4\n1.0\n4.013145 -0.000180 0.000000\n0.000068 4.082697 0.000000\n0.000000 0.000000 17.986267\nNd As Se\n4 4 4\ndirect\n0.750023 0.229153 0.140005 Nd\n0.749976 0.270848 0.640005 Nd\n0.249976 0.770848 0.859995 Nd\n0.250024 0.729153 0.359995 Nd\n0.749987 0.796096 0.502371 As\n0.750012 0.703905 0.002371 As\n0.250012 0.203905 0.497629 As\n0.249987 0.296096 0.997629 As\n0.750021 0.231806 0.312769 Se\n0.749977 0.268194 0.812769 Se\n0.249978 0.768195 0.687231 Se\n0.250022 0.731807 0.187231 Se\n","nsites":12,"nelements":3,"elements":["Nd","As","Se"],"chemical_system":"As-Nd-Se","density":6.719429597773362,"density_atomic":0.04072004116281168,"volume":294.6951834360919,"volume_molar":14.789132299551381,"formula_full":"Nd4 As4 Se4","formula_reduced":"NdAsSe","formula_anonymous":"ABC","energy_above_hull":1.072065538888889,"spacegroup":62},{"id":"jvasp-94156","created_at":"2022-09-04T14:36:15.476220Z","updated_at":"2022-09-04T14:36:15.476247Z","structure_string":"Hf1 Mg6 Cu1\n1.0\n6.426673 0.291335 0.000000\n-2.961034 5.128660 0.000000\n0.000000 0.000000 4.869021\nHf Mg Cu\n1 6 1\ndirect\n0.133363 0.816682 0.250000 Hf\n0.637193 0.319213 0.250000 Mg\n0.637193 0.817982 0.250000 Mg\n0.335975 0.165545 0.750000 Mg\n0.335975 0.670431 0.750000 Mg\n0.886966 0.193485 0.750000 Mg\n0.830742 0.665373 0.750000 Mg\n0.202591 0.351294 0.250000 Cu\n","nsites":8,"nelements":3,"elements":["Hf","Mg","Cu"],"chemical_system":"Cu-Hf-Mg","density":3.9109175364664264,"density_atomic":0.04857779937090099,"volume":164.68428178309267,"volume_molar":12.3968990732161,"formula_full":"Hf1 Mg6 Cu1","formula_reduced":"HfMg6Cu","formula_anonymous":"ABC6","energy_above_hull":0.0067834687499999,"spacegroup":38}]}