{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=3554","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=3552","results":[{"id":"jvasp-16484","created_at":"2022-09-04T14:37:59.064482Z","updated_at":"2022-09-04T14:37:59.064500Z","structure_string":"Ce1 Fe5\n1.0\n2.484389 -4.303088 0.000000\n2.484389 4.303088 -0.000000\n-0.000000 0.000000 3.992087\nCe Fe\n1 5\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 -0.000000 0.500000 Fe\n0.333333 0.666667 0.000000 Fe\n0.666667 0.333333 0.000000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.500000 Fe\n","nsites":6,"nelements":2,"elements":["Ce","Fe"],"chemical_system":"Ce-Fe","density":8.158054562250753,"density_atomic":0.07029451389481896,"volume":85.35516738870612,"volume_molar":8.567013876802498,"formula_full":"Ce1 Fe5","formula_reduced":"CeFe5","formula_anonymous":"AB5","energy_above_hull":3.572022166666666,"spacegroup":191},{"id":"jvasp-109038","created_at":"2022-09-04T14:37:48.148324Z","updated_at":"2022-09-04T14:37:48.148347Z","structure_string":"Dy6 Al2\n1.0\n6.777616 0.000000 0.000000\n-3.388808 5.869587 0.000000\n-0.000000 -0.000000 5.264712\nDy Al\n6 2\ndirect\n0.825427 0.174574 0.750000 Dy\n0.349149 0.174574 0.750000 Dy\n0.825427 0.650852 0.750000 Dy\n0.174574 0.825427 0.250000 Dy\n0.174574 0.349149 0.250000 Dy\n0.650852 0.825427 0.250000 Dy\n0.666667 0.333333 0.250000 Al\n0.333334 0.666667 0.750000 Al\n","nsites":8,"nelements":2,"elements":["Dy","Al"],"chemical_system":"Al-Dy","density":8.158113936228315,"density_atomic":0.03819714162008815,"volume":209.4397554552287,"volume_molar":15.765946101142063,"formula_full":"Dy6 Al2","formula_reduced":"Dy3Al","formula_anonymous":"AB3","energy_above_hull":1.419695575,"spacegroup":194},{"id":"jvasp-115890","created_at":"2022-09-04T14:38:41.063901Z","updated_at":"2022-09-04T14:38:41.063931Z","structure_string":"W2 N2 Cl2\n1.0\n1.754421 1.012915 8.907064\n-1.754421 1.012915 8.907064\n0.000000 -2.025831 8.907064\nW N Cl\n2 2 2\ndirect\n0.789894 0.789894 0.789886 W\n0.210109 0.210109 0.210107 W\n0.867049 0.867049 0.867040 N\n0.132954 0.132954 0.132952 N\n0.389156 0.389156 0.389152 Cl\n0.610847 0.610847 0.610841 Cl\n","nsites":6,"nelements":3,"elements":["W","N","Cl"],"chemical_system":"Cl-N-W","density":8.158315335200667,"density_atomic":0.06317692221210332,"volume":94.97138812581363,"volume_molar":9.532184457770706,"formula_full":"W2 N2 Cl2","formula_reduced":"WNCl","formula_anonymous":"ABC","energy_above_hull":3.823852439166666,"spacegroup":166},{"id":"jvasp-9280","created_at":"2022-09-04T14:38:34.079309Z","updated_at":"2022-09-04T14:38:34.079323Z","structure_string":"Mg1 Bi4 O8\n1.0\n3.455903 0.019401 0.007905\n1.688373 6.758350 0.602944\n1.690295 2.892224 8.883738\nMg Bi O\n1 4 8\ndirect\n0.695431 0.858821 0.762058 Mg\n0.405367 0.716976 0.484295 Bi\n0.948646 0.259405 0.855403 Bi\n0.108546 0.663692 0.131086 Bi\n0.688654 0.210536 0.424234 Bi\n0.075077 0.483313 0.378646 O\n0.506212 0.846753 0.152746 O\n0.540450 0.201406 0.729695 O\n0.856644 0.593583 0.705192 O\n0.861505 -0.069010 0.358020 O\n0.147965 0.826241 0.889659 O\n0.225514 -0.023209 0.584395 O\n0.717582 0.440851 0.135774 O\n","nsites":13,"nelements":3,"elements":["Mg","Bi","O"],"chemical_system":"Bi-Mg-O","density":8.158365955307305,"density_atomic":0.06463131720314239,"volume":201.1408797246041,"volume_molar":9.317682233013816,"formula_full":"Mg1 Bi4 O8","formula_reduced":"Mg(BiO2)4","formula_anonymous":"AB4C8","energy_above_hull":1.9739203269230767,"spacegroup":8},{"id":"jvasp-98458","created_at":"2022-09-04T14:36:07.220489Z","updated_at":"2022-09-04T14:36:07.220514Z","structure_string":"La3 Ge4 Rh4\n1.0\n4.129006 -0.000000 -0.673636\n-0.114105 4.216264 -0.699401\n0.014280 0.002198 13.078580\nLa Ge Rh\n3 4 4\ndirect\n0.855514 0.355514 0.711028 La\n0.144486 0.644486 0.288972 La\n0.000000 0.000000 0.000000 La\n0.450658 0.450658 0.901316 Ge\n0.549342 0.549341 0.098684 Ge\n0.301664 0.801665 0.603330 Ge\n0.698335 0.198335 0.396670 Ge\n0.399740 0.899740 0.799482 Rh\n0.250086 0.250086 0.500172 Rh\n0.749914 0.749913 0.499827 Rh\n0.600260 0.100259 0.200518 Rh\n","nsites":11,"nelements":3,"elements":["La","Ge","Rh"],"chemical_system":"Ge-La-Rh","density":8.158608013429273,"density_atomic":0.048302432092530656,"volume":227.73180404100205,"volume_molar":12.467572540578647,"formula_full":"La3 Ge4 Rh4","formula_reduced":"La3(GeRh)4","formula_anonymous":"A3B4C4","energy_above_hull":2.160829163636364,"spacegroup":71},{"id":"jvasp-16773","created_at":"2022-09-04T14:37:48.712148Z","updated_at":"2022-09-04T14:37:48.712171Z","structure_string":"Li1 Sb1 Au1\n1.0\n3.934034 0.000000 2.271315\n1.311344 3.709043 2.271315\n0.000000 0.000000 4.542632\nLi Sb Au\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250001 Sb\n0.499999 0.500000 0.500001 Au\n","nsites":3,"nelements":3,"elements":["Li","Sb","Au"],"chemical_system":"Au-Li-Sb","density":8.158608182166283,"density_atomic":0.0452599137026802,"volume":66.28382059469871,"volume_molar":13.305683257728752,"formula_full":"Li1 Sb1 Au1","formula_reduced":"LiSbAu","formula_anonymous":"ABC","energy_above_hull":0.7028712233333335,"spacegroup":216},{"id":"jvasp-100331","created_at":"2022-09-04T14:36:44.100290Z","updated_at":"2022-09-04T14:36:44.100317Z","structure_string":"Ti1 Bi2 O4 F2\n1.0\n3.738627 -0.025882 -7.283432\n-0.241338 3.730919 -7.283432\n0.024431 0.025882 8.186887\nTi Bi O F\n1 2 4 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.666897 0.666898 0.000001 Bi\n0.333103 0.333103 0.000000 Bi\n0.750000 0.250000 0.500001 O\n0.250000 0.750000 0.500000 O\n-0.000000 0.500000 0.500000 O\n0.500000 -0.000000 0.500001 O\n0.871728 0.871729 0.000001 F\n0.128272 0.128272 0.000000 F\n","nsites":9,"nelements":4,"elements":["Ti","Bi","O","F"],"chemical_system":"Bi-F-O-Ti","density":8.15914100199921,"density_atomic":0.07787991655152741,"volume":115.5625275233232,"volume_molar":7.732597859186961,"formula_full":"Ti1 Bi2 O4 F2","formula_reduced":"TiBi2(O2F)2","formula_anonymous":"AB2C2D4","energy_above_hull":1.7087234998148149,"spacegroup":139},{"id":"jvasp-9806","created_at":"2022-09-04T14:38:33.199081Z","updated_at":"2022-09-04T14:38:33.199101Z","structure_string":"Zn2 Bi4 O8\n1.0\n6.024820 -0.000000 -3.163107\n-1.660672 5.791427 -3.163107\n-0.278494 -0.369574 6.788887\nZn Bi O\n2 4 8\ndirect\n0.375001 0.625001 0.750001 Zn\n0.625000 0.375000 0.250000 Zn\n0.000000 0.000000 0.500001 Bi\n0.000000 0.500000 0.000000 Bi\n0.500000 0.000000 0.500000 Bi\n0.000000 0.000000 0.000000 Bi\n0.748795 0.746401 0.497589 O\n0.748813 0.251205 0.002411 O\n0.253600 0.251205 0.002411 O\n0.251206 0.253601 0.502412 O\n0.251206 0.748814 0.502412 O\n0.251188 0.748796 0.997590 O\n0.748795 0.251187 0.497589 O\n0.746401 0.748796 0.997589 O\n","nsites":14,"nelements":3,"elements":["Zn","Bi","O"],"chemical_system":"Bi-O-Zn","density":8.159335868119307,"density_atomic":0.06283835753835229,"volume":222.7938563075164,"volume_molar":9.583542593907698,"formula_full":"Zn2 Bi4 O8","formula_reduced":"Zn(BiO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.4328389999999998,"spacegroup":227},{"id":"jvasp-123365","created_at":"2022-09-04T14:38:53.232134Z","updated_at":"2022-09-04T14:38:53.232157Z","structure_string":"Y1 Ag3\n1.0\n4.378619 0.000000 -0.000000\n-0.000000 4.378619 0.000000\n-0.000000 0.000000 4.378619\nY Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n","nsites":4,"nelements":2,"elements":["Y","Ag"],"chemical_system":"Ag-Y","density":8.159669728842832,"density_atomic":0.04764842168646524,"volume":83.94821608826172,"volume_molar":12.638699345860216,"formula_full":"Y1 Ag3","formula_reduced":"YAg3","formula_anonymous":"AB3","energy_above_hull":0.4860568075,"spacegroup":221},{"id":"jvasp-87900","created_at":"2022-09-04T14:36:08.015672Z","updated_at":"2022-09-04T14:36:08.015698Z","structure_string":"Er4 Cr4 O12\n1.0\n5.204007 -0.000000 0.000000\n-0.000000 5.560105 0.000000\n0.000000 0.000000 7.518356\nEr Cr O\n4 4 12\ndirect\n0.978937 0.073196 0.250000 Er\n0.521064 0.573196 0.250000 Er\n0.021064 0.926805 0.750000 Er\n0.478937 0.426805 0.750000 Er\n0.500000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.884832 0.540293 0.750000 O\n0.384831 0.959708 0.250000 O\n0.689052 0.304713 0.442071 O\n0.689052 0.304713 0.057929 O\n0.189051 0.195287 0.942071 O\n0.810949 0.804714 0.442071 O\n0.310949 0.695288 0.557929 O\n0.310949 0.695288 0.942071 O\n0.810949 0.804714 0.057929 O\n0.189051 0.195287 0.557929 O\n0.115169 0.459707 0.250000 O\n0.615169 0.040293 0.750000 O\n","nsites":20,"nelements":3,"elements":["Er","Cr","O"],"chemical_system":"Cr-Er-O","density":8.159967219259924,"density_atomic":0.09193613550955396,"volume":217.54231770946703,"volume_molar":6.550352292515256,"formula_full":"Er4 Cr4 O12","formula_reduced":"ErCrO3","formula_anonymous":"ABC3","energy_above_hull":2.23842158,"spacegroup":62},{"id":"jvasp-37194","created_at":"2022-09-04T14:35:46.440926Z","updated_at":"2022-09-04T14:35:46.440953Z","structure_string":"Mn2 Si1 Ru1\n1.0\n2.897300 2.897300 0.000000\n2.897300 -0.000000 -2.897300\n-0.000000 2.897300 -2.897300\nMn Si Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.750000 0.750000 0.750000 Mn\n0.250000 0.250000 0.250000 Si\n0.500000 0.500000 0.500000 Ru\n","nsites":4,"nelements":3,"elements":["Mn","Si","Ru"],"chemical_system":"Mn-Ru-Si","density":8.160072228376723,"density_atomic":0.08223365553989515,"volume":48.641884806634,"volume_molar":7.323206928431383,"formula_full":"Mn2 Si1 Ru1","formula_reduced":"Mn2SiRu","formula_anonymous":"ABC2","energy_above_hull":3.949755895689656,"spacegroup":216},{"id":"jvasp-26856","created_at":"2022-09-04T14:38:32.000754Z","updated_at":"2022-09-04T14:38:32.000784Z","structure_string":"Ce2 P4 Rh4\n1.0\n4.181216 -0.000000 0.000000\n-0.000000 4.181216 -0.000000\n0.000000 -0.000000 9.494698\nCe P Rh\n2 4 4\ndirect\n0.000000 0.500000 0.744457 Ce\n0.500000 0.000000 0.255543 Ce\n0.000000 0.500000 0.138255 P\n0.500000 0.000000 0.861746 P\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.000000 0.500000 0.386932 Rh\n0.500000 0.000000 0.613068 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n","nsites":10,"nelements":3,"elements":["Ce","P","Rh"],"chemical_system":"Ce-P-Rh","density":8.160547749017958,"density_atomic":0.06024397743492113,"volume":165.99169619573263,"volume_molar":9.996253594818585,"formula_full":"Ce2 P4 Rh4","formula_reduced":"Ce(PRh)2","formula_anonymous":"AB2C2","energy_above_hull":2.7451945,"spacegroup":129}]}