{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4403","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4401","results":[{"id":"jvasp-8056","created_at":"2022-09-04T14:37:09.515515Z","updated_at":"2022-09-04T14:37:09.515541Z","structure_string":"K1 As1 F6\n1.0\n4.787758 -0.012439 -0.641784\n-0.731918 4.731498 -0.641784\n-0.010690 -0.012439 4.830569\nK As F\n1 1 6\ndirect\n0.500000 0.500000 0.500001 K\n0.000000 0.000000 0.000000 As\n0.788661 0.076150 0.698287 F\n0.076150 0.698286 0.788662 F\n0.301714 0.211339 0.923850 F\n0.923850 0.301714 0.211340 F\n0.211339 0.923850 0.301715 F\n0.698286 0.788661 0.076152 F\n","nsites":8,"nelements":3,"elements":["K","As","F"],"chemical_system":"As-F-K","density":3.4638040522876725,"density_atomic":0.0731879702579474,"volume":109.30758117494437,"volume_molar":8.228320499633014,"formula_full":"K1 As1 F6","formula_reduced":"KAsF6","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":148},{"id":"jvasp-11316","created_at":"2022-09-04T14:37:15.846769Z","updated_at":"2022-09-04T14:37:15.846798Z","structure_string":"Mg2 Co2 F8\n1.0\n-4.946119 0.007105 -0.015754\n-0.007426 -4.946143 -0.021950\n2.459408 2.445451 5.449681\nMg Co F\n2 2 8\ndirect\n0.719294 0.717639 0.433597 Mg\n0.287155 0.285507 0.569330 Mg\n-0.031807 0.466539 0.931372 Co\n0.538271 0.036603 0.071526 Co\n0.636946 0.578693 0.658002 F\n0.826415 0.772267 0.167858 F\n0.346448 0.397280 0.167851 F\n0.426050 0.978737 0.344877 F\n0.026036 0.081001 0.657994 F\n0.232470 0.658408 0.835029 F\n0.607545 0.178345 0.835038 F\n0.923826 0.367815 0.344872 F\n","nsites":12,"nelements":3,"elements":["Mg","Co","F"],"chemical_system":"Co-F-Mg","density":3.9801336990599103,"density_atomic":0.09031710078082054,"volume":132.8652037793078,"volume_molar":6.667774660542296,"formula_full":"Mg2 Co2 F8","formula_reduced":"MgCoF4","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":82},{"id":"jvasp-35000","created_at":"2022-09-04T14:37:28.949322Z","updated_at":"2022-09-04T14:37:28.949348Z","structure_string":"Mg2 Cu2 Ge2\n1.0\n4.036811 0.000000 0.000000\n0.000000 4.036811 -0.000000\n0.000000 0.000000 6.361637\nMg Cu Ge\n2 2 2\ndirect\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.295321 Cu\n0.000000 0.500000 0.704680 Cu\n0.500000 0.000000 0.677155 Ge\n0.000000 0.500000 0.322846 Ge\n","nsites":6,"nelements":3,"elements":["Mg","Cu","Ge"],"chemical_system":"Cu-Ge-Mg","density":5.141431555979556,"density_atomic":0.05787693618093474,"volume":103.66823809129795,"volume_molar":10.4050787021165,"formula_full":"Mg2 Cu2 Ge2","formula_reduced":"MgCuGe","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":129},{"id":"jvasp-12907","created_at":"2022-09-04T14:37:28.112430Z","updated_at":"2022-09-04T14:37:28.112450Z","structure_string":"K4 Na4 S4\n1.0\n4.624948 0.000000 0.000000\n-0.000000 7.757989 0.000000\n0.000000 0.000000 8.298488\nK Na S\n4 4 4\ndirect\n0.750000 0.987630 0.184231 K\n0.250000 0.012370 0.815769 K\n0.750000 0.487630 0.315769 K\n0.250000 0.512370 0.684231 K\n0.750000 0.853316 0.575550 Na\n0.250000 0.146684 0.424451 Na\n0.750000 0.353316 0.924451 Na\n0.250000 0.646684 0.075549 Na\n0.750000 0.719087 0.894964 S\n0.250000 0.280913 0.105036 S\n0.750000 0.219087 0.605037 S\n0.250000 0.780913 0.394964 S\n","nsites":12,"nelements":3,"elements":["K","Na","S"],"chemical_system":"K-Na-S","density":2.1003350840561676,"density_atomic":0.04030196876357337,"volume":297.75220338233476,"volume_molar":14.942547336404733,"formula_full":"K4 Na4 S4","formula_reduced":"KNaS","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-27783","created_at":"2022-09-04T14:37:09.532259Z","updated_at":"2022-09-04T14:37:09.532285Z","structure_string":"Na2 Cu6 F14\n1.0\n6.276287 0.018429 3.063452\n1.866530 6.014529 3.343231\n0.035894 0.037575 7.129726\nNa Cu F\n2 6 14\ndirect\n0.500000 0.500000 0.500000 Na\n-0.000000 0.500000 0.500001 Na\n-0.000000 -0.000000 0.500001 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 -0.000000 Cu\n-0.000000 0.500000 -0.000000 Cu\n0.500000 -0.000000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.820985 0.972505 0.367672 F\n0.679016 0.632328 0.027495 F\n0.500152 0.885392 0.303371 F\n0.250000 0.889929 0.110071 F\n0.000151 0.303371 0.885393 F\n0.320984 0.367672 0.972506 F\n0.179015 0.027495 0.632328 F\n0.604295 0.625426 0.686694 F\n0.895705 0.313306 0.374573 F\n0.395705 0.374573 0.313306 F\n0.104295 0.686694 0.625427 F\n0.750000 0.110071 0.889929 F\n0.499848 0.114607 0.696629 F\n0.999849 0.696629 0.114607 F\n","nsites":22,"nelements":3,"elements":["Na","Cu","F"],"chemical_system":"Cu-F-Na","density":4.300734986300647,"density_atomic":0.08219339552274625,"volume":267.6614083173107,"volume_molar":7.326793985939454,"formula_full":"Na2 Cu6 F14","formula_reduced":"NaCu3F7","formula_anonymous":"AB3C7","energy_above_hull":0.0,"spacegroup":15},{"id":"jvasp-81637","created_at":"2022-09-04T14:37:15.187508Z","updated_at":"2022-09-04T14:37:15.187535Z","structure_string":"Na1 Ga1 Hg2\n1.0\n-10.339861 0.000000 -5.969722\n-6.815439 0.449114 -0.134756\n-5.930147 2.953096 -1.668126\nNa Ga Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 -0.000000 Ga\n0.739929 0.000000 -0.000000 Hg\n0.260071 0.000000 -0.000000 Hg\n","nsites":4,"nelements":3,"elements":["Na","Ga","Hg"],"chemical_system":"Ga-Hg-Na","density":7.602020429515981,"density_atomic":0.03707722805458411,"volume":107.88293003218325,"volume_molar":16.24215475637597,"formula_full":"Na1 Ga1 Hg2","formula_reduced":"NaGaHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":71},{"id":"jvasp-80871","created_at":"2022-09-04T14:37:09.543886Z","updated_at":"2022-09-04T14:37:09.543913Z","structure_string":"Sr1 Ca1 Ag2\n1.0\n-12.452187 2.380669 -3.301667\n-9.252249 0.244247 0.417955\n-7.704697 4.621401 -2.262495\nSr Ca Ag\n1 1 2\ndirect\n0.500001 -0.000000 -0.000000 Sr\n0.000000 0.000000 0.000000 Ca\n0.749487 0.000249 0.000248 Ag\n0.250514 -0.000250 -0.000249 Ag\n","nsites":4,"nelements":3,"elements":["Sr","Ca","Ag"],"chemical_system":"Ag-Ca-Sr","density":5.261310440559481,"density_atomic":0.03690294515174513,"volume":108.3924327327257,"volume_molar":16.31886218088264,"formula_full":"Sr1 Ca1 Ag2","formula_reduced":"SrCaAg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-56792","created_at":"2022-09-04T14:37:28.151167Z","updated_at":"2022-09-04T14:37:28.151189Z","structure_string":"Sm1 Zn5\n1.0\n2.682555 -4.646321 -0.000000\n2.682555 4.646321 0.000000\n-0.000000 0.000000 4.212990\nSm Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 Sm\n-0.000000 0.500000 0.500000 Zn\n0.500000 -0.000000 0.500000 Zn\n0.666666 0.333332 0.000000 Zn\n0.499999 0.499999 0.500000 Zn\n0.333332 0.666666 0.000000 Zn\n","nsites":6,"nelements":2,"elements":["Sm","Zn"],"chemical_system":"Sm-Zn","density":7.548450146952831,"density_atomic":0.057131151940807354,"volume":105.02151271545341,"volume_molar":10.540905540009836,"formula_full":"Sm1 Zn5","formula_reduced":"SmZn5","formula_anonymous":"AB5","energy_above_hull":0.0,"spacegroup":191},{"id":"jvasp-102136","created_at":"2022-09-04T14:37:09.594421Z","updated_at":"2022-09-04T14:37:09.594432Z","structure_string":"Yb2 Tl1 Hg1\n1.0\n4.579457 0.000000 2.643950\n1.526485 4.317553 2.643950\n0.000000 0.000000 5.287902\nYb Tl Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750001 0.749999 0.749999 Yb\n0.000000 0.000000 0.000000 Tl\n0.500001 0.500000 0.499999 Hg\n","nsites":4,"nelements":3,"elements":["Yb","Tl","Hg"],"chemical_system":"Hg-Tl-Yb","density":11.928471449274292,"density_atomic":0.03825823501154744,"volume":104.55265379578239,"volume_molar":15.740769949743747,"formula_full":"Yb2 Tl1 Hg1","formula_reduced":"Yb2TlHg","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-100772","created_at":"2022-09-04T14:37:09.920626Z","updated_at":"2022-09-04T14:37:09.920649Z","structure_string":"Tb3 Mg3 Ga3\n1.0\n7.263001 -0.000000 0.000000\n-3.631500 6.289944 0.000000\n-0.000000 -0.000000 4.411938\nTb Mg Ga\n3 3 3\ndirect\n0.576062 0.000000 -0.000000 Tb\n-0.000000 0.576062 -0.000000 Tb\n0.423937 0.423937 -0.000000 Tb\n0.244359 0.000000 0.500000 Mg\n-0.000000 0.244359 0.500000 Mg\n0.755641 0.755641 0.500000 Mg\n0.333333 0.666666 0.500000 Ga\n0.666666 0.333333 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n","nsites":9,"nelements":3,"elements":["Tb","Mg","Ga"],"chemical_system":"Ga-Mg-Tb","density":6.251993300248789,"density_atomic":0.044652957192723074,"volume":201.55440010738408,"volume_molar":13.48654409160029,"formula_full":"Tb3 Mg3 Ga3","formula_reduced":"TbMgGa","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":189},{"id":"jvasp-104513","created_at":"2022-09-04T14:37:09.623366Z","updated_at":"2022-09-04T14:37:09.623385Z","structure_string":"Na2 Cu1 Sb1 F6\n1.0\n5.293158 -0.000000 3.056006\n1.764386 4.990437 3.056006\n-0.000000 -0.000000 6.112012\nNa Cu Sb F\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Sb\n0.746485 0.253515 0.253515 F\n0.253515 0.253515 0.746485 F\n0.253515 0.746485 0.746485 F\n0.253515 0.746485 0.253515 F\n0.746485 0.253515 0.746485 F\n0.746486 0.746485 0.253515 F\n","nsites":10,"nelements":4,"elements":["Na","Cu","Sb","F"],"chemical_system":"Cu-F-Na-Sb","density":3.5512218379096088,"density_atomic":0.06193874002699429,"volume":161.4498453736995,"volume_molar":9.722736945206533,"formula_full":"Na2 Cu1 Sb1 F6","formula_reduced":"Na2CuSbF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-107165","created_at":"2022-09-04T14:37:16.379414Z","updated_at":"2022-09-04T14:37:16.379439Z","structure_string":"Ca1 Tm1 Zn2\n1.0\n4.354622 -0.000000 2.514142\n1.451541 4.105577 2.514142\n-0.000000 -0.000000 5.028284\nCa Tm Zn\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Zn\n0.749999 0.750001 0.749999 Zn\n","nsites":4,"nelements":3,"elements":["Ca","Tm","Zn"],"chemical_system":"Ca-Tm-Zn","density":6.277209428452204,"density_atomic":0.044495442322449154,"volume":89.89684765942627,"volume_molar":13.53428676213354,"formula_full":"Ca1 Tm1 Zn2","formula_reduced":"CaTmZn2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225}]}