{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3427","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3425","results":[{"id":"jvasp-11362","created_at":"2022-09-04T14:37:19.359390Z","updated_at":"2022-09-04T14:37:19.359416Z","structure_string":"K2 Pt4 Se6\n1.0\n6.469388 -0.074621 4.092577\n2.216277 6.078377 4.092577\n-0.107955 -0.074621 7.654445\nK Pt Se\n2 4 6\ndirect\n0.200956 0.200956 0.200955 K\n0.799045 0.799045 0.799044 K\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.499999 Pt\n0.500000 0.500000 0.000000 Pt\n0.762253 0.762254 0.275250 Se\n0.237747 0.724750 0.237747 Se\n0.762254 0.275250 0.762252 Se\n0.275251 0.762254 0.762252 Se\n0.237748 0.237747 0.724749 Se\n0.724750 0.237747 0.237747 Se\n","nsites":12,"nelements":3,"elements":["K","Pt","Se"],"chemical_system":"K-Pt-Se","density":7.223162652082685,"density_atomic":0.0391795936462448,"volume":306.2818902194038,"volume_molar":15.370605459500975,"formula_full":"K2 Pt4 Se6","formula_reduced":"KPt2Se3","formula_anonymous":"AB2C3","energy_above_hull":1.4641534833333334,"spacegroup":166},{"id":"jvasp-8752","created_at":"2022-09-04T14:37:09.828706Z","updated_at":"2022-09-04T14:37:09.828727Z","structure_string":"Ca2 Co1 O3\n1.0\n3.310263 -0.076007 0.459926\n0.084833 3.310049 0.459926\n0.748609 0.713097 7.138132\nCa Co O\n2 1 3\ndirect\n0.393393 0.393394 0.174237 Ca\n0.071777 0.071777 0.817430 Ca\n0.703668 0.703668 0.495845 Co\n0.895605 0.895605 0.179712 O\n0.579446 0.579447 0.811938 O\n0.290108 0.290109 0.495840 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F\n","nsites":12,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":4.227478071874335,"density_atomic":0.08352940544261542,"volume":143.6619827043302,"volume_molar":7.209605680884684,"formula_full":"Mn4 O2 F6","formula_reduced":"Mn2OF3","formula_anonymous":"AB2C3","energy_above_hull":1.5533298050431037,"spacegroup":74},{"id":"jvasp-61939","created_at":"2022-09-04T14:35:49.624227Z","updated_at":"2022-09-04T14:35:49.624256Z","structure_string":"Yb1 B2 Ir3\n1.0\n4.870709 2.811864 -0.032785\n-4.870709 2.811864 -0.032785\n0.000000 0.034189 2.937611\nYb B Ir\n1 2 3\ndirect\n0.499999 0.499999 0.499998 Yb\n0.166662 0.833337 0.499998 B\n0.833337 0.166662 0.499998 B\n0.000000 0.000000 0.000000 Ir\n-0.000000 0.500000 -0.000001 Ir\n0.500000 -0.000000 -0.000001 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O\n","nsites":12,"nelements":3,"elements":["Na","Cu","O"],"chemical_system":"Cu-Na-O","density":3.305698471834239,"density_atomic":0.07260428339827266,"volume":165.27950471150157,"volume_molar":8.294470350964547,"formula_full":"Na6 Cu2 O4","formula_reduced":"Na3CuO2","formula_anonymous":"AB2C3","energy_above_hull":0.2073585833333335,"spacegroup":72},{"id":"jvasp-48708","created_at":"2022-09-04T14:36:00.632996Z","updated_at":"2022-09-04T14:36:00.633021Z","structure_string":"Na4 Co2 O6\n1.0\n4.901338 2.946023 -0.409003\n-4.901338 2.946023 0.409003\n-1.627384 0.000000 5.908909\nNa Co O\n4 2 6\ndirect\n0.352287 0.647712 0.282619 Na\n0.000000 -0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.647712 0.352287 0.717381 Na\n0.336672 0.663327 0.763123 Co\n0.663327 0.336672 0.236878 Co\n0.204922 0.795077 0.881961 O\n0.640985 0.808906 0.685197 O\n0.191093 0.359014 0.685197 O\n0.808906 0.640984 0.314803 O\n0.359015 0.191093 0.314803 O\n0.795077 0.204922 0.118039 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0.965342 O\n0.856408 0.657179 0.633149 O\n0.486413 0.657179 0.866851 O\n0.143592 0.342821 0.366851 O\n0.404546 0.190910 0.750000 O\n0.996289 0.007424 0.250000 O\n0.003711 0.992576 0.750000 O\n0.329164 0.802715 0.465342 O\n0.868119 0.802715 0.034658 O\n0.670836 0.197285 0.534658 O\n0.513587 0.342821 0.133149 O\n0.595454 0.809090 0.250000 O\n","nsites":24,"nelements":3,"elements":["Ba","Zn","O"],"chemical_system":"Ba-O-Zn","density":6.0056168928875575,"density_atomic":0.05591902044126207,"volume":429.1920675758234,"volume_molar":10.76939601673767,"formula_full":"Ba8 Zn4 O12","formula_reduced":"Ba2ZnO3","formula_anonymous":"AB2C3","energy_above_hull":0.5580471616666668,"spacegroup":15},{"id":"jvasp-15116","created_at":"2022-09-04T14:35:55.976487Z","updated_at":"2022-09-04T14:35:55.976502Z","structure_string":"Ho1 B2 Ru3\n1.0\n2.746330 -4.756783 -0.000000\n2.746330 4.756783 -0.000000\n0.000000 0.000000 3.033817\nHo B Ru\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Ho\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.500000 0.500000 0.500000 Ru\n0.500000 0.000000 0.500000 Ru\n0.000000 0.500000 0.500000 Ru\n","nsites":6,"nelements":3,"elements":["Ho","B","Ru"],"chemical_system":"B-Ho-Ru","density":10.260039433592794,"density_atomic":0.0756947594828433,"volume":79.26572514389109,"volume_molar":7.955822570999724,"formula_full":"Ho1 B2 Ru3","formula_reduced":"HoB2Ru3","formula_anonymous":"AB2C3","energy_above_hull":4.333812038888889,"spacegroup":191},{"id":"jvasp-86159","created_at":"2022-09-04T14:36:02.851669Z","updated_at":"2022-09-04T14:36:02.851691Z","structure_string":"Ca3 Si1 Br2\n1.0\n4.428712 0.093828 0.946956\n2.226987 3.829208 0.946957\n0.543117 0.320127 11.959868\nCa Si Br\n3 1 2\ndirect\n0.789264 0.789265 0.517775 Ca\n0.300481 0.300482 0.121533 Ca\n0.753189 0.753190 0.887625 Ca\n0.025307 0.025307 0.006064 Si\n0.404360 0.404361 0.652089 Br\n0.172400 0.172401 0.390917 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0.000000 Te\n0.545052 0.045052 0.545052 Te\n0.000000 0.045052 0.500000 Te\n0.500000 0.500000 0.545052 Te\n0.954948 0.454948 0.954948 Te\n0.000000 0.454948 0.500000 Te\n0.500000 0.500000 0.954948 Te\n0.545052 0.000000 0.000000 Te\n0.500000 0.500000 0.250000 Au\n0.250000 0.750000 0.250000 Au\n0.250000 0.000000 0.000000 Au\n0.000000 0.750000 0.500000 Au\n","nsites":24,"nelements":3,"elements":["Ag","Te","Au"],"chemical_system":"Ag-Au-Te","density":9.00576819455603,"density_atomic":0.04194587726806043,"volume":572.1658852579234,"volume_molar":14.356931246221764,"formula_full":"Ag12 Te8 Au4","formula_reduced":"Ag3Te2Au","formula_anonymous":"AB2C3","energy_above_hull":0.260030813888889,"spacegroup":214}]}