{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=created_at&page=3381","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=created_at&page=3379","results":[{"id":"jvasp-52091","created_at":"2022-09-04T14:38:06.590063Z","updated_at":"2022-09-04T14:38:06.590094Z","structure_string":"Dy3 Co11 B4\n1.0\n2.500804 -4.331520 -0.000000\n2.500804 4.331520 -0.000000\n-0.000000 0.000000 9.792023\nDy Co B\n3 11 4\ndirect\n0.000000 0.000000 0.341495 Dy\n0.000000 0.000000 0.658504 Dy\n0.000000 0.000000 0.000000 Dy\n-0.000000 0.500000 0.500000 Co\n0.666666 0.333332 0.000000 Co\n0.333332 0.666666 0.000000 Co\n0.500000 -0.000000 0.200860 Co\n0.499999 0.499999 0.200860 Co\n-0.000000 0.500000 0.200860 Co\n0.500000 -0.000000 0.799139 Co\n0.499999 0.499999 0.799139 Co\n-0.000000 0.500000 0.799139 Co\n0.500000 -0.000000 0.500000 Co\n0.499999 0.499999 0.500000 Co\n0.333332 0.666666 0.348924 B\n0.666666 0.333332 0.348924 B\n0.666666 0.333332 0.651076 B\n0.333332 0.666666 0.651076 B\n","nsites":18,"nelements":3,"elements":["Dy","Co","B"],"chemical_system":"B-Co-Dy","density":9.228771034434924,"density_atomic":0.08484965976637225,"volume":212.1399195890917,"volume_molar":7.097424758781064,"formula_full":"Dy3 Co11 B4","formula_reduced":"Dy3Co11B4","formula_anonymous":"A3B4C11","energy_above_hull":4.047874429629629,"spacegroup":191},{"id":"jvasp-12478","created_at":"2022-09-04T14:38:06.590511Z","updated_at":"2022-09-04T14:38:06.590521Z","structure_string":"Sr2 Zn2 Cl8\n1.0\n6.020087 -0.000001 -2.482326\n-1.023564 5.932433 -2.482327\n-0.003062 -0.003635 8.533630\nSr Zn Cl\n2 2 8\ndirect\n0.875001 0.625000 0.750000 Sr\n0.125000 0.375000 0.250000 Sr\n0.625001 0.875000 0.250000 Zn\n0.375001 0.125001 0.750000 Zn\n0.716837 0.364858 0.914685 Cl\n0.864858 0.697849 0.414685 Cl\n0.283165 0.635143 0.085315 Cl\n0.450174 0.783165 0.585315 Cl\n0.549828 0.216836 0.414685 Cl\n0.802153 0.950173 0.085315 Cl\n0.135143 0.302152 0.585315 Cl\n0.197849 0.049828 0.914685 Cl\n","nsites":12,"nelements":3,"elements":["Sr","Zn","Cl"],"chemical_system":"Cl-Sr-Zn","density":3.2140484129593583,"density_atomic":0.039388250532967996,"volume":304.6593803387127,"volume_molar":15.289180602117538,"formula_full":"Sr2 Zn2 Cl8","formula_reduced":"SrZnCl4","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":88},{"id":"jvasp-38590","created_at":"2022-09-04T14:38:06.601605Z","updated_at":"2022-09-04T14:38:06.601615Z","structure_string":"Li1 Lu1 Hg2\n1.0\n-0.000000 3.480703 3.480703\n3.480703 -0.000000 3.480703\n3.480703 3.480703 0.000000\nLi Lu Hg\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Li\n0.749999 0.749999 0.749999 Lu\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n","nsites":4,"nelements":3,"elements":["Li","Lu","Hg"],"chemical_system":"Hg-Li-Lu","density":11.480275303289147,"density_atomic":0.04742737553429384,"volume":84.33947598697878,"volume_molar":12.697604900455653,"formula_full":"Li1 Lu1 Hg2","formula_reduced":"LiLuHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-109483","created_at":"2022-09-04T14:38:06.604830Z","updated_at":"2022-09-04T14:38:06.604857Z","structure_string":"K1 Na2 Ir1 F6\n1.0\n5.427354 -0.000000 3.133484\n1.809118 5.116958 3.133484\n-0.000000 -0.000000 6.266969\nK Na Ir F\n1 2 1 6\ndirect\n0.500000 0.500000 0.499999 K\n0.750000 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ir\n0.771998 0.228002 0.228001 F\n0.228001 0.228002 0.771998 F\n0.228002 0.771999 0.771998 F\n0.228002 0.771999 0.228001 F\n0.771998 0.228002 0.771998 F\n0.771998 0.771999 0.228001 F\n","nsites":10,"nelements":4,"elements":["K","Na","Ir","F"],"chemical_system":"F-Ir-K-Na","density":3.7332324731231497,"density_atomic":0.057456934563349944,"volume":174.04339573623372,"volume_molar":10.48113827471983,"formula_full":"K1 Na2 Ir1 F6","formula_reduced":"KNa2IrF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-35244","created_at":"2022-09-04T14:38:06.606671Z","updated_at":"2022-09-04T14:38:06.606704Z","structure_string":"Al1 Cu1\n1.0\n2.997266 -0.000000 -0.000000\n0.000000 2.997266 -0.000000\n-0.000000 0.000000 2.997266\nAl Cu\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.500001 Cu\n","nsites":2,"nelements":2,"elements":["Al","Cu"],"chemical_system":"Al-Cu","density":5.582824144555491,"density_atomic":0.07427696227777103,"volume":26.926249252368024,"volume_molar":8.107683156830252,"formula_full":"Al1 Cu1","formula_reduced":"AlCu","formula_anonymous":"AB","energy_above_hull":0.3559166250000001,"spacegroup":221},{"id":"jvasp-37554","created_at":"2022-09-04T14:38:06.611450Z","updated_at":"2022-09-04T14:38:06.611460Z","structure_string":"Tm1 Hf1 Ir2\n1.0\n-0.000000 3.322639 3.322639\n3.322639 -0.000000 3.322639\n3.322639 3.322639 0.000000\nTm Hf Ir\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Tm\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 Ir\n","nsites":4,"nelements":3,"elements":["Tm","Hf","Ir"],"chemical_system":"Hf-Ir-Tm","density":16.565195885226792,"density_atomic":0.05452309751217124,"volume":73.36340344763201,"volume_molar":11.045118554857732,"formula_full":"Tm1 Hf1 Ir2","formula_reduced":"TmHfIr2","formula_anonymous":"ABC2","energy_above_hull":3.769744862500001,"spacegroup":225},{"id":"jvasp-30332","created_at":"2022-09-04T14:38:06.614522Z","updated_at":"2022-09-04T14:38:06.614540Z","structure_string":"Rb2 Fe4 O7\n1.0\n5.082191 0.000072 -0.000019\n-2.541033 4.401309 0.000006\n-0.000025 -0.000007 6.766271\nRb Fe O\n2 4 7\ndirect\n0.333333 0.666649 1.000000 Rb\n0.666665 0.333314 1.000000 Rb\n-0.000001 0.999984 0.271252 Fe\n0.000001 0.999986 0.728750 Fe\n0.333333 0.666651 0.500000 Fe\n0.666666 0.333319 0.500000 Fe\n0.000000 0.652625 0.347320 O\n-0.000001 0.347344 0.652681 O\n0.000001 0.999983 0.000001 O\n0.347362 0.347348 0.347320 O\n0.652637 0.652622 0.652681 O\n0.347360 0.999984 0.652682 O\n0.652640 0.999986 0.347319 O\n","nsites":13,"nelements":3,"elements":["Rb","Fe","O"],"chemical_system":"Fe-O-Rb","density":5.554961082328817,"density_atomic":0.08589296001505523,"volume":151.35117008100983,"volume_molar":7.0112157724503215,"formula_full":"Rb2 Fe4 O7","formula_reduced":"Rb2Fe4O7","formula_anonymous":"A2B4C7","energy_above_hull":2.610504346153846,"spacegroup":162},{"id":"jvasp-55661","created_at":"2022-09-04T14:38:06.618000Z","updated_at":"2022-09-04T14:38:06.618010Z","structure_string":"Al4 Cu2 Cl16\n1.0\n0.000000 6.361378 -0.127935\n7.344998 0.000000 0.000000\n0.000000 -0.967152 -12.074172\nAl Cu Cl\n4 2 16\ndirect\n0.810639 0.736044 0.812492 Al\n0.810639 0.763956 0.312492 Al\n0.189362 0.263956 0.187509 Al\n0.189362 0.236044 0.687509 Al\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.646569 -0.004976 0.362645 Cl\n0.353431 0.495024 0.137355 Cl\n0.353431 0.004976 0.637355 Cl\n0.646569 0.504976 0.862645 Cl\n0.169361 0.229446 0.361219 Cl\n0.830640 0.729446 0.138782 Cl\n0.830640 0.770554 0.638782 Cl\n0.309633 0.010294 0.113613 Cl\n0.690367 0.510294 0.386387 Cl\n0.129260 0.761068 0.896699 Cl\n0.309633 0.489706 0.613613 Cl\n0.690367 0.989706 0.886387 Cl\n0.870741 0.238932 0.103301 Cl\n0.129260 0.738932 0.396699 Cl\n0.169361 0.270554 0.861218 Cl\n0.870741 0.261068 0.603301 Cl\n","nsites":22,"nelements":3,"elements":["Al","Cu","Cl"],"chemical_system":"Al-Cl-Cu","density":2.357589954175605,"density_atomic":0.03893349441202668,"volume":565.0661553051896,"volume_molar":15.467763299817602,"formula_full":"Al4 Cu2 Cl16","formula_reduced":"Al2CuCl8","formula_anonymous":"AB2C8","energy_above_hull":0.2954289627272727,"spacegroup":14},{"id":"jvasp-38398","created_at":"2022-09-04T14:38:06.619092Z","updated_at":"2022-09-04T14:38:06.619113Z","structure_string":"Li2 Tm6\n1.0\n0.000000 6.823001 0.001064\n5.386589 0.000000 0.000000\n0.000000 -3.411222 -5.909443\nLi Tm\n2 6\ndirect\n0.333332 0.250000 0.666655 Li\n0.666668 0.750000 0.333345 Li\n0.167892 0.750000 0.335800 Tm\n0.167902 0.750000 0.832129 Tm\n0.664220 0.750000 0.832140 Tm\n0.832109 0.250000 0.664200 Tm\n0.832099 0.250000 0.167871 Tm\n0.335780 0.250000 0.167860 Tm\n","nsites":8,"nelements":2,"elements":["Li","Tm"],"chemical_system":"Li-Tm","density":7.856494602242627,"density_atomic":0.03683776391834631,"volume":217.1684475130631,"volume_molar":16.347736994429226,"formula_full":"Li2 Tm6","formula_reduced":"LiTm3","formula_anonymous":"AB3","energy_above_hull":1.2286156875,"spacegroup":194},{"id":"jvasp-12247","created_at":"2022-09-04T14:38:06.619507Z","updated_at":"2022-09-04T14:38:06.619529Z","structure_string":"Zn2 Cr4 O8\n1.0\n5.139208 0.000000 2.967123\n1.713069 4.845292 2.967123\n0.000000 0.000000 5.934246\nZn Cr O\n2 4 8\ndirect\n0.875001 0.875000 0.875000 Zn\n0.125000 0.125000 0.125000 Zn\n0.500000 -0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 -0.000001 Cr\n0.500000 0.500000 0.500000 Cr\n0.737946 0.737945 0.737945 O\n0.262055 0.262055 0.713837 O\n0.262055 0.713836 0.262054 O\n0.713837 0.262055 0.262054 O\n0.737946 0.286163 0.737945 O\n0.286164 0.737945 0.737945 O\n0.262055 0.262055 0.262055 O\n0.737946 0.737945 0.286163 O\n","nsites":14,"nelements":3,"elements":["Zn","Cr","O"],"chemical_system":"Cr-O-Zn","density":5.245610211881609,"density_atomic":0.09474282710653552,"volume":147.76844250443796,"volume_molar":6.3563025760549445,"formula_full":"Zn2 Cr4 O8","formula_reduced":"ZnCr2O4","formula_anonymous":"AB2C4","energy_above_hull":2.5863456000000005,"spacegroup":227},{"id":"jvasp-30106","created_at":"2022-09-04T14:38:06.624863Z","updated_at":"2022-09-04T14:38:06.624882Z","structure_string":"U2 B8 H32\n1.0\n3.966353 3.890931 -0.000000\n-3.966353 3.890931 -0.000000\n0.000000 0.000000 11.631742\nU B H\n2 8 32\ndirect\n0.304816 0.304816 0.250000 U\n0.695184 0.695184 0.750000 U\n0.382333 0.809988 0.250000 B\n0.190012 0.617667 0.750000 B\n0.617667 0.190012 0.750000 B\n0.809988 0.382333 0.250000 B\n0.234387 0.234387 0.038942 B\n0.765613 0.765613 0.961058 B\n0.234387 0.234387 0.461058 B\n0.765613 0.765613 0.538942 B\n0.893373 0.893373 0.896654 H\n0.106627 0.106627 0.396654 H\n0.893373 0.893373 0.603346 H\n0.444763 0.192315 0.070396 H\n0.807685 0.555236 0.929604 H\n0.444763 0.192315 0.429604 H\n0.192315 0.444763 0.429604 H\n0.555236 0.807685 0.929604 H\n0.192315 0.444763 0.070396 H\n0.555236 0.807685 0.570396 H\n0.106627 0.106627 0.103346 H\n0.801686 0.801686 0.061107 H\n0.198313 0.198313 0.938893 H\n0.807685 0.555236 0.570396 H\n0.688592 0.394232 0.161878 H\n0.394232 0.688592 0.161878 H\n0.688592 0.394232 0.338122 H\n0.605768 0.311408 0.661878 H\n0.311408 0.605768 0.838121 H\n0.801686 0.801686 0.438893 H\n0.311408 0.605768 0.661878 H\n0.394232 0.688592 0.338122 H\n0.909112 0.184254 0.250000 H\n0.815745 0.090887 0.750000 H\n0.090887 0.815745 0.750000 H\n0.184254 0.909112 0.250000 H\n0.959219 0.550365 0.250000 H\n0.449634 0.040781 0.750000 H\n0.040781 0.449634 0.750000 H\n0.550365 0.959219 0.250000 H\n0.605768 0.311408 0.838121 H\n0.198313 0.198313 0.561107 H\n","nsites":42,"nelements":3,"elements":["U","B","H"],"chemical_system":"B-H-U","density":2.7510617300183693,"density_atomic":0.11698485512531044,"volume":359.02083184195885,"volume_molar":5.147795202677538,"formula_full":"U2 B8 H32","formula_reduced":"U(BH4)4","formula_anonymous":"AB4C16","energy_above_hull":3.9186374444444447,"spacegroup":63},{"id":"jvasp-18342","created_at":"2022-09-04T14:38:06.625990Z","updated_at":"2022-09-04T14:38:06.626021Z","structure_string":"Pr1 Bi1\n1.0\n4.011106 -0.000000 2.315814\n1.337035 3.781707 2.315814\n-0.000000 -0.000000 4.631626\nPr Bi\n1 1\ndirect\n0.500001 0.500000 0.499999 Pr\n0.000000 0.000000 0.000000 Bi\n","nsites":2,"nelements":2,"elements":["Pr","Bi"],"chemical_system":"Bi-Pr","density":8.269756225451658,"density_atomic":0.028467183179172063,"volume":70.25633647741076,"volume_molar":21.154677377444507,"formula_full":"Pr1 Bi1","formula_reduced":"PrBi","formula_anonymous":"AB","energy_above_hull":0.3579270750000001,"spacegroup":225}]}