{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4347","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4345","results":[{"id":"jvasp-35606","created_at":"2022-09-04T14:37:36.182838Z","updated_at":"2022-09-04T14:37:36.182865Z","structure_string":"Fe1 Cu2 Si1 Se4\n1.0\n5.570186 -0.000000 -0.000000\n0.000000 5.570186 0.000000\n-2.785093 -2.785093 5.524319\nFe Cu Si Se\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.250001 0.750001 0.500000 Cu\n0.750001 0.250001 0.500000 Cu\n0.500000 0.500000 0.000000 Si\n0.380329 0.380329 0.246301 Se\n0.865973 0.865973 0.246301 Se\n0.134029 0.619672 0.753700 Se\n0.619672 0.134029 0.753700 Se\n","nsites":8,"nelements":4,"elements":["Fe","Cu","Si","Se"],"chemical_system":"Cu-Fe-Se-Si","density":5.104206569187204,"density_atomic":0.046673658403677626,"volume":171.40289134416008,"volume_molar":12.902654229318971,"formula_full":"Fe1 Cu2 Si1 Se4","formula_reduced":"FeCu2SiSe4","formula_anonymous":"ABC2D4","energy_above_hull":1.6137573083333332,"spacegroup":121},{"id":"jvasp-57364","created_at":"2022-09-04T14:37:44.339160Z","updated_at":"2022-09-04T14:37:44.339169Z","structure_string":"Ho2 Mo2 Cl2 O8\n1.0\n6.069703 0.004370 1.516555\n1.771509 5.805434 1.516555\n0.012837 0.009512 6.830448\nHo Mo Cl O\n2 2 2 8\ndirect\n0.221725 0.221724 0.891195 Ho\n0.778275 0.778275 0.108804 Ho\n0.637495 0.637494 0.730250 Mo\n0.362506 0.362505 0.269749 Mo\n0.008930 0.008930 0.237531 Cl\n0.991071 0.991069 0.762468 Cl\n0.542895 0.542895 0.200323 O\n0.705122 0.705121 0.462946 O\n0.509668 0.890996 0.845969 O\n0.890997 0.509667 0.845969 O\n0.294878 0.294878 0.537053 O\n0.490333 0.109003 0.154030 O\n0.109003 0.490332 0.154030 O\n0.457105 0.457104 0.799676 O\n","nsites":14,"nelements":4,"elements":["Ho","Mo","Cl","O"],"chemical_system":"Cl-Ho-Mo-O","density":4.976551646063367,"density_atomic":0.05822211534554275,"volume":240.45845666910802,"volume_molar":10.343390521383782,"formula_full":"Ho2 Mo2 Cl2 O8","formula_reduced":"HoMoClO4","formula_anonymous":"ABCD4","energy_above_hull":2.4075442191666667,"spacegroup":12},{"id":"jvasp-47075","created_at":"2022-09-04T14:38:02.090580Z","updated_at":"2022-09-04T14:38:02.090600Z","structure_string":"Li1 V5 O7 F1\n1.0\n-0.000000 4.240071 4.240071\n4.240071 -0.000000 4.240071\n4.162602 4.162602 0.077470\nLi V O F\n1 5 7 1\ndirect\n0.241204 0.241204 0.276387 Li\n0.008021 0.008021 0.975938 V\n0.622411 0.622411 0.132769 V\n0.635239 0.122200 0.607319 V\n0.122200 0.635239 0.607319 V\n0.635239 0.635239 0.607319 V\n0.843707 0.380665 0.394961 O\n0.380665 0.380665 0.394961 O\n0.380665 0.843707 0.394961 O\n0.872538 0.872538 0.382386 O\n0.868136 0.394390 0.869338 O\n0.394390 0.868136 0.869338 O\n0.868136 0.868136 0.869338 O\n0.377446 0.377446 0.867661 F\n","nsites":14,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":4.397093744250485,"density_atomic":0.09441633362491547,"volume":148.27942859566355,"volume_molar":6.3782827915389655,"formula_full":"Li1 V5 O7 F1","formula_reduced":"LiV5O7F","formula_anonymous":"ABC5D7","energy_above_hull":3.290186127321429,"spacegroup":160},{"id":"jvasp-25817","created_at":"2022-09-04T14:37:43.559975Z","updated_at":"2022-09-04T14:37:43.559993Z","structure_string":"Ru2 Cl2 O4 F12\n1.0\n0.000000 7.077273 -0.290208\n5.678055 0.000000 0.000000\n0.000000 -6.726956 -6.729292\nRu Cl O F\n2 2 4 12\ndirect\n0.500000 0.011913 0.250000 Ru\n0.499999 -0.011913 0.750000 Ru\n-0.000000 0.363063 0.250000 Cl\n-0.000001 0.636936 0.750000 Cl\n0.870529 0.505141 0.577820 O\n0.870529 0.494858 0.077820 O\n0.129470 0.505141 0.922180 O\n0.129470 0.494858 0.422180 O\n0.804867 0.012468 0.508644 F\n0.625524 0.256598 0.195230 F\n0.360987 0.784021 0.298870 F\n0.195132 0.987531 0.491356 F\n0.639013 0.784021 0.201130 F\n0.195132 0.012468 -0.008644 F\n0.360986 0.215978 0.798870 F\n0.374476 0.256598 0.304771 F\n0.804868 0.987531 0.008644 F\n0.374475 0.743402 0.804770 F\n0.625524 0.743402 0.695229 F\n0.639012 0.215978 0.701130 F\n","nsites":20,"nelements":4,"elements":["Ru","Cl","O","F"],"chemical_system":"Cl-F-O-Ru","density":3.3329920292156596,"density_atomic":0.07104735935199188,"volume":281.5023694394249,"volume_molar":8.476234465188696,"formula_full":"Ru2 Cl2 O4 F12","formula_reduced":"RuCl(OF3)2","formula_anonymous":"ABC2D6","energy_above_hull":0.9090183262500005,"spacegroup":13},{"id":"jvasp-25651","created_at":"2022-09-04T14:37:43.489021Z","updated_at":"2022-09-04T14:37:43.489049Z","structure_string":"Na6 Ca4 Bi2 O12\n1.0\n5.793878 0.010766 -1.075908\n-2.266361 5.332236 -1.075909\n0.000318 0.000481 10.602848\nNa Ca Bi O\n6 4 2 12\ndirect\n0.962190 0.712191 0.424374 Na\n0.287811 0.037812 0.075627 Na\n0.037811 0.287811 0.575626 Na\n0.712190 0.962190 0.924373 Na\n0.875002 0.125000 0.250000 Na\n0.125000 0.875002 0.750000 Na\n0.455516 0.205515 0.411024 Ca\n0.205515 0.455516 0.911024 Ca\n0.794486 0.544485 0.088976 Ca\n0.544486 0.794486 0.588976 Ca\n0.375001 0.625001 0.250000 Bi\n0.625001 0.375001 0.750000 Bi\n0.769638 0.527970 0.593988 O\n0.324349 0.066016 0.593987 O\n0.933985 0.675652 0.906013 O\n0.472032 0.230363 0.906012 O\n0.066016 0.324349 0.093987 O\n0.149002 0.850999 0.250000 O\n0.230364 0.472032 0.406012 O\n0.850999 0.149002 0.750000 O\n0.399002 0.600999 0.750000 O\n0.527970 0.769639 0.093988 O\n0.675652 0.933985 0.406013 O\n0.600999 0.399002 0.250000 O\n","nsites":24,"nelements":4,"elements":["Na","Ca","Bi","O"],"chemical_system":"Bi-Ca-Na-O","density":4.60024082804528,"density_atomic":0.07320811067203162,"volume":327.83252811315816,"volume_molar":8.226056791683732,"formula_full":"Na6 Ca4 Bi2 O12","formula_reduced":"Na3Ca2BiO6","formula_anonymous":"AB2C3D6","energy_above_hull":1.0783444283333332,"spacegroup":70},{"id":"jvasp-91656","created_at":"2022-09-04T14:37:41.037087Z","updated_at":"2022-09-04T14:37:41.037117Z","structure_string":"Zr2 Si2 Cu2 As2\n1.0\n3.684474 -0.000000 0.000000\n0.000000 3.684474 -0.000000\n-0.000000 0.000000 9.752429\nZr Si Cu As\n2 2 2 2\ndirect\n0.749999 0.749999 0.778406 Zr\n0.250000 0.250000 0.221594 Zr\n0.250000 0.749999 0.000000 Si\n0.749999 0.250000 0.000000 Si\n0.749999 0.250000 0.500000 Cu\n0.250000 0.749999 0.500000 Cu\n0.749999 0.749999 0.320646 As\n0.250000 0.250000 0.679355 As\n","nsites":8,"nelements":4,"elements":["Zr","Si","Cu","As"],"chemical_system":"As-Cu-Si-Zr","density":6.466356392619438,"density_atomic":0.0604263271084008,"volume":132.39262392447804,"volume_molar":9.96608771073688,"formula_full":"Zr2 Si2 Cu2 As2","formula_reduced":"ZrCuSiAs","formula_anonymous":"ABCD","energy_above_hull":2.185103825,"spacegroup":129},{"id":"jvasp-58322","created_at":"2022-09-04T14:37:34.308663Z","updated_at":"2022-09-04T14:37:34.308690Z","structure_string":"K2 Li2 S2 O8\n1.0\n2.557026 -4.428899 0.000000\n2.557026 4.428899 -0.000000\n0.000000 0.000000 8.705875\nK Li S O\n2 2 2 8\ndirect\n0.000000 0.000000 0.989774 K\n0.000000 0.000000 0.489774 K\n0.333334 0.666668 0.803264 Li\n0.666668 0.333334 0.303264 Li\n0.333334 0.666668 0.192357 S\n0.666668 0.333334 0.692357 S\n0.337554 0.943317 0.247563 O\n0.943317 0.605765 0.747563 O\n0.333334 0.666668 0.021913 O\n0.605765 0.662449 0.247563 O\n0.666668 0.333334 0.521913 O\n0.056684 0.394237 0.247563 O\n0.662448 0.056684 0.747563 O\n0.394237 0.337553 0.747563 O\n","nsites":14,"nelements":4,"elements":["K","Li","S","O"],"chemical_system":"K-Li-O-S","density":2.3933468080357745,"density_atomic":0.07099940225520059,"volume":197.18475867836653,"volume_molar":8.481959803483964,"formula_full":"K2 Li2 S2 O8","formula_reduced":"KLiSO4","formula_anonymous":"ABCD4","energy_above_hull":1.555100285714286,"spacegroup":173},{"id":"jvasp-25649","created_at":"2022-09-04T14:37:43.470738Z","updated_at":"2022-09-04T14:37:43.470762Z","structure_string":"Na4 Bi8 Au4 O20\n1.0\n12.471278 -0.000000 0.000000\n0.000000 12.471278 0.000000\n0.000000 0.000000 3.608161\nNa Bi Au O\n4 8 4 20\ndirect\n0.801210 0.698790 0.500000 Na\n0.698790 0.198790 0.500000 Na\n0.198790 0.301210 0.500000 Na\n0.301210 0.801210 0.500000 Na\n0.769114 0.950560 -0.000068 Bi\n0.549441 0.730886 0.000068 Bi\n0.950560 0.230886 0.000068 Bi\n0.269114 0.549441 -0.000068 Bi\n0.230886 0.049441 -0.000068 Bi\n0.730886 0.450559 -0.000068 Bi\n0.049441 0.769114 0.000068 Bi\n0.450559 0.269114 0.000068 Bi\n0.000000 0.500000 0.500000 Au\n0.500000 0.500000 0.500000 Au\n0.500000 0.000000 0.500000 Au\n0.000000 0.000000 0.500000 Au\n0.286604 0.213396 0.000000 O\n0.883780 0.113808 0.500006 O\n0.786604 0.286604 0.000000 O\n0.886192 0.883780 0.499994 O\n0.386192 0.616220 0.499994 O\n0.616220 0.613808 0.500006 O\n0.613808 0.383780 0.499994 O\n0.504219 0.161095 0.500026 O\n0.213396 0.713396 0.000000 O\n0.713396 0.786604 0.000000 O\n0.838905 0.504219 0.499974 O\n0.113808 0.116220 0.499994 O\n0.495781 0.838905 0.500026 O\n0.995781 0.661095 0.500026 O\n0.383780 0.386192 0.500006 O\n0.116220 0.886192 0.500006 O\n0.338905 0.995781 0.499974 O\n0.161095 0.495781 0.499974 O\n0.661095 0.004219 0.499974 O\n0.004219 0.338905 0.500026 O\n","nsites":36,"nelements":4,"elements":["Na","Bi","Au","O"],"chemical_system":"Au-Bi-Na-O","density":8.497159421504,"density_atomic":0.06414970627694323,"volume":561.1872928082161,"volume_molar":9.387635750040035,"formula_full":"Na4 Bi8 Au4 O20","formula_reduced":"NaBi2AuO5","formula_anonymous":"ABC2D5","energy_above_hull":1.654132518888889,"spacegroup":127},{"id":"jvasp-30750","created_at":"2022-09-04T14:38:01.290150Z","updated_at":"2022-09-04T14:38:01.290171Z","structure_string":"Mg4 Ti4 Ge8 O24\n1.0\n5.119917 0.000000 -1.575384\n0.000000 8.484471 0.000000\n-0.206084 0.000000 12.049148\nMg Ti Ge O\n4 4 8 24\ndirect\n0.411672 0.457705 0.257713 Mg\n0.088329 0.957705 0.742287 Mg\n0.588329 0.542295 0.742288 Mg\n0.911672 0.042295 0.257713 Mg\n0.917550 0.656235 0.275185 Ti\n0.582451 0.156235 0.724816 Ti\n0.082451 0.343765 0.724816 Ti\n0.417550 0.843765 0.275184 Ti\n0.714154 0.150381 0.469183 Ge\n0.785848 0.650381 0.530818 Ge\n0.214153 0.349619 0.469183 Ge\n0.285848 0.849619 0.530818 Ge\n0.230542 0.647338 0.925530 Ge\n0.730543 0.852662 0.925530 Ge\n0.769459 0.352662 0.074471 Ge\n0.269459 0.147338 0.074471 Ge\n0.216071 0.003490 0.194892 O\n0.144471 0.851405 0.377882 O\n0.355531 0.351405 0.622119 O\n0.309191 0.164226 0.789687 O\n0.190810 0.664226 0.210313 O\n0.690811 0.835773 0.210313 O\n0.809191 0.335773 0.789688 O\n0.716071 0.496510 0.194893 O\n0.783930 -0.003490 0.805108 O\n0.283930 0.503490 0.805108 O\n0.133662 0.537285 0.411356 O\n0.965941 0.203911 0.403262 O\n0.866339 0.462715 0.588645 O\n0.633662 0.962715 0.411356 O\n0.638837 0.183401 0.153737 O\n0.861165 0.683401 0.846264 O\n0.361165 0.816598 0.846264 O\n0.138836 0.316599 0.153737 O\n0.644471 0.648595 0.377882 O\n0.534061 0.703911 0.596739 O\n0.034060 0.796089 0.596739 O\n0.465941 0.296089 0.403261 O\n0.366339 0.037285 0.588645 O\n0.855531 0.148595 0.622119 O\n","nsites":40,"nelements":4,"elements":["Mg","Ti","Ge","O"],"chemical_system":"Ge-Mg-O-Ti","density":3.998735966271415,"density_atomic":0.0768258854066026,"volume":520.6578458328097,"volume_molar":7.838687088508898,"formula_full":"Mg4 Ti4 Ge8 O24","formula_reduced":"MgTi(GeO3)2","formula_anonymous":"ABC2D6","energy_above_hull":2.0470680283333333,"spacegroup":14},{"id":"jvasp-28794","created_at":"2022-09-04T14:37:43.432220Z","updated_at":"2022-09-04T14:37:43.432228Z","structure_string":"Te2 Mo3 W1 S6\n1.0\n3.283302 0.000000 0.000000\n-1.641651 2.843503 -0.000167\n0.000000 -0.002702 36.295320\nTe Mo W S\n2 3 1 6\ndirect\n0.333434 0.666868 0.710928 Te\n0.333305 0.666611 0.604171 Te\n0.333314 0.666627 0.093935 Mo\n0.333301 0.666602 0.469559 Mo\n0.666698 0.333396 0.281761 Mo\n0.666695 0.333391 0.657678 W\n0.333364 0.666730 0.324254 S\n0.666604 0.333209 0.051685 S\n0.666611 0.333221 0.427146 S\n0.666684 0.333369 0.136382 S\n0.666692 0.333382 0.511878 S\n0.333296 0.666592 0.239369 S\n","nsites":12,"nelements":4,"elements":["Te","Mo","W","S"],"chemical_system":"Mo-S-Te-W","density":4.504717764269196,"density_atomic":0.03541327534822057,"volume":338.85597652302357,"volume_molar":17.00531989990753,"formula_full":"Te2 Mo3 W1 S6","formula_reduced":"Te2Mo3WS6","formula_anonymous":"AB2C3D6","energy_above_hull":3.920685269444444,"spacegroup":156},{"id":"jvasp-59491","created_at":"2022-09-04T14:37:40.964653Z","updated_at":"2022-09-04T14:37:40.964680Z","structure_string":"Ba2 Sm4 Fe2 S10\n1.0\n6.971284 0.000000 -3.457935\n-1.715224 6.756983 -3.457935\n-0.033112 -0.042567 8.689356\nBa Sm Fe S\n2 4 2 10\ndirect\n0.250000 0.250000 0.500000 Ba\n0.750000 0.750000 0.500001 Ba\n0.338868 0.161132 0.000000 Sm\n0.161132 0.661132 0.000000 Sm\n0.661132 0.838868 0.000001 Sm\n0.838868 0.338868 0.000000 Sm\n0.250000 0.750000 0.500001 Fe\n0.750000 0.250000 0.500001 Fe\n0.500000 0.500000 0.000000 S\n0.485658 0.985657 0.268840 S\n0.985657 0.783181 0.268841 S\n0.283181 0.485657 0.268840 S\n0.014343 0.216818 0.731161 S\n0.716819 0.514342 0.731161 S\n0.514342 0.014342 0.731161 S\n0.216819 0.716818 0.731161 S\n0.783181 0.283181 0.268840 S\n0.000000 0.000000 0.000000 S\n","nsites":18,"nelements":4,"elements":["Ba","Sm","Fe","S"],"chemical_system":"Ba-Fe-S-Sm","density":5.334954754906199,"density_atomic":0.04419797046552017,"volume":407.25851912232497,"volume_molar":13.625378488132181,"formula_full":"Ba2 Sm4 Fe2 S10","formula_reduced":"BaSm2FeS5","formula_anonymous":"ABC2D5","energy_above_hull":1.8614310244444447,"spacegroup":140},{"id":"jvasp-48234","created_at":"2022-09-04T14:37:40.707352Z","updated_at":"2022-09-04T14:37:40.707378Z","structure_string":"Li4 Cr4 Si4 O16\n1.0\n4.737054 0.000000 0.000000\n0.000000 5.707988 0.000000\n0.000000 0.000000 10.074709\nLi Cr Si O\n4 4 4 16\ndirect\n-0.000012 0.256415 0.500080 Li\n0.500011 0.256415 0.000080 Li\n0.499988 0.756415 0.999920 Li\n0.000012 0.756415 0.499920 Li\n0.001876 0.006551 0.231961 Cr\n0.498123 0.006551 0.731961 Cr\n0.501876 0.506551 0.268039 Cr\n-0.001876 0.506551 0.768039 Cr\n0.941225 0.006549 0.907926 Si\n0.558774 0.006549 0.407926 Si\n0.441225 0.506549 0.592074 Si\n0.058774 0.506549 0.092074 Si\n0.777582 0.226776 0.828002 O\n0.782657 0.506536 0.598883 O\n0.717341 0.506536 0.098883 O\n0.722416 0.226776 0.328002 O\n0.722433 0.786312 0.328011 O\n0.690134 0.006554 0.558081 O\n0.309865 0.506554 0.441919 O\n0.222433 0.286312 0.171989 O\n0.277583 0.726776 0.671998 O\n0.282658 0.006536 0.901117 O\n0.217342 0.006536 0.401117 O\n0.222417 0.726776 0.171998 O\n0.777566 0.786312 0.828011 O\n0.190135 0.506554 0.941920 O\n0.277566 0.286312 0.671989 O\n0.809865 0.006554 0.058081 O\n","nsites":28,"nelements":4,"elements":["Li","Cr","Si","O"],"chemical_system":"Cr-Li-O-Si","density":3.6823090238662903,"density_atomic":0.10278603981350203,"volume":272.4105340647817,"volume_molar":5.858909216588894,"formula_full":"Li4 Cr4 Si4 O16","formula_reduced":"LiCrSiO4","formula_anonymous":"ABCD4","energy_above_hull":2.6165242857142865,"spacegroup":62}]}