{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4588","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=4586","results":[{"id":"jvasp-29175","created_at":"2022-09-04T14:38:34.979788Z","updated_at":"2022-09-04T14:38:34.979815Z","structure_string":"Te2 Mo1 W3 Se4 S2\n1.0\n3.353544 -0.000002 0.000005\n-1.676773 2.904235 0.000009\n0.000061 0.000149 37.882285\nTe Mo W Se S\n2 1 3 4 2\ndirect\n0.333357 0.666717 0.707742 Te\n0.333356 0.666709 0.607242 Te\n0.333316 0.666627 0.093934 Mo\n0.333318 0.666636 0.469611 W\n0.666679 0.333361 0.281809 W\n0.666688 0.333380 0.657595 W\n0.666641 0.333281 0.050206 Se\n0.666639 0.333280 0.425396 Se\n0.666649 0.333297 0.137878 Se\n0.666647 0.333293 0.513761 Se\n0.333359 0.666716 0.322066 S\n0.333348 0.666701 0.241510 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":5.77269629651336,"density_atomic":0.03252441281524478,"volume":368.95362471771926,"volume_molar":18.515755516352673,"formula_full":"Te2 Mo1 W3 Se4 S2","formula_reduced":"Te2MoW3(Se2S)2","formula_anonymous":"AB2C2D3E4","energy_above_hull":4.124646241666667,"spacegroup":156},{"id":"jvasp-113075","created_at":"2022-09-04T14:38:46.573564Z","updated_at":"2022-09-04T14:38:46.573600Z","structure_string":"Na1 Dy3 Ti2 Sb2 O14\n1.0\n6.312309 0.002006 3.551793\n2.051147 5.969761 3.551793\n0.003888 0.002776 7.196117\nNa Dy Ti Sb O\n1 3 2 2 14\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Dy\n0.500000 0.000000 -0.000000 Dy\n0.000000 0.500000 -0.000000 Dy\n0.500000 0.500001 0.499999 Ti\n0.500000 0.500000 -0.000001 Ti\n0.000000 0.500000 0.500000 Sb\n0.500000 0.000001 0.500000 Sb\n0.421209 0.825836 0.420094 O\n0.823547 0.436678 0.826142 O\n0.436677 0.823548 0.826142 O\n0.825836 0.421209 0.420094 O\n0.831821 0.831821 0.424878 O\n0.428600 0.428600 0.819162 O\n0.174165 0.578792 0.579905 O\n0.176453 0.563323 0.173857 O\n0.563323 0.176454 0.173857 O\n0.867534 0.867534 0.870448 O\n0.168179 0.168180 0.575121 O\n0.571401 0.571401 0.180837 O\n0.578792 0.174165 0.579905 O\n0.132467 0.132467 0.129550 O\n","nsites":22,"nelements":5,"elements":["Na","Dy","Ti","Sb","O"],"chemical_system":"Dy-Na-O-Sb-Ti","density":6.578845840564957,"density_atomic":0.08117569844705541,"volume":271.0170706365882,"volume_molar":7.418649762438168,"formula_full":"Na1 Dy3 Ti2 Sb2 O14","formula_reduced":"NaDy3Ti2(SbO7)2","formula_anonymous":"AB2C2D3E14","energy_above_hull":2.647657562121212,"spacegroup":12},{"id":"jvasp-116771","created_at":"2022-09-04T14:38:45.520195Z","updated_at":"2022-09-04T14:38:45.520222Z","structure_string":"La2 Mn2 Zn2 Fe2 O12\n1.0\n5.473068 0.000096 -0.000035\n0.000105 5.272940 -0.006828\n-0.000016 0.013985 7.536287\nLa Mn Zn Fe O\n2 2 2 2 12\ndirect\n0.005267 0.991840 0.250022 La\n0.494698 0.492165 0.750022 La\n0.500673 0.000578 0.499889 Mn\n0.999326 0.500503 -0.000109 Mn\n0.503620 0.529284 0.250268 Zn\n0.996382 0.029305 0.750277 Zn\n0.500992 0.000678 0.000433 Fe\n0.999003 0.500569 0.500425 Fe\n0.732278 0.735642 0.444203 O\n0.767680 0.235720 0.944184 O\n0.763259 0.228242 0.555413 O\n0.503004 0.927673 0.745253 O\n0.498102 0.139894 0.254982 O\n0.224048 0.226808 0.944377 O\n0.271168 0.719301 0.055131 O\n0.228865 0.219365 0.555144 O\n0.736758 0.728218 0.055410 O\n0.001901 0.639915 0.754987 O\n0.275916 0.726810 0.444441 O\n0.997052 0.427505 0.245252 O\n","nsites":20,"nelements":5,"elements":["La","Mn","Zn","Fe","O"],"chemical_system":"Fe-La-Mn-O-Zn","density":6.27737387149051,"density_atomic":0.09195764688058199,"volume":217.49142870056684,"volume_molar":6.548819988641587,"formula_full":"La2 Mn2 Zn2 Fe2 O12","formula_reduced":"LaMnZnFeO6","formula_anonymous":"ABCDE6","energy_above_hull":2.474827914137931,"spacegroup":7},{"id":"jvasp-116892","created_at":"2022-09-04T14:38:34.729084Z","updated_at":"2022-09-04T14:38:34.729110Z","structure_string":"Na5 Ni2 P2 C2 O14\n1.0\n6.472785 -0.000000 0.000000\n0.000000 5.084320 0.121404\n-0.000000 -0.045407 8.855976\nNa Ni P C O\n5 2 2 2 14\ndirect\n0.262732 0.240202 0.257030 Na\n0.737268 0.240202 0.257030 Na\n0.753687 0.756425 0.741540 Na\n0.246312 0.756425 0.741540 Na\n-0.000000 0.228743 0.923297 Na\n-0.000000 0.777272 0.350869 Ni\n0.500000 0.221785 0.653381 Ni\n-0.000000 0.295063 0.580915 P\n0.500000 0.707113 0.420595 P\n-0.000000 0.720185 0.067962 C\n0.500000 0.280675 0.927216 C\n-0.000000 0.600059 0.553951 O\n0.500000 0.483215 0.834289 O\n0.187562 0.217727 0.683085 O\n0.812437 0.217727 0.683085 O\n0.500000 0.849295 0.572818 O\n0.500000 0.400926 0.454424 O\n-0.000000 0.944146 0.137491 O\n0.691896 0.778604 0.323836 O\n0.308104 0.778604 0.323836 O\n-0.000000 0.507925 0.150963 O\n0.500000 0.055132 0.855880 O\n0.500000 0.294241 0.068474 O\n-0.000000 0.157425 0.428537 O\n-0.000000 0.713931 0.922912 O\n","nsites":25,"nelements":5,"elements":["Na","Ni","P","C","O"],"chemical_system":"C-Na-Ni-O-P","density":3.089384607989215,"density_atomic":0.0857682111409479,"volume":291.483285793568,"volume_molar":7.021413504944699,"formula_full":"Na5 Ni2 P2 C2 O14","formula_reduced":"Na5Ni2P2(CO7)2","formula_anonymous":"A2B2C2D5E14","energy_above_hull":2.4962419920000007,"spacegroup":6},{"id":"jvasp-26005","created_at":"2022-09-04T14:38:35.427338Z","updated_at":"2022-09-04T14:38:35.427360Z","structure_string":"Ti1 Mn1 H12 O6 F6\n1.0\n6.479960 0.002749 -0.679921\n-0.755280 6.435795 -0.679921\n0.002444 0.002749 6.515533\nTi Mn H O F\n1 1 12 6 6\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Mn\n0.806825 0.588755 0.949130 H\n0.411245 0.050870 0.193175 H\n0.050869 0.193174 0.411245 H\n0.193174 0.411245 0.050870 H\n0.675866 0.190629 0.819328 H\n0.190628 0.819328 0.675866 H\n0.819328 0.675866 0.190629 H\n0.324133 0.809371 0.180672 H\n0.809371 0.180672 0.324134 H\n0.180671 0.324134 0.809371 H\n0.588754 0.949130 0.806825 H\n0.949130 0.806825 0.588755 H\n0.694982 0.059391 0.878451 O\n0.878451 0.694982 0.059390 O\n0.305018 0.940609 0.121549 O\n0.940609 0.121549 0.305018 O\n0.121548 0.305018 0.940609 O\n0.059390 0.878451 0.694982 O\n0.656424 0.431075 0.741137 F\n0.431075 0.741137 0.656424 F\n0.741137 0.656424 0.431075 F\n0.343575 0.568924 0.258863 F\n0.568924 0.258863 0.343575 F\n0.258862 0.343575 0.568924 F\n","nsites":26,"nelements":5,"elements":["Ti","Mn","H","O","F"],"chemical_system":"F-H-Mn-O-Ti","density":1.9851660085077159,"density_atomic":0.09567281536732383,"volume":271.75953691940856,"volume_molar":6.2945160930811355,"formula_full":"Ti1 Mn1 H12 O6 F6","formula_reduced":"TiMnH12(OF)6","formula_anonymous":"ABC6D6E12","energy_above_hull":2.520441471912025,"spacegroup":148},{"id":"jvasp-46708","created_at":"2022-09-04T14:38:34.569162Z","updated_at":"2022-09-04T14:38:34.569189Z","structure_string":"Li4 Al2 P2 C2 O14\n1.0\n0.000000 4.960440 0.020182\n6.173523 0.000000 0.000000\n0.000000 -0.574446 -8.294322\nLi Al P C O\n4 2 2 2 14\ndirect\n0.776467 0.015455 0.210286 Li\n0.776467 0.484545 0.210286 Li\n0.223532 0.515455 0.789714 Li\n0.223532 0.984544 0.789714 Li\n0.208450 0.250000 0.345846 Al\n0.791549 0.750000 0.654154 Al\n0.272784 0.750000 0.423470 P\n0.727215 0.250000 0.576530 P\n0.266992 0.250000 0.060036 C\n0.733007 0.750000 0.939964 C\n0.535096 0.750000 0.823971 O\n0.818210 0.050391 0.675428 O\n0.818210 0.449609 0.675428 O\n0.143718 0.750000 0.588065 O\n0.415771 0.250000 0.539053 O\n0.584228 0.750000 0.460947 O\n0.028036 0.250000 0.116776 O\n0.181789 0.550390 0.324572 O\n0.181789 0.949609 0.324572 O\n0.464903 0.250000 0.176030 O\n0.971963 0.750000 0.883224 O\n0.691932 0.750000 0.088000 O\n0.856281 0.250000 0.411935 O\n0.308067 0.250000 0.912000 O\n","nsites":24,"nelements":5,"elements":["Li","Al","P","C","O"],"chemical_system":"Al-C-Li-O-P","density":2.5613985082451856,"density_atomic":0.0945147243906404,"volume":253.92868841055065,"volume_molar":6.371642935877153,"formula_full":"Li4 Al2 P2 C2 O14","formula_reduced":"Li2AlPCO7","formula_anonymous":"ABCD2E7","energy_above_hull":2.745332733333333,"spacegroup":11},{"id":"jvasp-44406","created_at":"2022-09-04T14:38:35.315438Z","updated_at":"2022-09-04T14:38:35.315467Z","structure_string":"Li4 V3 Cr3 W2 O16\n1.0\n5.861128 -0.001352 0.000286\n-2.929384 5.073737 0.017154\n-0.000131 0.017556 9.589778\nLi V Cr W O\n4 3 3 2 16\ndirect\n0.331564 0.663152 0.096264 Li\n0.001754 0.003533 0.007327 Li\n0.993778 0.987590 0.506856 Li\n0.664097 0.328212 0.599927 Li\n0.174387 0.348788 0.782016 V\n0.344310 0.165735 0.285780 V\n0.821410 0.165740 0.285778 V\n0.661863 0.832220 0.785667 Cr\n0.830869 0.661751 0.286609 Cr\n0.170339 0.832223 0.785670 Cr\n0.327321 0.654671 0.514726 W\n0.667290 0.334608 0.010213 W\n0.832324 0.664675 0.906909 O\n0.339874 0.173164 0.905550 O\n0.667099 0.334226 0.397688 O\n0.960253 0.483167 0.156595 O\n0.522894 0.483172 0.156601 O\n0.165725 0.331480 0.406088 O\n0.493868 0.525549 0.654969 O\n0.479873 0.959754 0.660006 O\n0.655737 0.828275 0.405271 O\n0.001761 0.003529 0.193027 O\n0.001158 0.002320 0.690346 O\n0.336148 0.672329 0.895794 O\n0.516591 0.033195 0.150682 O\n0.172515 0.828267 0.405273 O\n0.031657 0.525543 0.654978 O\n0.833266 0.173157 0.905550 O\n","nsites":28,"nelements":5,"elements":["Li","V","Cr","W","O"],"chemical_system":"Cr-Li-O-V-W","density":5.592100788481177,"density_atomic":0.09819760025453837,"volume":285.1393509354719,"volume_molar":6.1326760983873205,"formula_full":"Li4 V3 Cr3 W2 O16","formula_reduced":"Li4V3Cr3(WO8)2","formula_anonymous":"A2B3C3D4E16","energy_above_hull":3.7948693142857137,"spacegroup":8},{"id":"jvasp-111725","created_at":"2022-09-04T14:38:41.646876Z","updated_at":"2022-09-04T14:38:41.646901Z","structure_string":"V2 Fe2 Pb1 O8 F2\n1.0\n5.061869 0.031769 1.841515\n1.559366 4.815798 1.841515\n-0.153261 -0.112206 7.778642\nV Fe Pb O F\n2 2 1 8 2\ndirect\n0.559879 0.559878 0.250672 V\n0.440123 0.440122 0.749328 V\n0.500000 -0.000000 0.500000 Fe\n0.000001 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Pb\n0.670409 0.670408 0.405128 O\n0.329592 0.329592 0.594872 O\n0.302058 0.302057 0.965881 O\n0.697943 0.697943 0.034119 O\n0.682979 0.198124 0.281007 O\n0.317023 0.801876 0.718993 O\n0.801877 0.317021 0.718993 O\n0.198124 0.682978 0.281007 O\n0.832311 0.832311 0.591619 F\n0.167690 0.167689 0.408381 F\n","nsites":15,"nelements":5,"elements":["V","Fe","Pb","O","F"],"chemical_system":"F-Fe-O-Pb-V","density":5.093074695992752,"density_atomic":0.07840757133568696,"volume":191.3080553889417,"volume_molar":7.680560253827223,"formula_full":"V2 Fe2 Pb1 O8 F2","formula_reduced":"V2Fe2Pb(O4F)2","formula_anonymous":"AB2C2D2E8","energy_above_hull":2.749464585666667,"spacegroup":12},{"id":"jvasp-119549","created_at":"2022-09-04T14:38:35.386989Z","updated_at":"2022-09-04T14:38:35.387016Z","structure_string":"Li1 V1 Cr1 P4 O14\n1.0\n4.576259 -0.005905 -1.461799\n-0.104196 7.938473 -0.034037\n-0.052974 -0.009015 6.939679\nLi V Cr P O\n1 1 1 4 14\ndirect\n0.838735 0.369713 0.321587 Li\n0.221380 0.507757 0.730432 V\n0.785987 0.999245 0.272798 Cr\n0.402046 0.176759 0.515347 P\n0.204836 0.780934 0.090522 P\n0.779552 0.277403 0.908480 P\n0.606330 0.686465 0.482326 P\n0.837647 0.547972 0.515207 O\n0.730977 0.862422 0.488354 O\n0.616495 0.188586 0.391983 O\n0.394424 0.936506 0.093845 O\n0.390582 0.645365 0.257974 O\n0.588490 0.141698 0.749262 O\n0.258567 0.350387 0.514494 O\n0.424527 0.670969 0.628423 O\n0.880139 0.190796 0.112420 O\n0.181070 0.034508 0.458399 O\n0.130164 0.676789 0.894026 O\n0.037085 0.330703 0.835669 O\n0.590575 0.430396 0.921187 O\n0.924373 0.816601 0.140096 O\n","nsites":21,"nelements":5,"elements":["Li","V","Cr","P","O"],"chemical_system":"Cr-Li-O-P-V","density":3.0225773278166055,"density_atomic":0.0835035229192669,"volume":251.48639561355125,"volume_molar":7.211840350523106,"formula_full":"Li1 V1 Cr1 P4 O14","formula_reduced":"LiVCr(P2O7)2","formula_anonymous":"ABCD4E14","energy_above_hull":3.2397215523809524,"spacegroup":1},{"id":"jvasp-29168","created_at":"2022-09-04T14:38:35.847628Z","updated_at":"2022-09-04T14:38:35.847649Z","structure_string":"Te4 Mo3 W1 Se2 S2\n1.0\n3.408001 0.000000 -0.000000\n-1.704000 2.950978 0.000028\n-0.000000 -0.000308 45.423889\nTe Mo W Se S\n4 3 1 2 2\ndirect\n0.333383 0.666768 0.703811 Te\n0.666787 0.333573 0.423358 Te\n0.666541 0.333083 0.505974 Te\n0.333529 0.667058 0.621395 Te\n0.333207 0.666414 0.093954 Mo\n0.333377 0.666753 0.464800 Mo\n0.666754 0.333507 0.662632 Mo\n0.666660 0.333320 0.281622 W\n0.666572 0.333145 0.057748 Se\n0.666404 0.332809 0.130032 Se\n0.333305 0.666609 0.314933 S\n0.333479 0.666960 0.248490 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":4.376886264273489,"density_atomic":0.02626825640488761,"volume":456.8251434368981,"volume_molar":22.925544304034922,"formula_full":"Te4 Mo3 W1 Se2 S2","formula_reduced":"Te4Mo3W(SeS)2","formula_anonymous":"AB2C2D3E4","energy_above_hull":3.6392537916666665,"spacegroup":156},{"id":"jvasp-112698","created_at":"2022-09-04T14:38:41.774240Z","updated_at":"2022-09-04T14:38:41.774269Z","structure_string":"Ca3 Mg2 Fe1 C6 O18\n1.0\n4.845328 -0.003600 -0.007498\n-2.420066 5.386620 -1.022657\n0.015407 0.058882 12.384681\nCa Mg Fe C O\n3 2 1 6 18\ndirect\n0.661167 0.831896 0.831559 Ca\n0.338830 0.168103 0.168437 Ca\n-0.000002 0.500000 0.499998 Ca\n0.666590 0.834122 0.333586 Mg\n0.333407 0.165878 0.666410 Mg\n-0.000002 0.500000 -0.000002 Fe\n0.009560 0.518664 0.248927 C\n0.340610 0.184707 0.913633 C\n0.676980 0.851474 0.580794 C\n0.323018 0.148526 0.419202 C\n0.659387 0.815292 0.086363 C\n0.990437 0.481336 0.751069 C\n0.209181 0.601512 0.332091 O\n0.749290 0.530041 0.259742 O\n0.066753 0.415011 0.155947 O\n0.408806 0.094179 0.820151 O\n0.735080 0.754966 0.486556 O\n0.532885 0.264911 0.999113 O\n0.876336 0.930859 0.663853 O\n0.924961 0.812140 0.077236 O\n0.467113 0.735087 0.000883 O\n0.585006 0.140336 0.406846 O\n0.933244 0.584989 0.844050 O\n0.264917 0.245034 0.513440 O\n0.591192 0.905821 0.179846 O\n0.414992 0.859665 0.593150 O\n0.790816 0.398489 0.667906 O\n0.123661 0.069141 0.336144 O\n0.250708 0.469959 0.740254 O\n0.075036 0.187860 0.922760 O\n","nsites":30,"nelements":5,"elements":["Ca","Mg","Fe","C","O"],"chemical_system":"C-Ca-Fe-Mg-O","density":3.00220277309259,"density_atomic":0.09275719203468334,"volume":323.4250556957625,"volume_molar":6.492370702369072,"formula_full":"Ca3 Mg2 Fe1 C6 O18","formula_reduced":"Ca3Mg2Fe(CO3)6","formula_anonymous":"AB2C3D6E18","energy_above_hull":3.3590972620000006,"spacegroup":2},{"id":"jvasp-113077","created_at":"2022-09-04T14:38:42.151358Z","updated_at":"2022-09-04T14:38:42.151375Z","structure_string":"Na4 Al3 Si3 Cl1 O12\n1.0\n6.300551 -0.019019 4.411558\n0.002271 6.300580 4.411558\n-0.013340 -0.013295 8.834682\nNa Al Si Cl O\n4 3 3 1 12\ndirect\n0.644945 -0.001002 0.347825 Na\n0.348140 -0.003875 0.003985 Na\n0.003875 0.651860 -0.003984 Na\n0.001002 0.355055 0.652175 Na\n0.748674 0.251326 0.500000 Al\n0.249000 0.252149 0.258594 Al\n0.747851 0.751000 0.741406 Al\n0.491086 0.488272 0.758695 Si\n0.253626 0.746374 0.500000 Si\n0.511728 0.508914 0.241305 Si\n0.999646 0.000353 0.000000 Cl\n0.997689 0.290755 0.435137 O\n0.710271 0.448358 0.280211 O\n0.289403 0.423055 0.997061 O\n0.012004 0.698174 0.698380 O\n0.551642 0.289729 0.719789 O\n0.709245 0.002311 0.564863 O\n0.301826 0.987996 0.301621 O\n0.414976 0.696342 0.588044 O\n0.436058 0.303296 0.284260 O\n0.696704 0.563942 0.715740 O\n0.576945 0.710597 0.002939 O\n0.303658 0.585024 0.411957 O\n","nsites":23,"nelements":5,"elements":["Na","Al","Si","Cl","O"],"chemical_system":"Al-Cl-Na-O-Si","density":2.289656876110772,"density_atomic":0.06544257246998021,"volume":351.4531769140119,"volume_molar":9.202176095327662,"formula_full":"Na4 Al3 Si3 Cl1 O12","formula_reduced":"Na4Al3Si3ClO12","formula_anonymous":"AB3C3D4E12","energy_above_hull":2.126910707282609,"spacegroup":5}]}