{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=59","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=57","results":[{"id":"jvasp-119335","created_at":"2022-09-04T14:38:30.653283Z","updated_at":"2022-09-04T14:38:30.653310Z","structure_string":"Li6 Mn4 Si4 O16\n1.0\n7.252536 -0.012218 -0.524852\n3.483960 6.283891 3.504176\n-0.020361 -0.030693 7.259904\nLi Mn Si O\n6 4 4 16\ndirect\n0.783432 0.253823 0.451001 Li\n0.283443 0.253819 0.951009 Li\n0.534188 0.751528 0.205658 Li\n0.034191 0.751532 0.705655 Li\n0.961478 0.749425 0.289132 Li\n0.461473 0.749440 0.789128 Li\n0.582623 0.009429 0.389082 Mn\n0.907669 0.489499 0.099100 Mn\n0.082620 0.009430 0.889080 Mn\n0.407687 0.489501 0.599123 Mn\n0.825366 0.506033 0.666975 Si\n0.325356 0.506032 0.166976 Si\n0.675029 0.994426 0.836850 Si\n0.175026 0.994429 0.336848 Si\n0.118939 0.518048 0.250258 O\n0.246672 0.723387 0.928455 O\n0.746672 0.723383 0.428450 O\n-0.002579 0.501349 0.833768 O\n0.497402 0.501349 0.333779 O\n0.618960 0.518050 0.750283 O\n0.436801 0.292242 0.149014 O\n0.859436 0.978994 0.998981 O\n0.451082 0.204883 0.767493 O\n0.951072 0.204881 0.267488 O\n0.758989 0.000222 0.628128 O\n0.258987 0.000226 0.128124 O\n0.359429 0.979001 0.498979 O\n0.653560 0.776773 0.967569 O\n0.936792 0.292240 0.649017 O\n0.153567 0.776768 0.467572 O\n","nsites":30,"nelements":4,"elements":["Li","Mn","Si","O"],"chemical_system":"Li-Mn-O-Si","density":3.1502178064016846,"density_atomic":0.09037700723394454,"volume":331.94283499943504,"volume_molar":6.663354922133507,"formula_full":"Li6 Mn4 Si4 O16","formula_reduced":"Li3Mn2(SiO4)2","formula_anonymous":"A2B2C3D8","energy_above_hull":2.833304645517241,"spacegroup":1},{"id":"jvasp-9482","created_at":"2022-09-04T14:38:30.958896Z","updated_at":"2022-09-04T14:38:30.958912Z","structure_string":"Mg2 Ti2 P2 O10\n1.0\n5.106329 -0.181184 0.048630\n-1.281940 5.326405 -0.011315\n-1.464244 -2.053285 6.478461\nMg Ti P O\n2 2 2 10\ndirect\n0.346711 0.226702 0.804002 Mg\n0.678073 0.852732 0.325331 Mg\n0.011469 0.503663 0.500140 Ti\n-0.011686 0.496082 0.008141 Ti\n0.692410 0.831929 0.744603 P\n0.311313 0.143980 0.253215 P\n0.671773 0.625189 0.863000 O\n0.972874 0.882648 0.676588 O\n0.299730 0.314213 0.103727 O\n0.051094 0.136221 0.340469 O\n0.582551 0.242218 0.433996 O\n0.312261 0.863874 0.135681 O\n0.451321 0.731979 0.540218 O\n0.675911 0.098167 0.876123 O\n0.874855 0.586741 0.256492 O\n0.097271 0.433666 0.754748 O\n","nsites":16,"nelements":4,"elements":["Mg","Ti","P","O"],"chemical_system":"Mg-O-P-Ti","density":3.4739301796025743,"density_atomic":0.09138443173291647,"volume":175.08452694395686,"volume_molar":6.589897913465755,"formula_full":"Mg2 Ti2 P2 O10","formula_reduced":"MgTiPO5","formula_anonymous":"ABCD5","energy_above_hull":2.278112547916667,"spacegroup":1},{"id":"jvasp-119353","created_at":"2022-09-04T14:38:31.221460Z","updated_at":"2022-09-04T14:38:31.221488Z","structure_string":"V6 O8 F4\n1.0\n5.206236 -0.059933 1.787260\n1.264297 5.052304 1.788610\n0.071805 0.042519 7.273765\nV O F\n6 8 4\ndirect\n0.678735 0.703503 0.835742 V\n0.334800 0.347126 0.669513 V\n0.640011 0.650797 0.315949 V\n0.303535 0.326147 0.175276 V\n-0.000748 -0.000274 0.499754 V\n0.031850 0.974302 0.004894 V\n0.953284 0.368459 0.333425 O\n0.633658 0.046207 0.668613 O\n0.318289 0.684394 0.998150 O\n0.425088 0.429750 0.364364 O\n0.230420 0.229498 0.964399 O\n0.363727 0.961338 0.332171 O\n0.035122 0.638434 0.669447 O\n0.771899 0.771002 0.035736 O\n0.105558 0.101158 0.699672 F\n0.573275 0.578549 0.631470 F\n0.895739 0.893019 0.304673 F\n0.705775 0.296592 0.996744 F\n","nsites":18,"nelements":3,"elements":["V","O","F"],"chemical_system":"F-O-V","density":4.432593926521599,"density_atomic":0.09428002988240218,"volume":190.92060134528856,"volume_molar":6.387504084917628,"formula_full":"V6 O8 F4","formula_reduced":"V3(O2F)2","formula_anonymous":"A2B3C4","energy_above_hull":2.650146351666667,"spacegroup":1},{"id":"jvasp-9481","created_at":"2022-09-04T14:38:31.431737Z","updated_at":"2022-09-04T14:38:31.431761Z","structure_string":"Mg2 Ti2 Si2 O10\n1.0\n5.426538 -0.149801 -0.021864\n-1.503961 4.905376 0.050567\n-1.810474 -2.078394 6.465508\nMg Ti Si O\n2 2 2 10\ndirect\n0.275543 0.153269 0.707732 Mg\n0.691585 0.852217 0.215920 Mg\n0.994697 0.512506 0.502148 Ti\n0.005262 0.492056 0.005718 Ti\n0.675684 0.807663 0.772867 Si\n0.332514 0.193540 0.255626 Si\n0.633659 0.519518 0.854211 O\n0.879224 0.807545 0.632694 O\n0.358619 0.474403 0.170012 O\n0.146819 0.204149 0.410829 O\n0.630385 0.191550 0.387168 O\n0.217985 0.898981 0.059278 O\n0.382374 0.810735 0.635713 O\n0.791786 0.079961 0.988106 O\n0.928338 0.614188 0.264874 O\n0.054194 0.389717 0.759070 O\n","nsites":16,"nelements":4,"elements":["Mg","Ti","Si","O"],"chemical_system":"Mg-O-Si-Ti","density":3.501396426283535,"density_atomic":0.09358280494712641,"volume":170.97157975805365,"volume_molar":6.4350932453910366,"formula_full":"Mg2 Ti2 Si2 O10","formula_reduced":"MgTiSiO5","formula_anonymous":"ABCD5","energy_above_hull":2.262227935416666,"spacegroup":1},{"id":"jvasp-116442","created_at":"2022-09-04T14:38:31.431004Z","updated_at":"2022-09-04T14:38:31.431029Z","structure_string":"As2 N1\n1.0\n4.510816 -0.453274 -0.062856\n-0.419188 -4.536010 -0.771788\n-0.973815 0.123950 -2.749299\nAs N\n2 1\ndirect\n0.563627 0.598199 0.834918 As\n0.106393 0.005772 0.514151 As\n0.861264 0.894250 0.915678 N\n","nsites":3,"nelements":2,"elements":["As","N"],"chemical_system":"As-N","density":4.760969398171676,"density_atomic":0.05249541418044897,"volume":57.14784894710478,"volume_molar":11.471746349689425,"formula_full":"As2 N1","formula_reduced":"As2N","formula_anonymous":"AB2","energy_above_hull":3.023432249999999,"spacegroup":1},{"id":"jvasp-53461","created_at":"2022-09-04T14:38:31.539863Z","updated_at":"2022-09-04T14:38:31.539893Z","structure_string":"Ba3 Bi2 F12\n1.0\n4.375017 0.012334 0.009298\n-2.141071 3.817518 -0.014179\n-1.515366 -1.392749 17.654517\nBa Bi F\n3 2 12\ndirect\n0.090153 0.988717 0.005298 Ba\n0.863644 0.397903 0.211762 Ba\n0.638482 0.811180 0.417668 Ba\n0.453251 0.296922 0.620813 Bi\n0.400823 0.713079 0.821156 Bi\n0.409004 0.130129 0.746141 F\n0.680285 0.746789 0.707359 F\n0.969078 0.863481 0.852075 F\n0.676674 0.802026 0.564634 F\n0.332898 0.163706 0.478140 F\n0.039482 0.483794 0.626953 F\n0.665777 0.207918 0.888902 F\n0.556823 0.752733 0.265497 F\n0.171995 0.043904 0.161088 F\n0.783906 0.342746 0.061857 F\n0.947198 0.456253 0.368248 F\n0.390526 0.618716 0.952410 F\n","nsites":17,"nelements":3,"elements":["Ba","Bi","F"],"chemical_system":"Ba-Bi-F","density":5.948493275676092,"density_atomic":0.057564254982204924,"volume":295.32215791301877,"volume_molar":10.461597673524393,"formula_full":"Ba3 Bi2 F12","formula_reduced":"Ba3Bi2F12","formula_anonymous":"A2B3C12","energy_above_hull":0.0,"spacegroup":1},{"id":"jvasp-54749","created_at":"2022-09-04T14:38:31.694455Z","updated_at":"2022-09-04T14:38:31.694482Z","structure_string":"Ba2 H8 O12\n1.0\n6.029566 -0.278567 0.124553\n-0.722046 5.989117 -0.026641\n-0.195366 -0.619690 6.553959\nBa H O\n2 8 12\ndirect\n0.145465 0.809812 0.259600 Ba\n0.876915 0.206802 0.816626 Ba\n0.905733 0.660367 0.709077 H\n0.638567 0.056873 0.227247 H\n0.637712 0.728185 0.991160 H\n0.540666 0.126272 0.519181 H\n0.374660 0.304991 0.089816 H\n0.669474 0.657596 0.434910 H\n0.074648 0.356381 0.387695 H\n0.345271 0.964552 0.786505 H\n0.545783 0.109079 0.105893 O\n0.871367 0.541731 0.545586 O\n0.568135 0.770055 0.418484 O\n0.243972 0.387879 0.084215 O\n0.440454 0.210169 0.611215 O\n0.939162 0.759982 0.875939 O\n0.731535 0.983323 0.407786 O\n0.068822 0.236199 0.188972 O\n0.264373 0.026287 0.667795 O\n0.094516 0.465928 0.526853 O\n0.764248 0.631453 -0.002053 O\n0.478718 0.900499 0.962709 O\n","nsites":22,"nelements":3,"elements":["Ba","H","O"],"chemical_system":"Ba-H-O","density":3.3478467455313967,"density_atomic":0.09343519132515081,"volume":235.4573227494217,"volume_molar":6.445259729862581,"formula_full":"Ba2 H8 O12","formula_reduced":"Ba(H2O3)2","formula_anonymous":"AB4C6","energy_above_hull":2.6071215427272723,"spacegroup":1},{"id":"jvasp-116505","created_at":"2022-09-04T14:38:31.868281Z","updated_at":"2022-09-04T14:38:31.868318Z","structure_string":"Li8 Mn2 Co4 O14\n1.0\n5.324244 -0.062264 -2.155412\n0.575558 5.729890 -2.740785\n-0.107856 0.005320 7.521670\nLi Mn Co O\n8 2 4 14\ndirect\n0.216982 0.437792 0.145327 Li\n0.931881 0.864617 0.296431 Li\n0.634559 0.273845 0.426021 Li\n0.360080 0.720982 0.563178 Li\n0.067683 0.143753 0.706676 Li\n0.786925 0.568211 0.854940 Li\n0.500375 0.990833 0.006185 Li\n0.430086 0.861663 0.292080 Li\n0.008567 0.995012 0.003276 Mn\n0.708494 0.437454 0.144998 Mn\n0.570251 0.141597 0.712295 Co\n0.286431 0.572498 0.858626 Co\n0.143184 0.282555 0.427099 Co\n0.855615 0.715674 0.569375 Co\n0.105745 0.721587 0.057040 O\n0.880427 0.273970 0.933183 O\n0.603396 0.692015 0.065118 O\n0.295896 0.143044 0.207878 O\n0.018686 0.563087 0.358304 O\n0.746080 0.996094 0.515812 O\n0.443657 0.414002 0.644719 O\n0.165158 0.846101 0.789547 O\n0.560454 0.563934 0.355701 O\n0.259319 0.022396 0.508938 O\n0.984092 0.442675 0.639064 O\n0.693320 0.867823 0.781525 O\n0.408608 0.298884 0.929438 O\n0.834035 0.147911 0.207219 O\n","nsites":28,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.543760174709957,"density_atomic":0.12256177903955758,"volume":228.45621383288525,"volume_molar":4.913555275708193,"formula_full":"Li8 Mn2 Co4 O14","formula_reduced":"Li4MnCo2O7","formula_anonymous":"AB2C4D7","energy_above_hull":2.5535159672413794,"spacegroup":1},{"id":"jvasp-118993","created_at":"2022-09-04T14:38:31.941332Z","updated_at":"2022-09-04T14:38:31.941369Z","structure_string":"Li7 Mn2 Co3 O12\n1.0\n4.860033 0.030478 1.055799\n1.413371 5.395543 1.046187\n-0.005324 0.037754 7.485069\nLi Mn Co O\n7 2 3 12\ndirect\n0.502042 0.825088 0.163937 Li\n0.492331 0.347574 0.159056 Li\n0.504427 0.498393 0.496279 Li\n0.497825 0.005142 0.494559 Li\n0.495905 0.175836 0.839170 Li\n0.507320 0.649832 0.846566 Li\n0.997449 0.498490 0.004448 Li\n0.002369 0.002630 0.003406 Mn\n0.001771 0.825686 0.669162 Mn\n-0.001989 0.170607 0.330348 Co\n0.000047 0.332442 0.668602 Co\n0.998533 0.666020 0.331374 Co\n0.773819 0.843104 0.904623 O\n0.230465 0.157335 0.089457 O\n0.228159 0.682877 0.089506 O\n0.221182 0.842762 0.421518 O\n0.211446 0.340748 0.420203 O\n0.231672 0.509740 0.737189 O\n0.223820 0.003367 0.753854 O\n0.770247 0.494042 0.260073 O\n0.778628 -0.005421 0.245470 O\n0.780872 0.157124 0.578188 O\n0.780095 0.660035 0.581401 O\n0.771566 0.316541 0.911620 O\n","nsites":24,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.470414893187163,"density_atomic":0.12254310418308065,"volume":195.84945362689487,"volume_molar":4.914304072959389,"formula_full":"Li7 Mn2 Co3 O12","formula_reduced":"Li7Mn2(CoO4)3","formula_anonymous":"A2B3C7D12","energy_above_hull":2.6895070492816093,"spacegroup":1},{"id":"jvasp-119382","created_at":"2022-09-04T14:38:32.036051Z","updated_at":"2022-09-04T14:38:32.036079Z","structure_string":"Li2 Mn4 P4 O20\n1.0\n6.619758 0.035026 -0.123431\n-3.064869 6.076835 -0.012119\n-0.006665 -0.041805 7.823862\nLi Mn P O\n2 4 4 20\ndirect\n0.204350 0.215398 0.064242 Li\n0.704319 0.215302 0.564241 Li\n0.248434 0.997176 0.749523 Mn\n0.253841 0.503812 0.748001 Mn\n0.753851 0.503813 0.248009 Mn\n0.748444 -0.002823 0.249516 Mn\n0.735996 0.760308 0.589155 P\n0.766054 0.241699 0.914212 P\n0.235996 0.760312 0.089156 P\n0.266056 0.241698 0.414213 P\n0.571108 0.653575 0.735332 O\n0.777365 0.262478 0.323913 O\n0.715905 0.408710 0.016574 O\n0.768726 0.581768 0.486669 O\n0.956535 0.933190 0.674057 O\n0.552928 0.071342 0.818011 O\n0.722125 0.739994 0.176831 O\n0.371725 0.127791 0.531770 O\n0.425693 0.351581 0.263849 O\n0.215898 0.408706 0.516572 O\n0.277364 0.262479 0.823910 O\n0.456543 0.933188 0.174051 O\n0.052933 0.071345 0.318005 O\n0.925683 0.351571 0.763841 O\n0.268715 0.581762 0.986667 O\n0.222116 0.739992 0.676832 O\n0.071116 0.653577 0.235338 O\n0.146182 0.891538 0.973322 O\n0.646183 0.891533 0.473317 O\n0.871732 0.127798 0.031768 O\n","nsites":30,"nelements":4,"elements":["Li","Mn","P","O"],"chemical_system":"Li-Mn-O-P","density":3.565369506277157,"density_atomic":0.09507281652016995,"volume":315.5476096959368,"volume_molar":6.334240406901573,"formula_full":"Li2 Mn4 P4 O20","formula_reduced":"LiMn2(PO5)2","formula_anonymous":"AB2C2D10","energy_above_hull":3.1135826988505757,"spacegroup":1},{"id":"jvasp-45134","created_at":"2022-09-04T14:38:32.252513Z","updated_at":"2022-09-04T14:38:32.252538Z","structure_string":"Ni1 Te4 O12\n1.0\n5.073152 0.005250 -0.006708\n0.058704 5.593712 0.067287\n0.025822 0.774777 7.552419\nNi Te O\n1 4 12\ndirect\n0.992794 0.599741 0.291462 Ni\n0.003028 0.989330 0.982262 Te\n0.504004 0.465144 0.502363 Te\n0.016938 -0.003352 0.510972 Te\n0.492172 0.475204 0.985696 Te\n0.299714 0.780366 0.903746 O\n0.169553 0.611669 0.532563 O\n0.809628 0.660691 0.055926 O\n0.341142 0.450800 0.234591 O\n0.638442 0.492381 0.740976 O\n0.822533 0.306801 0.410208 O\n0.126855 0.930503 0.221423 O\n0.692658 0.172506 0.059848 O\n0.854573 0.003027 0.749000 O\n0.682193 0.750644 0.405542 O\n0.190718 0.289180 0.912260 O\n0.363041 0.143969 0.560465 O\n","nsites":17,"nelements":3,"elements":["Ni","Te","O"],"chemical_system":"Ni-O-Te","density":5.904165289870709,"density_atomic":0.07941901269387272,"volume":214.05453711100557,"volume_molar":7.582744428230113,"formula_full":"Ni1 Te4 O12","formula_reduced":"Ni(TeO3)4","formula_anonymous":"AB4C12","energy_above_hull":2.424526792156862,"spacegroup":1},{"id":"jvasp-33226","created_at":"2022-09-04T14:38:32.421025Z","updated_at":"2022-09-04T14:38:32.421035Z","structure_string":"Sn7 S2 Br10\n1.0\n12.330613 0.031336 -0.105244\n-6.109579 10.707481 0.054806\n0.037629 -0.000960 4.264932\nSn S Br\n7 2 10\ndirect\n0.175966 0.791624 0.268096 Sn\n0.214276 0.429123 0.269301 Sn\n0.047537 0.048796 0.272235 Sn\n0.593974 0.829718 0.278977 Sn\n0.433295 0.126096 0.752578 Sn\n0.695918 0.532693 0.680895 Sn\n0.852414 0.262539 0.745846 Sn\n0.269669 0.031862 0.262513 S\n-0.012342 0.244914 0.261088 S\n0.764442 0.738894 0.255576 Br\n0.503566 0.375131 0.266812 Br\n0.789339 -0.011478 0.766519 Br\n0.482474 0.631189 0.763503 Br\n0.022024 0.810936 0.766113 Br\n0.387188 0.867744 0.765593 Br\n0.129914 0.529863 0.769250 Br\n0.630104 0.125187 0.269879 Br\n0.208626 0.224858 0.768904 Br\n0.855117 0.486410 0.278230 Br\n","nsites":19,"nelements":3,"elements":["Sn","S","Br"],"chemical_system":"Br-S-Sn","density":4.9882967409241905,"density_atomic":0.033690502414242256,"volume":563.9571582039684,"volume_molar":17.874891522704665,"formula_full":"Sn7 S2 Br10","formula_reduced":"Sn7(SBr5)2","formula_anonymous":"A2B7C10","energy_above_hull":0.3492522605263161,"spacegroup":1}]}