{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-spacegroup&page=10258","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-spacegroup&page=10256","results":[{"id":"mp-977011","created_at":"2022-09-04T14:39:35.177351Z","structure_string":"H3 Pb1 C1 I3 N1 F3\n1.0\n6.476631 0.000000 0.000000\n0.000000 6.467177 0.000000\n0.000000 0.132190 6.557812\nH Pb C I N F\n3 1 1 3 1 3\ndirect\n0.000000 0.178972 0.185795 H\n0.866103 0.217842 0.966551 H\n0.133897 0.217842 0.966551 H\n0.500000 0.474561 0.475304 Pb\n0.000000 0.922172 0.987661 C\n0.500000 0.950676 0.503971 I\n0.500000 0.391776 0.970906 I\n0.000000 0.407726 0.491930 I\n0.000000 0.147397 0.027851 N\n0.829724 0.836886 0.068455 F\n0.000000 0.894169 0.786174 F\n0.170276 0.836886 0.068455 F\n","nsites":12,"nelements":6,"elements":["H","Pb","C","I","N","F"],"chemical_system":"C-F-H-I-N-Pb","density":4.0743075441851335,"density_atomic":0.043687619637071747,"volume":274.6773593912457,"volume_molar":13.784547681993246,"formula_full":"H3 Pb1 C1 I3 N1 F3","formula_reduced":"H3PbCI3NF3","formula_anonymous":"ABCD3E3F3","energy":-54.53962754999999,"energy_per_atom":-4.5449689625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.65562755,"band_gap":1.8543,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0018418,"is_theoretical":true,"updated_at":"2021-11-28T01:34:27.321000Z","spacegroup":6},{"id":"mp-1175307","created_at":"2022-09-04T14:39:35.574832Z","structure_string":"Li7 Mn4 Co1 O12\n1.0\n2.877399 0.000000 0.000000\n0.000000 5.883453 0.000000\n0.000000 2.883581 12.993640\nLi Mn Co O\n7 4 1 12\ndirect\n0.500000 0.829048 0.821189 Li\n0.500000 0.495706 0.520058 Li\n0.500000 0.171467 0.160188 Li\n0.000000 0.159682 0.663715 Li\n0.000000 0.826049 0.344792 Li\n0.000000 0.503180 0.984406 Li\n0.000000 0.673407 0.667076 Li\n0.000000 0.009544 0.991574 Mn\n0.500000 0.987809 0.514347 Mn\n0.000000 0.329186 0.341619 Mn\n0.500000 0.665666 0.165442 Mn\n0.500000 0.361959 0.805819 Co\n0.500000 0.785279 0.995035 O\n0.500000 0.409338 0.669990 O\n0.500000 0.096638 0.347204 O\n0.000000 0.096451 0.847121 O\n0.000000 0.776142 0.501314 O\n0.000000 0.438756 0.165783 O\n0.500000 0.920902 0.653133 O\n0.500000 0.558701 0.337416 O\n0.500000 0.219511 0.005819 O\n0.000000 0.217155 0.506682 O\n0.000000 0.898544 0.158490 O\n0.000000 0.569880 0.831788 O\n","nsites":24,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":3.919900901401953,"density_atomic":0.1091058494418829,"volume":219.9698744179982,"volume_molar":5.519539777936284,"formula_full":"Li7 Mn4 Co1 O12","formula_reduced":"Li7Mn4CoO12","formula_anonymous":"AB4C7D12","energy":-165.15410905,"energy_per_atom":-6.881421210416666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-148.60010905,"band_gap":0.4323000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":17.9994552,"is_theoretical":true,"updated_at":"2021-11-28T01:34:26.761000Z","spacegroup":6},{"id":"mp-1235119","created_at":"2022-09-04T14:39:35.779070Z","structure_string":"Li1 Co1 Pt3 O6\n1.0\n3.171492 0.000000 0.000000\n0.000000 5.937657 -1.924263\n0.000000 0.217094 6.559765\nLi Co Pt O\n1 1 3 6\ndirect\n0.500000 0.698059 0.712041 Li\n0.000000 0.443198 0.441588 Co\n0.000000 0.012286 0.011347 Pt\n0.500001 0.510994 0.016665 Pt\n0.500001 0.008064 0.505688 Pt\n0.000000 0.953899 0.688648 O\n0.000000 0.065794 0.329503 O\n0.000000 0.674132 0.922499 O\n0.000000 0.348535 0.104144 O\n0.500001 0.351452 0.603725 O\n0.500001 0.662752 0.393318 O\n","nsites":11,"nelements":4,"elements":["Li","Co","Pt","O"],"chemical_system":"Co-Li-O-Pt","density":9.936669152621832,"density_atomic":0.08810337529364888,"volume":124.8533323875159,"volume_molar":6.835312199933524,"formula_full":"Li1 Co1 Pt3 O6","formula_reduced":"LiCo(PtO2)3","formula_anonymous":"ABC3D6","energy":-67.87343305,"energy_per_atom":-6.170312095454546,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-62.11343305,"band_gap":0.1200999999999998,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9891361,"is_theoretical":true,"updated_at":"2021-11-28T01:34:36.334000Z","spacegroup":6},{"id":"mp-1226188","created_at":"2022-09-04T14:39:35.629498Z","structure_string":"Dy6 Ga15 Ni15\n1.0\n4.065937 0.000000 0.000000\n0.000000 8.857407 0.000000\n0.000000 0.053886 15.429014\nDy Ga Ni\n6 15 15\ndirect\n0.000000 0.999304 0.336836 Dy\n0.000000 0.504293 0.835639 Dy\n0.000000 0.505680 0.168484 Dy\n0.000000 0.003195 0.663855 Dy\n0.500000 0.992198 0.000563 Dy\n0.500000 0.497480 0.496388 Dy\n0.500000 0.009833 0.501264 Ga\n0.500000 0.508097 0.000661 Ga\n0.500000 0.746851 0.255855 Ga\n0.500000 0.252086 0.751764 Ga\n0.500000 0.248949 0.247987 Ga\n0.500000 0.751603 0.747885 Ga\n0.000000 0.145279 0.853853 Ga\n0.000000 0.145421 0.147090 Ga\n0.000000 0.647455 0.646807 Ga\n0.000000 0.781505 0.494277 Ga\n0.000000 0.295150 0.000623 Ga\n0.000000 0.849512 0.140166 Ga\n0.000000 0.351730 0.637801 Ga\n0.000000 0.362097 0.362271 Ga\n0.000000 0.851181 0.861799 Ga\n0.500000 0.995006 0.185055 Ni\n0.500000 0.498746 0.683583 Ni\n0.500000 0.224989 0.404705 Ni\n0.500000 0.725603 0.906438 Ni\n0.500000 0.779071 0.410303 Ni\n0.500000 0.277255 0.909592 Ni\n0.500000 0.495079 0.315537 Ni\n0.500000 0.998331 0.814923 Ni\n0.500000 0.725098 0.094494 Ni\n0.500000 0.227578 0.593538 Ni\n0.500000 0.277286 0.090984 Ni\n0.500000 0.778033 0.589627 Ni\n0.000000 0.199692 0.499316 Ni\n0.000000 0.700360 0.000378 Ni\n0.000000 0.649175 0.349657 Ni\n","nsites":36,"nelements":3,"elements":["Dy","Ga","Ni"],"chemical_system":"Dy-Ga-Ni","density":8.670182374811676,"density_atomic":0.06478837413253152,"volume":555.6552465162679,"volume_molar":9.295094745981848,"formula_full":"Dy6 Ga15 Ni15","formula_reduced":"Dy2(GaNi)5","formula_anonymous":"A2B5C5","energy":-180.15027236000003,"energy_per_atom":-5.004174232222223,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-180.15027236000003,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006687,"is_theoretical":true,"updated_at":"2021-11-28T01:34:33.263000Z","spacegroup":6},{"id":"mp-1215260","created_at":"2022-09-04T14:39:36.714734Z","structure_string":"Zr3 Nb3 Si6 Ru6\n1.0\n3.754574 0.000000 0.000000\n0.000000 6.613867 0.000000\n0.000000 0.075379 11.301080\nZr Nb Si Ru\n3 3 6 6\ndirect\n0.500000 0.289691 0.291268 Zr\n0.500000 0.290868 0.709167 Zr\n0.500000 0.789915 0.208600 Zr\n0.500000 0.420926 0.999466 Nb\n0.500000 0.917359 0.500928 Nb\n0.500000 0.790845 0.791586 Nb\n0.000000 0.992609 0.666474 Si\n0.000000 0.498417 0.162586 Si\n0.000000 0.503419 0.835669 Si\n0.000000 0.997565 0.337355 Si\n0.500000 0.004162 0.996742 Si\n0.500000 0.506542 0.500090 Si\n0.000000 0.754485 0.998187 Ru\n0.000000 0.254091 0.501308 Ru\n0.000000 0.623010 0.623055 Ru\n0.000000 0.122536 0.121784 Ru\n0.000000 0.121552 0.877231 Ru\n0.000000 0.622206 0.378505 Ru\n","nsites":18,"nelements":4,"elements":["Zr","Nb","Si","Ru"],"chemical_system":"Nb-Ru-Si-Zr","density":7.853984058446857,"density_atomic":0.06414110390367396,"volume":280.6312786108593,"volume_molar":9.388894785852067,"formula_full":"Zr3 Nb3 Si6 Ru6","formula_reduced":"ZrNb(SiRu)2","formula_anonymous":"ABC2D2","energy":-157.98185152999997,"energy_per_atom":-8.776769529444444,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-158.40785153,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.2175159,"is_theoretical":true,"updated_at":"2021-11-28T01:34:40.661000Z","spacegroup":6},{"id":"mp-1216262","created_at":"2022-09-04T14:39:36.828194Z","structure_string":"Y16 Se16 F15\n1.0\n4.135858 0.000000 0.000000\n0.000000 10.022848 0.000000\n0.000000 3.419706 25.454161\nY Se F\n16 16 15\ndirect\n0.500000 0.400100 0.558900 Y\n0.000000 0.599768 0.441325 Y\n0.500000 0.316532 0.807612 Y\n0.000000 0.683957 0.192076 Y\n0.500000 0.062649 0.062169 Y\n0.000000 0.943058 0.939473 Y\n0.500000 0.984335 0.316273 Y\n0.000000 0.015208 0.684020 Y\n0.500000 0.898497 0.566022 Y\n0.000000 0.101425 0.434203 Y\n0.500000 0.819450 0.819243 Y\n0.000000 0.180852 0.181614 Y\n0.500000 0.567793 0.062485 Y\n0.000000 0.430851 0.937823 Y\n0.500000 0.482428 0.308930 Y\n0.000000 0.518192 0.691117 Y\n0.500000 0.540158 0.866585 Se\n0.000000 0.458804 0.133985 Se\n0.500000 0.626112 0.615808 Se\n0.000000 0.373867 0.384075 Se\n0.500000 0.332436 0.009832 Se\n0.000000 0.671109 0.990919 Se\n0.500000 0.796916 0.117577 Se\n0.000000 0.203506 0.881851 Se\n0.500000 0.161895 0.508708 Se\n0.000000 0.838072 0.491209 Se\n0.500000 0.709343 0.365620 Se\n0.000000 0.290721 0.634283 Se\n0.500000 0.246016 0.256517 Se\n0.000000 0.753872 0.743344 Se\n0.500000 0.078644 0.758234 Se\n0.000000 0.921752 0.241699 Se\n0.500000 0.150450 0.145462 F\n0.000000 0.849641 0.854076 F\n0.500000 0.981937 0.648014 F\n0.000000 0.018110 0.351892 F\n0.500000 0.458238 0.726651 F\n0.000000 0.541819 0.273290 F\n0.500000 0.900182 0.900257 F\n0.000000 0.097792 0.098669 F\n0.500000 0.623839 0.227423 F\n0.000000 0.376377 0.772481 F\n0.500000 0.551623 0.479685 F\n0.000000 0.448417 0.520204 F\n0.500000 0.069155 0.397804 F\n0.000000 0.930858 0.602085 F\n0.500000 0.989248 0.983473 F\n","nsites":47,"nelements":3,"elements":["Y","Se","F"],"chemical_system":"F-Se-Y","density":4.675319518907599,"density_atomic":0.04454329169185156,"volume":1055.1532725767963,"volume_molar":13.519747937940672,"formula_full":"Y16 Se16 F15","formula_reduced":"Y16Se16F15","formula_anonymous":"A15B16C16","energy":-326.12791259,"energy_per_atom":-6.9388917572340425,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-319.19791259,"band_gap":0.1477000000000004,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.0014208,"is_theoretical":true,"updated_at":"2021-11-28T01:34:28.781000Z","spacegroup":6},{"id":"mp-1235083","created_at":"2022-09-04T14:39:42.253475Z","structure_string":"Sr1 Li1 Nd1 Co1 O4\n1.0\n3.820889 0.003278 0.271379\n0.028820 4.126044 -0.582071\n2.321797 1.080464 7.258450\nSr Li Nd Co O\n1 1 1 1 4\ndirect\n0.362818 0.591372 0.227605 Sr\n0.594024 0.096517 0.501664 Li\n0.784664 0.592435 0.734242 Nd\n0.079592 0.092180 0.956036 Co\n0.061811 0.094861 0.651504 O\n0.709046 0.593934 0.443244 O\n0.519023 0.094183 0.040908 O\n0.139022 0.594518 0.935535 O\n","nsites":8,"nelements":5,"elements":["Sr","Li","Nd","Co","O"],"chemical_system":"Co-Li-Nd-O-Sr","density":5.258124045205645,"density_atomic":0.07002975908228161,"volume":114.23714867561353,"volume_molar":8.599402366819904,"formula_full":"Sr1 Li1 Nd1 Co1 O4","formula_reduced":"SrLiNdCoO4","formula_anonymous":"ABCDE4","energy":-55.492477740000005,"energy_per_atom":-6.936559717500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.10647774,"band_gap":1.6195999999999997,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.0001353,"is_theoretical":true,"updated_at":"2021-11-28T01:34:24.734000Z","spacegroup":6},{"id":"mp-753528","created_at":"2022-09-04T14:39:37.232254Z","structure_string":"Li6 Fe1 Ni1 P2 C2 O14\n1.0\n8.470854 0.079319 -0.000521\n0.438434 4.956966 0.000336\n-0.000504 0.001040 6.495489\nLi Fe Ni P C O\n6 1 1 2 2 14\ndirect\n0.104343 0.784091 0.249969 Li\n0.272578 0.261673 0.016743 Li\n0.272647 0.261613 0.483147 Li\n0.725711 0.739956 0.519288 Li\n0.725731 0.739541 0.980832 Li\n0.894603 0.212873 0.749991 Li\n0.663351 0.216107 0.249986 Fe\n0.332815 0.792685 0.750047 Ni\n0.410629 0.726783 0.250040 P\n0.585836 0.271180 0.750019 P\n0.042247 0.687860 0.749967 C\n0.963366 0.312825 0.249952 C\n0.072553 0.938133 0.749943 O\n0.107177 0.380818 0.249955 O\n0.163709 0.503961 0.750032 O\n0.308007 0.834253 0.062920 O\n0.308023 0.834247 0.437078 O\n0.420748 0.165037 0.749969 O\n0.428334 0.411118 0.250127 O\n0.562550 0.587294 0.750086 O\n0.578196 0.824307 0.250064 O\n0.691183 0.165976 0.934979 O\n0.691173 0.166257 0.565047 O\n0.843206 0.499397 0.249816 O\n0.898349 0.618733 0.749932 O\n0.932932 0.063284 0.250071 O\n","nsites":26,"nelements":6,"elements":["Li","Fe","Ni","P","C","O"],"chemical_system":"C-Fe-Li-Ni-O-P","density":2.8403699552867523,"density_atomic":0.09540655211879881,"volume":272.51797096309684,"volume_molar":6.312083002959085,"formula_full":"Li6 Fe1 Ni1 P2 C2 O14","formula_reduced":"Li6FeNiP2(CO7)2","formula_anonymous":"ABC2D2E6F14","energy":-184.46270048,"energy_per_atom":-7.094719249230769,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-170.04770048,"band_gap":2.6653999999999995,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.004251,"is_theoretical":true,"updated_at":"2021-11-28T01:34:28.246000Z","spacegroup":6},{"id":"mp-759833","created_at":"2022-09-04T14:39:37.806515Z","structure_string":"Li9 V6 O12 F6\n1.0\n8.952026 0.000000 0.000000\n0.000000 5.139980 0.000000\n0.000000 0.193969 7.372739\nLi V O F\n9 6 12 6\ndirect\n0.166175 0.682665 0.369170 Li\n0.166666 0.310986 0.624863 Li\n0.000000 0.137527 0.361368 Li\n0.833825 0.682665 0.369170 Li\n0.833334 0.310986 0.624863 Li\n0.677788 0.850992 0.645495 Li\n0.500000 0.711282 0.365128 Li\n0.500000 0.316946 0.599333 Li\n0.322212 0.850992 0.645495 Li\n0.166463 0.003778 0.001633 V\n0.000000 0.507929 0.990749 V\n0.833537 0.003778 0.001633 V\n0.667109 0.495028 0.003275 V\n0.500000 0.997696 0.009154 V\n0.332891 0.495028 0.003275 V\n0.171609 0.687641 0.861609 O\n0.160881 0.317826 0.136819 O\n0.000000 0.167095 0.854360 O\n0.000000 0.841211 0.149160 O\n0.828391 0.687641 0.861609 O\n0.839119 0.317826 0.136819 O\n0.667980 0.156148 0.854632 O\n0.667387 0.830388 0.148122 O\n0.500000 0.682189 0.865899 O\n0.500000 0.312112 0.136302 O\n0.332020 0.156148 0.854632 O\n0.332613 0.830388 0.148122 O\n0.166247 0.997440 0.498004 F\n0.000000 0.471849 0.482397 F\n0.833753 0.997440 0.498004 F\n0.668420 0.522237 0.512919 F\n0.500000 0.977240 0.532353 F\n0.331580 0.522237 0.512919 F\n","nsites":33,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":3.299609810751811,"density_atomic":0.0972752411288936,"volume":339.24356924773565,"volume_molar":6.190825836165671,"formula_full":"Li9 V6 O12 F6","formula_reduced":"Li3V2(O2F)2","formula_anonymous":"A2B2C3D4","energy":-231.17592885,"energy_per_atom":-7.005331177272727,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-209.95992885,"band_gap":0.6701000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.9999031,"is_theoretical":true,"updated_at":"2021-11-28T01:34:39.193000Z","spacegroup":6},{"id":"mp-1226435","created_at":"2022-09-04T14:39:37.913522Z","structure_string":"Co3 Re1 B4\n1.0\n3.031954 0.000000 0.000000\n0.000000 4.125951 0.000000\n0.000000 0.133366 5.413195\nCo Re B\n3 1 4\ndirect\n0.000000 0.869769 0.826538 Co\n0.500000 0.371564 0.679922 Co\n0.500000 0.127181 0.173737 Co\n0.000000 0.630626 0.320784 Re\n0.000000 0.128356 0.479608 B\n0.000000 0.366901 0.955294 B\n0.500000 0.900093 0.549691 B\n0.500000 0.605509 0.014426 B\n","nsites":8,"nelements":3,"elements":["Co","Re","B"],"chemical_system":"B-Co-Re","density":9.961913143465894,"density_atomic":0.11813800727859168,"volume":67.71741105412835,"volume_molar":5.097547265884261,"formula_full":"Co3 Re1 B4","formula_reduced":"Co3ReB4","formula_anonymous":"AB3C4","energy":-62.91206837,"energy_per_atom":-7.86400854625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-62.91206837,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.2e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:34:24.971000Z","spacegroup":6},{"id":"mp-1218799","created_at":"2022-09-04T14:39:38.419410Z","structure_string":"Sr3 Cu3 Pb3 Cl1 O8\n1.0\n3.870427 0.000000 0.000000\n0.000000 3.909287 0.000000\n0.000000 0.307140 19.932177\nSr Cu Pb Cl O\n3 3 3 1 8\ndirect\n0.000000 0.517451 0.718959 Sr\n0.000000 0.484243 0.273846 Sr\n0.000000 0.501854 0.097515 Sr\n0.500000 0.004589 0.812921 Cu\n0.500000 0.995121 0.185153 Cu\n0.000000 0.497776 0.500098 Cu\n0.500000 0.000909 0.586515 Pb\n0.500000 0.997807 0.409524 Pb\n0.000000 0.495730 0.896697 Pb\n0.500000 0.004375 0.017658 Cl\n0.000000 0.002751 0.826534 O\n0.500000 0.495691 0.176503 O\n0.000000 0.996595 0.175165 O\n0.500000 0.503827 0.824593 O\n0.500000 0.024562 0.696927 O\n0.500000 0.980461 0.300763 O\n0.000000 0.600704 0.591561 O\n0.000000 0.395554 0.409067 O\n","nsites":18,"nelements":5,"elements":["Sr","Cu","Pb","Cl","O"],"chemical_system":"Cl-Cu-O-Pb-Sr","density":6.819462375104591,"density_atomic":0.05968446895260962,"volume":301.5859957519648,"volume_molar":10.089962875906078,"formula_full":"Sr3 Cu3 Pb3 Cl1 O8","formula_reduced":"Sr3Cu3Pb3ClO8","formula_anonymous":"AB3C3D3E8","energy":-103.51075045,"energy_per_atom":-5.750597247222222,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-97.40075045,"band_gap":0.2583999999999999,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.003276,"is_theoretical":true,"updated_at":"2021-11-28T01:34:35.129000Z","spacegroup":6},{"id":"mp-756174","created_at":"2022-09-04T14:39:38.501211Z","structure_string":"Li2 V2 Si1 Ge1 O10\n1.0\n6.382862 0.000000 0.000000\n0.000000 4.653620 0.000000\n0.000000 0.275576 6.476360\nLi V Si Ge O\n2 2 1 1 10\ndirect\n0.257925 0.000302 0.508098 Li\n0.742075 0.000302 0.508098 Li\n0.000000 0.389319 0.755798 V\n0.500000 0.611192 0.236858 V\n0.500000 0.498480 0.740464 Si\n0.000000 0.500795 0.253750 Ge\n0.500000 0.668341 0.958718 O\n0.000000 0.739836 0.730587 O\n0.710498 0.294099 0.729861 O\n0.289502 0.294099 0.729861 O\n0.500000 0.736198 0.546569 O\n0.000000 0.248263 0.465084 O\n0.220820 0.730225 0.265500 O\n0.779180 0.730225 0.265500 O\n0.500000 0.261337 0.275116 O\n0.000000 0.296985 0.030135 O\n","nsites":16,"nelements":5,"elements":["Li","V","Si","Ge","O"],"chemical_system":"Ge-Li-O-Si-V","density":3.249816537328754,"density_atomic":0.08317305021049341,"volume":192.37000397974322,"volume_molar":7.2404952622985865,"formula_full":"Li2 V2 Si1 Ge1 O10","formula_reduced":"Li2V2SiGeO10","formula_anonymous":"ABC2D2E10","energy":-121.08246821,"energy_per_atom":-7.567654263125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-110.81246821,"band_gap":1.7448,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0017582,"is_theoretical":true,"updated_at":"2021-11-28T01:34:30.633000Z","spacegroup":6}]}