{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=29","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=27","results":[{"id":"mp-1078722","created_at":"2022-09-04T14:41:10.221013Z","structure_string":"Eu2 As4 Pt4\n1.0\n4.505071 0.000000 0.000000\n0.000000 4.505071 0.000000\n0.000000 0.000000 9.995558\nEu As Pt\n2 4 4\ndirect\n0.000000 0.500000 0.252275 Eu\n0.500000 0.000000 0.747725 Eu\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.500000 As\n0.000000 0.500000 0.868458 As\n0.500000 0.000000 0.131542 As\n0.500000 0.500000 0.000000 Pt\n0.000000 0.000000 0.000000 Pt\n0.000000 0.500000 0.619185 Pt\n0.500000 0.000000 0.380815 Pt\n","nsites":10,"nelements":3,"elements":["Eu","As","Pt"],"chemical_system":"As-Eu-Pt","density":11.328158052628357,"density_atomic":0.04929350240299851,"volume":202.8664938077458,"volume_molar":12.216905811979137,"formula_full":"Eu2 As4 Pt4","formula_reduced":"Eu(AsPt)2","formula_anonymous":"AB2C2","energy":-71.43907466,"energy_per_atom":-7.143907466,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-71.43907466,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":13.5923389,"is_theoretical":false,"updated_at":"2021-11-28T01:35:12.363000Z","spacegroup":129},{"id":"mp-24662","created_at":"2022-09-04T14:41:09.915451Z","structure_string":"Rb8 Mg6 H20\n1.0\n3.023253 -7.080168 0.000000\n3.023253 7.080168 0.000000\n0.000000 0.000000 13.568273\nRb Mg H\n8 6 20\ndirect\n0.040927 0.959073 0.639408 Rb\n0.959073 0.040927 0.360592 Rb\n0.459073 0.540927 0.139408 Rb\n0.540927 0.459073 0.860592 Rb\n0.242849 0.757151 0.894745 Rb\n0.757151 0.242849 0.105255 Rb\n0.257151 0.742849 0.394745 Rb\n0.742849 0.257151 0.605255 Rb\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.377732 0.622268 0.656637 Mg\n0.622268 0.377732 0.343363 Mg\n0.122268 0.877732 0.156637 Mg\n0.877732 0.122268 0.843363 Mg\n0.243897 0.756103 0.648084 H\n0.756103 0.243897 0.351916 H\n0.256103 0.743897 0.148084 H\n0.743897 0.256103 0.851916 H\n0.027371 0.972629 0.856256 H\n0.972629 0.027371 0.143744 H\n0.472629 0.527371 0.356256 H\n0.527371 0.472629 0.643744 H\n0.139213 0.360787 0.750000 H\n0.360787 0.139213 0.250000 H\n0.860787 0.639213 0.250000 H\n0.639213 0.860787 0.750000 H\n0.384791 0.187502 0.460452 H\n0.187502 0.384791 0.539548 H\n0.687502 0.884791 0.960452 H\n0.884791 0.687502 0.039548 H\n0.812498 0.615209 0.460452 H\n0.615209 0.812498 0.539548 H\n0.312498 0.115209 0.039548 H\n0.115209 0.312498 0.960452 H\n","nsites":34,"nelements":3,"elements":["Rb","Mg","H"],"chemical_system":"H-Mg-Rb","density":2.429170721500473,"density_atomic":0.058533742515288166,"volume":580.8615430855065,"volume_molar":10.288323454505072,"formula_full":"Rb8 Mg6 H20","formula_reduced":"Rb4Mg3H10","formula_anonymous":"A3B4C10","energy":-96.56117253,"energy_per_atom":-2.8400344861764704,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-92.98117253,"band_gap":3.4271,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002621,"is_theoretical":false,"updated_at":"2021-11-28T01:35:16.043000Z","spacegroup":64},{"id":"mp-1093879","created_at":"2022-09-04T14:41:09.943664Z","structure_string":"Sc1 Zn1 Au2\n1.0\n-5.291052 5.704741 8.063710\n5.291052 -5.704741 8.063710\n5.291052 5.704741 -8.063710\nSc Zn Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Zn\n0.000000 0.247763 0.247763 Au\n0.000000 0.752237 0.752237 Au\n","nsites":4,"nelements":3,"elements":["Sc","Zn","Au"],"chemical_system":"Au-Sc-Zn","density":0.8601288855906888,"density_atomic":0.004108536388398963,"volume":973.5827121537902,"volume_molar":146.57630335231718,"formula_full":"Sc1 Zn1 Au2","formula_reduced":"ScZnAu2","formula_anonymous":"ABC2","energy":-9.9052299,"energy_per_atom":-2.476307475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.9052299,"band_gap":0.2311,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.9997952,"is_theoretical":true,"updated_at":"2021-11-28T01:35:09.725000Z","spacegroup":71},{"id":"mp-1064529","created_at":"2022-09-04T14:41:09.949449Z","structure_string":"Rb2 N2\n1.0\n4.170418 0.000000 0.000000\n0.000000 4.638791 0.000000\n0.000000 0.000000 5.992934\nRb N\n2 2\ndirect\n0.500000 0.227593 0.500000 Rb\n0.000000 0.772407 0.000000 Rb\n0.500000 0.277668 0.000000 N\n0.000000 0.722332 0.500000 N\n","nsites":4,"nelements":2,"elements":["Rb","N"],"chemical_system":"N-Rb","density":2.8494889087498256,"density_atomic":0.034501351217609305,"volume":115.93748820940154,"volume_molar":17.45479683394641,"formula_full":"Rb2 N2","formula_reduced":"RbN","formula_anonymous":"AB","energy":-13.67551469,"energy_per_atom":-3.4188786725,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.95351469,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.9962392,"is_theoretical":true,"updated_at":"2021-11-28T01:35:15.138000Z","spacegroup":59},{"id":"mp-1203166","created_at":"2022-09-04T14:41:09.951150Z","structure_string":"Er4 Mo6 H4 Se4 O34\n1.0\n7.287137 0.000000 0.000000\n0.000000 6.830186 0.000000\n0.000000 2.387842 14.125521\nEr Mo H Se O\n4 6 4 4 34\ndirect\n0.250000 0.389946 0.541514 Er\n0.750000 0.610054 0.458486 Er\n0.250000 0.741543 0.122596 Er\n0.750000 0.258457 0.877404 Er\n0.004274 0.208232 0.137084 Mo\n0.504274 0.791768 0.862916 Mo\n0.995726 0.791768 0.862916 Mo\n0.495726 0.208232 0.137084 Mo\n0.750000 0.127612 0.332839 Mo\n0.250000 0.872388 0.667161 Mo\n0.356650 0.247571 0.362362 H\n0.856650 0.752429 0.637638 H\n0.643350 0.752429 0.637638 H\n0.143350 0.247571 0.362362 H\n0.250000 0.788548 0.382158 Se\n0.750000 0.211452 0.617842 Se\n0.750000 0.743553 0.189538 Se\n0.250000 0.256447 0.810462 Se\n0.072939 0.648163 0.444567 O\n0.572939 0.351837 0.555433 O\n0.927061 0.351837 0.555433 O\n0.427061 0.648163 0.444567 O\n0.250000 0.710543 0.274859 O\n0.750000 0.289457 0.725141 O\n0.750000 0.797958 0.302018 O\n0.250000 0.202042 0.697982 O\n0.940203 0.881846 0.142198 O\n0.440203 0.118154 0.857802 O\n0.059797 0.118154 0.857802 O\n0.559797 0.881846 0.142198 O\n0.250000 0.089585 0.127892 O\n0.750000 0.910415 0.872108 O\n0.932333 0.236498 0.017818 O\n0.432333 0.763502 0.982182 O\n0.067667 0.763502 0.982182 O\n0.567667 0.236498 0.017818 O\n0.074854 0.452423 0.144232 O\n0.574854 0.547577 0.855768 O\n0.925146 0.547577 0.855768 O\n0.425146 0.452423 0.144232 O\n0.997284 0.122141 0.286452 O\n0.497284 0.877859 0.713548 O\n0.002716 0.877859 0.713548 O\n0.502716 0.122141 0.286452 O\n0.750000 0.230150 0.177704 O\n0.250000 0.769850 0.822296 O\n0.750000 0.369046 0.364152 O\n0.250000 0.630954 0.635848 O\n0.750000 0.968958 0.443812 O\n0.250000 0.031042 0.556188 O\n0.250000 0.300110 0.392784 O\n0.750000 0.699890 0.607216 O\n","nsites":52,"nelements":5,"elements":["Er","Mo","H","Se","O"],"chemical_system":"Er-H-Mo-O-Se","density":4.9800579687893585,"density_atomic":0.07396212894061818,"volume":703.0625097575156,"volume_molar":8.142194993920448,"formula_full":"Er4 Mo6 H4 Se4 O34","formula_reduced":"Er2Mo3H2Se2O17","formula_anonymous":"A2B2C2D3E17","energy":-391.38158774,"energy_per_atom":-7.526568995,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-348.81158774,"band_gap":1.6125000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.009458,"is_theoretical":false,"updated_at":"2021-11-28T01:35:10.923000Z","spacegroup":11},{"id":"mp-982367","created_at":"2022-09-04T14:41:09.954641Z","structure_string":"Pm3 Zr1\n1.0\n-2.494787 2.494787 4.967826\n2.494787 -2.494787 4.967826\n2.494787 2.494787 -4.967826\nPm Zr\n3 1\ndirect\n0.750000 0.250000 0.500000 Pm\n0.250000 0.750000 0.500000 Pm\n0.500000 0.500000 0.000000 Pm\n0.000000 0.000000 0.000000 Zr\n","nsites":4,"nelements":2,"elements":["Pm","Zr"],"chemical_system":"Pm-Zr","density":7.065232155567847,"density_atomic":0.032341985586070876,"volume":123.67824447125872,"volume_molar":18.620194928890296,"formula_full":"Pm3 Zr1","formula_reduced":"Pm3Zr","formula_anonymous":"AB3","energy":-22.24767989,"energy_per_atom":-5.5619199725,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.24767989,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002685,"is_theoretical":true,"updated_at":"2021-11-28T01:35:15.473000Z","spacegroup":139},{"id":"mp-1033792","created_at":"2022-09-04T14:41:09.956328Z","structure_string":"Mg14 Cr1 C1 O16\n1.0\n8.454112 0.000000 0.000000\n0.000000 8.737375 0.000000\n0.000000 0.000000 4.208503\nMg Cr C O\n14 1 1 16\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.257247 0.500000 Mg\n0.000000 0.742753 0.500000 Mg\n0.500000 0.251567 0.500000 Mg\n0.500000 0.748433 0.500000 Mg\n0.250727 0.000000 0.500000 Mg\n0.245910 0.500000 0.500000 Mg\n0.749273 0.000000 0.500000 Mg\n0.754090 0.500000 0.500000 Mg\n0.245720 0.255478 0.000000 Mg\n0.245720 0.744522 0.000000 Mg\n0.754280 0.255478 0.000000 Mg\n0.754280 0.744522 0.000000 Mg\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 C\n0.246561 0.000000 0.000000 O\n0.255297 0.500000 0.000000 O\n0.753439 0.000000 0.000000 O\n0.744703 0.500000 0.000000 O\n0.248495 0.250467 0.500000 O\n0.248495 0.749533 0.500000 O\n0.751505 0.250467 0.500000 O\n0.751505 0.749533 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.225156 0.000000 O\n0.000000 0.774844 0.000000 O\n0.500000 0.247604 0.000000 O\n0.500000 0.752396 0.000000 O\n","nsites":32,"nelements":4,"elements":["Mg","Cr","C","O"],"chemical_system":"C-Cr-Mg-O","density":3.5268923747030456,"density_atomic":0.10293744027592369,"volume":310.8684256595466,"volume_molar":5.850291928629329,"formula_full":"Mg14 Cr1 C1 O16","formula_reduced":"Mg14CrCO16","formula_anonymous":"ABC14D16","energy":-205.53616568,"energy_per_atom":-6.4230051775,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-192.54516568,"band_gap":3.151299999999999,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":3.9999998,"is_theoretical":true,"updated_at":"2021-11-28T01:35:15.636000Z","spacegroup":47},{"id":"mp-1196263","created_at":"2022-09-04T14:41:09.958425Z","structure_string":"Mo8 As8 O48\n1.0\n7.377321 0.000000 0.000000\n0.000000 12.679373 0.000000\n-3.169555 0.000000 11.924723\nMo As O\n8 8 48\ndirect\n0.619168 0.271613 0.779892 Mo\n0.380832 0.771613 0.720108 Mo\n0.380832 0.728387 0.220108 Mo\n0.619168 0.228387 0.279892 Mo\n0.178432 0.284141 0.585796 Mo\n0.821568 0.784141 0.914204 Mo\n0.821568 0.715859 0.414204 Mo\n0.178432 0.215859 0.085796 Mo\n0.205648 0.358724 0.325881 As\n0.794352 0.858724 0.174119 As\n0.794352 0.641276 0.674119 As\n0.205648 0.141276 0.825881 As\n0.612295 0.147219 0.012710 As\n0.387705 0.647219 0.487290 As\n0.387705 0.852781 0.987290 As\n0.612295 0.352781 0.512710 As\n0.996206 0.202206 0.596839 O\n0.003794 0.702206 0.903161 O\n0.003794 0.797794 0.403161 O\n0.996206 0.297794 0.096839 O\n0.479764 0.297518 0.609959 O\n0.520236 0.797518 0.890041 O\n0.520236 0.702482 0.390041 O\n0.479764 0.202482 0.109959 O\n0.103756 0.411118 0.595682 O\n0.896244 0.911118 0.904318 O\n0.896244 0.588882 0.404318 O\n0.103756 0.088882 0.095682 O\n0.768126 0.375797 0.775164 O\n0.231874 0.875797 0.724836 O\n0.231874 0.624203 0.224836 O\n0.768126 0.124203 0.275164 O\n0.743086 0.158059 0.773688 O\n0.256914 0.658059 0.726312 O\n0.256914 0.841941 0.226312 O\n0.743086 0.341941 0.273688 O\n0.322240 0.236526 0.747241 O\n0.677760 0.736526 0.752759 O\n0.677760 0.763474 0.252759 O\n0.322240 0.263474 0.247241 O\n0.169130 0.266590 0.429991 O\n0.830870 0.766590 0.070009 O\n0.830870 0.733410 0.570009 O\n0.169130 0.233410 0.929991 O\n0.417991 0.418577 0.413434 O\n0.582009 0.918577 0.086566 O\n0.582009 0.581423 0.586566 O\n0.417991 0.081423 0.913434 O\n0.607108 0.268450 0.933411 O\n0.392892 0.768450 0.566589 O\n0.392892 0.731550 0.066589 O\n0.607108 0.231550 0.433411 O\n0.542922 0.511622 0.866135 O\n0.457078 0.011622 0.633865 O\n0.457078 0.488378 0.133865 O\n0.542922 0.988378 0.366135 O\n0.315421 0.044721 0.555887 O\n0.684579 0.544721 0.944113 O\n0.684579 0.955279 0.444113 O\n0.315421 0.455279 0.055887 O\n0.277000 0.500888 0.960069 O\n0.723000 0.000888 0.539931 O\n0.723000 0.499112 0.039931 O\n0.277000 0.999112 0.460069 O\n","nsites":64,"nelements":3,"elements":["Mo","As","O"],"chemical_system":"As-Mo-O","density":3.178151185644927,"density_atomic":0.057376653660384976,"volume":1115.4362605184142,"volume_molar":10.495803390078002,"formula_full":"Mo8 As8 O48","formula_reduced":"MoAsO6","formula_anonymous":"ABC6","energy":-423.52057829,"energy_per_atom":-6.61750903578125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-397.90457829,"band_gap":0.8843,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0684443,"is_theoretical":false,"updated_at":"2021-11-28T01:35:10.071000Z","spacegroup":14},{"id":"mp-1093684","created_at":"2022-09-04T14:41:09.962543Z","structure_string":"Be1 Al1 Pd2\n1.0\n-4.458982 5.138538 7.265677\n4.458982 -5.138538 7.265677\n4.458982 5.138538 -7.265677\nBe Al Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.000000 0.500000 0.500000 Al\n0.000000 0.238864 0.238864 Pd\n0.000000 0.761136 0.761136 Pd\n","nsites":4,"nelements":3,"elements":["Be","Al","Pd"],"chemical_system":"Al-Be-Pd","density":0.6205073934045818,"density_atomic":0.006006875367187577,"volume":665.903611360061,"volume_molar":100.25413200506556,"formula_full":"Be1 Al1 Pd2","formula_reduced":"BeAlPd2","formula_anonymous":"ABC2","energy":-11.64629889,"energy_per_atom":-2.9115747225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.64629889,"band_gap":0.3228,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.3315429,"is_theoretical":true,"updated_at":"2021-11-28T01:35:15.613000Z","spacegroup":71},{"id":"mp-774494","created_at":"2022-09-04T14:41:09.930428Z","structure_string":"Li8 Ti4 Mn8 Fe6 O36\n1.0\n2.936968 0.000000 0.000000\n0.000000 9.112073 0.000000\n0.000000 0.000000 25.076774\nLi Ti Mn Fe O\n8 4 8 6 36\ndirect\n0.000000 0.177863 0.996444 Li\n0.000000 0.187177 0.202184 Li\n0.000000 0.312823 0.702184 Li\n0.000000 0.322137 0.496444 Li\n0.000000 0.677863 0.503556 Li\n0.000000 0.687177 0.297816 Li\n0.000000 0.812823 0.797816 Li\n0.000000 0.822137 0.003556 Li\n0.000000 0.996298 0.105755 Ti\n0.000000 0.503702 0.605755 Ti\n0.000000 0.496298 0.394245 Ti\n0.000000 0.003702 0.894245 Ti\n0.000000 0.008097 0.311207 Mn\n0.500000 0.146842 0.586298 Mn\n0.500000 0.353158 0.086298 Mn\n0.000000 0.491903 0.811207 Mn\n0.000000 0.508097 0.188793 Mn\n0.500000 0.646842 0.913702 Mn\n0.500000 0.853158 0.413702 Mn\n0.000000 0.991903 0.688793 Mn\n0.000000 0.000000 0.500000 Fe\n0.500000 0.153565 0.804326 Fe\n0.500000 0.346435 0.304326 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.653565 0.695674 Fe\n0.500000 0.846435 0.195674 Fe\n0.000000 0.993039 0.419347 O\n0.000000 0.006961 0.580653 O\n0.500000 0.042124 0.942305 O\n0.500000 0.052695 0.160515 O\n0.500000 0.116275 0.661696 O\n0.000000 0.124948 0.752929 O\n0.500000 0.154617 0.507794 O\n0.500000 0.129063 0.285559 O\n0.000000 0.185947 0.858032 O\n0.000000 0.215110 0.086246 O\n0.000000 0.284890 0.586246 O\n0.000000 0.314053 0.358032 O\n0.500000 0.370937 0.785559 O\n0.500000 0.345383 0.007794 O\n0.000000 0.375052 0.252929 O\n0.500000 0.383725 0.161696 O\n0.500000 0.447305 0.660515 O\n0.500000 0.457876 0.442305 O\n0.000000 0.493039 0.080653 O\n0.000000 0.506961 0.919347 O\n0.500000 0.542124 0.557695 O\n0.500000 0.552695 0.339485 O\n0.500000 0.616275 0.838304 O\n0.000000 0.624948 0.747071 O\n0.500000 0.654617 0.992206 O\n0.500000 0.629063 0.214441 O\n0.000000 0.685947 0.641968 O\n0.000000 0.715110 0.413754 O\n0.000000 0.784890 0.913754 O\n0.000000 0.814053 0.141968 O\n0.500000 0.870937 0.714441 O\n0.500000 0.845383 0.492206 O\n0.000000 0.875052 0.247071 O\n0.500000 0.883725 0.338304 O\n0.500000 0.947305 0.839485 O\n0.500000 0.957876 0.057695 O\n","nsites":62,"nelements":5,"elements":["Li","Ti","Mn","Fe","O"],"chemical_system":"Fe-Li-Mn-O-Ti","density":3.9528938215405933,"density_atomic":0.09238545849921041,"volume":671.101285929429,"volume_molar":6.518494206587143,"formula_full":"Li8 Ti4 Mn8 Fe6 O36","formula_reduced":"Li4Ti2Mn4(FeO6)3","formula_anonymous":"A2B3C4D4E18","energy":-484.64068989,"energy_per_atom":-7.816785320806451,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-433.02868989,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":56.0000948,"is_theoretical":true,"updated_at":"2021-11-28T01:35:09.822000Z","spacegroup":55},{"id":"mp-753269","created_at":"2022-09-04T14:41:10.020921Z","structure_string":"Li3 V3 Cr1 O8\n1.0\n2.048152 6.174851 0.000000\n-2.048152 6.174851 0.000000\n0.000000 1.877125 6.237192\nLi V Cr O\n3 3 1 8\ndirect\n0.056562 0.056562 0.637172 Li\n0.179680 0.179680 0.993122 Li\n0.937253 0.937253 0.362751 Li\n0.605389 0.605389 0.295673 V\n0.290107 0.290107 0.303616 V\n0.393738 0.393738 0.711922 V\n0.717101 0.717101 0.683489 Cr\n0.651458 0.651458 0.008505 O\n0.564191 0.564191 0.630003 O\n0.115953 0.115953 0.308838 O\n0.764537 0.764537 0.356745 O\n0.230311 0.230311 0.663822 O\n0.879666 0.879666 0.678818 O\n0.444757 0.444757 0.365431 O\n0.340539 0.340539 0.007755 O\n","nsites":15,"nelements":4,"elements":["Li","V","Cr","O"],"chemical_system":"Cr-Li-O-V","density":3.7222130760680816,"density_atomic":0.0950787544687162,"volume":157.7639514086762,"volume_molar":6.3338448149123225,"formula_full":"Li3 V3 Cr1 O8","formula_reduced":"Li3V3CrO8","formula_anonymous":"AB3C3D8","energy":-117.95641037,"energy_per_atom":-7.863760691333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-105.36141037,"band_gap":0.1876000000000002,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":7.9999357,"is_theoretical":true,"updated_at":"2021-11-28T01:35:12.077000Z","spacegroup":8},{"id":"mp-1209354","created_at":"2022-09-04T14:41:09.033770Z","structure_string":"Pr4 S2 O12\n1.0\n0.000000 -4.300326 0.000000\n-6.805676 2.150164 2.080169\n-0.010874 0.000000 -8.384972\nPr S O\n4 2 12\ndirect\n0.674224 0.337043 0.585295 Pr\n0.325776 0.662957 0.414705 Pr\n0.337181 0.662957 0.914705 Pr\n0.662819 0.337043 0.085295 Pr\n0.937441 0.000000 0.750000 S\n0.062559 0.000000 0.250000 S\n0.766560 0.505431 0.876250 O\n0.233440 0.494569 0.123750 O\n0.261129 0.494569 0.623750 O\n0.738871 0.505431 0.376250 O\n0.730231 0.994997 0.604116 O\n0.269769 0.005003 0.395884 O\n0.735234 0.005003 0.895884 O\n0.264766 0.994997 0.104116 O\n0.220771 0.180439 0.790845 O\n0.779229 0.819561 0.209155 O\n0.040331 0.819561 0.709155 O\n0.959669 0.180439 0.290845 O\n","nsites":18,"nelements":3,"elements":["Pr","S","O"],"chemical_system":"O-Pr-S","density":5.5448007547877065,"density_atomic":0.07332061953929732,"volume":245.49710726806694,"volume_molar":8.213434089672878,"formula_full":"Pr4 S2 O12","formula_reduced":"Pr2SO6","formula_anonymous":"AB2C6","energy":-142.87694646,"energy_per_atom":-7.937608136666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-134.63294646,"band_gap":5.1158,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.001434,"is_theoretical":true,"updated_at":"2021-11-28T01:35:11.548000Z","spacegroup":15}]}