{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable&page=12172","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable&page=12170","results":[{"id":"mp-1220246","created_at":"2022-09-04T14:40:15.319855Z","structure_string":"Ni4 H32 Cl8 O16\n1.0\n9.404583 0.000000 0.000000\n0.000000 5.995655 0.000000\n0.000000 4.135562 10.758935\nNi H Cl O\n4 32 8 16\ndirect\n0.916860 0.749381 0.767301 Ni\n0.083140 0.749381 0.267301 Ni\n0.578239 0.248612 0.235324 Ni\n0.421761 0.248612 0.735324 Ni\n0.685979 0.805909 0.883014 H\n0.314021 0.805909 0.383014 H\n0.819430 0.205960 0.118400 H\n0.180570 0.205960 0.618400 H\n0.936676 0.173354 0.793946 H\n0.063324 0.173354 0.293946 H\n0.560095 0.827346 0.205862 H\n0.439905 0.827346 0.705862 H\n0.762904 0.462392 0.689558 H\n0.237096 0.462392 0.189558 H\n0.735857 0.537296 0.315283 H\n0.264143 0.537296 0.815283 H\n0.825993 0.127034 0.565294 H\n0.174007 0.127034 0.065294 H\n0.672811 0.873213 0.434982 H\n0.327189 0.873213 0.934982 H\n0.902879 0.512704 0.612167 H\n0.097121 0.512704 0.112167 H\n0.591595 0.489915 0.386351 H\n0.408405 0.489915 0.886351 H\n0.949195 0.967653 0.926480 H\n0.050805 0.967653 0.426480 H\n0.550969 0.032312 0.072047 H\n0.449031 0.032312 0.572047 H\n0.686805 0.005633 0.644138 H\n0.313195 0.005633 0.144138 H\n0.812896 0.992222 0.356783 H\n0.187104 0.992222 0.856783 H\n0.728991 0.531130 0.947026 H\n0.271009 0.531130 0.447026 H\n0.822529 0.469627 0.125959 H\n0.177471 0.469627 0.625959 H\n0.061867 0.475950 0.931819 Cl\n0.938133 0.475950 0.431819 Cl\n0.435786 0.522172 0.069626 Cl\n0.564214 0.522172 0.569626 Cl\n0.110694 0.850659 0.620763 Cl\n0.889306 0.850659 0.120763 Cl\n0.389513 0.133564 0.381768 Cl\n0.610487 0.133564 0.881768 Cl\n0.979612 0.013837 0.838226 O\n0.020388 0.013837 0.338226 O\n0.521987 0.989786 0.160646 O\n0.478013 0.989786 0.660646 O\n0.732983 0.669162 0.868651 O\n0.267017 0.669162 0.368651 O\n0.760314 0.343095 0.117827 O\n0.239686 0.343095 0.617827 O\n0.789401 0.986685 0.632945 O\n0.210599 0.986685 0.132945 O\n0.710316 0.012814 0.367298 O\n0.289684 0.012814 0.867298 O\n0.867396 0.473023 0.698565 O\n0.132604 0.473023 0.198565 O\n0.632288 0.525559 0.301952 O\n0.367712 0.525559 0.801952 O\n","nsites":60,"nelements":4,"elements":["Ni","H","Cl","O"],"chemical_system":"Cl-H-Ni-O","density":2.2079259776309135,"density_atomic":0.09890216262619679,"volume":606.6601417682999,"volume_molar":6.0889879453504285,"formula_full":"Ni4 H32 Cl8 O16","formula_reduced":"NiH8(ClO2)2","formula_anonymous":"AB2C4D8","energy":-299.80062219,"energy_per_atom":-4.9966770365,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-273.73262219,"band_gap":4.3162,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.0008088,"is_theoretical":true,"updated_at":"2021-11-28T01:34:56.604000Z","spacegroup":7},{"id":"mp-1287","created_at":"2022-09-04T14:40:15.326230Z","structure_string":"K6 S6\n1.0\n4.293041 -7.435766 0.000000\n4.293041 7.435766 0.000000\n0.000000 0.000000 5.920854\nK S\n6 6\ndirect\n0.000000 0.642561 0.500000 K\n0.357439 0.357439 0.500000 K\n0.642561 0.000000 0.500000 K\n0.000000 0.307123 0.000000 K\n0.692877 0.692877 0.000000 K\n0.307123 0.000000 0.000000 K\n0.666667 0.333333 0.181137 S\n0.666667 0.333333 0.818863 S\n0.333333 0.666667 0.818863 S\n0.333333 0.666667 0.181137 S\n0.000000 0.000000 0.679870 S\n0.000000 0.000000 0.320130 S\n","nsites":12,"nelements":2,"elements":["K","S"],"chemical_system":"K-S","density":1.8756479585491195,"density_atomic":0.031745059676807845,"volume":378.01157478267095,"volume_molar":18.970324268754254,"formula_full":"K6 S6","formula_reduced":"KS","formula_anonymous":"AB","energy":-45.68144011,"energy_per_atom":-3.806786675833333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-42.66344011,"band_gap":1.469,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002691,"is_theoretical":false,"updated_at":"2021-11-28T01:34:51.838000Z","spacegroup":189},{"id":"mp-1078856","created_at":"2022-09-04T14:40:15.330596Z","structure_string":"Sm3 In3 Ni3\n1.0\n3.759197 -6.511121 0.000000\n3.759197 6.511121 0.000000\n0.000000 0.000000 3.916404\nSm In Ni\n3 3 3\ndirect\n0.000000 0.413557 0.500000 Sm\n0.586443 0.586443 0.500000 Sm\n0.413557 0.000000 0.500000 Sm\n0.000000 0.750332 0.000000 In\n0.249668 0.249668 0.000000 In\n0.750332 0.000000 0.000000 In\n0.333333 0.666667 0.000000 Ni\n0.666667 0.333333 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n","nsites":9,"nelements":3,"elements":["Sm","In","Ni"],"chemical_system":"In-Ni-Sm","density":8.415397179111928,"density_atomic":0.04694336058827587,"volume":191.7204027835995,"volume_molar":12.828525023630357,"formula_full":"Sm3 In3 Ni3","formula_reduced":"SmInNi","formula_anonymous":"ABC","energy":-43.99739723,"energy_per_atom":-4.888599692222222,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-43.99739723,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0024158,"is_theoretical":false,"updated_at":"2021-11-28T01:34:54.812000Z","spacegroup":189},{"id":"mp-27668","created_at":"2022-09-04T14:40:15.334002Z","structure_string":"Mg4 Ga10\n1.0\n-4.331063 4.331063 3.608543\n4.331063 -4.331063 3.608543\n4.331063 4.331063 -3.608543\nMg Ga\n4 10\ndirect\n0.699424 0.699424 0.398849 Mg\n0.699424 0.300576 0.000000 Mg\n0.300576 0.699424 0.000000 Mg\n0.300576 0.300576 0.601151 Mg\n0.181235 0.884305 0.703070 Ga\n0.478166 0.181235 0.296930 Ga\n0.884305 0.181235 0.703070 Ga\n0.181235 0.478166 0.296930 Ga\n0.710063 0.710063 0.000000 Ga\n0.289937 0.289937 0.000000 Ga\n0.521834 0.818765 0.703070 Ga\n0.818765 0.115695 0.296930 Ga\n0.818765 0.521834 0.703070 Ga\n0.115695 0.818765 0.296930 Ga\n","nsites":14,"nelements":2,"elements":["Mg","Ga"],"chemical_system":"Ga-Mg","density":4.872308610853556,"density_atomic":0.05170674001787913,"volume":270.7577386460467,"volume_molar":11.646722957041321,"formula_full":"Mg4 Ga10","formula_reduced":"Mg2Ga5","formula_anonymous":"A2B5","energy":-38.42229507,"energy_per_atom":-2.7444496478571425,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.42229507,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002943,"is_theoretical":false,"updated_at":"2021-11-28T01:34:53.052000Z","spacegroup":139},{"id":"mp-766811","created_at":"2022-09-04T14:40:15.338108Z","structure_string":"Li4 Co4 P4 O16\n1.0\n-2.576478 4.460729 0.036297\n-0.036486 0.059171 9.353733\n7.768555 4.483327 -0.001924\nLi Co P O\n4 4 4 16\ndirect\n0.495194 0.742591 0.500266 Li\n0.995180 0.742643 0.000193 Li\n0.995167 0.242676 0.999689 Li\n0.495129 0.242740 0.499734 Li\n0.996874 0.347106 0.666631 Co\n0.497019 0.847160 0.833422 Co\n0.496871 0.347337 0.166599 Co\n0.996939 0.847342 0.333462 Co\n0.500936 0.712305 0.169663 P\n0.000798 0.712083 0.669640 P\n0.000881 0.212350 0.330328 P\n0.500789 0.212178 0.830306 P\n0.633916 0.770397 0.026106 O\n0.133815 0.770026 0.525985 O\n0.133909 0.270531 0.474106 O\n0.633857 0.270193 0.973990 O\n0.531883 0.550134 0.175827 O\n0.031136 0.549922 0.676016 O\n0.031804 0.050153 0.324022 O\n0.531514 0.050038 0.823947 O\n0.633159 0.779737 0.309430 O\n0.133395 0.779439 0.809322 O\n0.133031 0.279802 0.190564 O\n0.633101 0.279594 0.690700 O\n0.208704 0.758439 0.169257 O\n0.708598 0.758337 0.669278 O\n0.708459 0.258296 0.330770 O\n0.208543 0.258246 0.830748 O\n","nsites":28,"nelements":4,"elements":["Li","Co","P","O"],"chemical_system":"Co-Li-O-P","density":2.4721260709036454,"density_atomic":0.06479037419985809,"volume":432.1629616403933,"volume_molar":9.294807808060462,"formula_full":"Li4 Co4 P4 O16","formula_reduced":"LiCoPO4","formula_anonymous":"ABCD4","energy":-202.96148853000005,"energy_per_atom":-7.248624590357145,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-185.41748853,"band_gap":2.5705,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":9.5e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:00.401000Z","spacegroup":9},{"id":"mp-1207909","created_at":"2022-09-04T14:40:15.340898Z","structure_string":"U4 Ta4 N8\n1.0\n3.233169 0.000000 0.000000\n0.000000 5.641341 0.000000\n0.000000 0.000000 11.062625\nU Ta N\n4 4 8\ndirect\n0.250000 0.579280 0.857019 U\n0.750000 0.420720 0.142981 U\n0.750000 0.920720 0.357019 U\n0.250000 0.079280 0.642981 U\n0.250000 0.923172 0.102630 Ta\n0.750000 0.076828 0.897370 Ta\n0.750000 0.576828 0.602630 Ta\n0.250000 0.423172 0.397370 Ta\n0.250000 0.662160 0.245079 N\n0.750000 0.337840 0.754921 N\n0.750000 0.837840 0.745079 N\n0.250000 0.162160 0.254921 N\n0.250000 0.759143 0.504226 N\n0.750000 0.240857 0.495774 N\n0.750000 0.740857 0.004226 N\n0.250000 0.259143 0.995774 N\n","nsites":16,"nelements":3,"elements":["U","Ta","N"],"chemical_system":"N-Ta-U","density":14.714250030115654,"density_atomic":0.07929595492000652,"volume":201.7757402145008,"volume_molar":7.594511934530727,"formula_full":"U4 Ta4 N8","formula_reduced":"UTaN2","formula_anonymous":"ABC2","energy":-183.07617933,"energy_per_atom":-11.442261208125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-180.18817933,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0826421,"is_theoretical":true,"updated_at":"2021-11-28T01:34:52.223000Z","spacegroup":62},{"id":"mp-15065","created_at":"2022-09-04T14:40:15.342825Z","structure_string":"Cu2 Ir4 S8\n1.0\n0.000000 4.960101 4.960101\n4.960101 0.000000 4.960101\n4.960101 4.960101 0.000000\nCu Ir S\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 Cu\n0.625000 0.625000 0.625000 Ir\n0.625000 0.625000 0.125000 Ir\n0.125000 0.625000 0.625000 Ir\n0.625000 0.125000 0.625000 Ir\n0.385433 0.385433 0.843702 S\n0.385433 0.385433 0.385433 S\n0.864567 0.864567 0.864567 S\n0.864567 0.864567 0.406298 S\n0.385433 0.843702 0.385433 S\n0.843702 0.385433 0.385433 S\n0.406298 0.864567 0.864567 S\n0.864567 0.406298 0.864567 S\n","nsites":14,"nelements":3,"elements":["Cu","Ir","S"],"chemical_system":"Cu-Ir-S","density":7.841171261871164,"density_atomic":0.05736228993995798,"volume":244.06278087318378,"volume_molar":10.498431576395346,"formula_full":"Cu2 Ir4 S8","formula_reduced":"Cu(IrS2)2","formula_anonymous":"AB2C4","energy":-85.90717445,"energy_per_atom":-6.136226746428571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-81.88317445,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0016881,"is_theoretical":false,"updated_at":"2021-11-28T01:34:47.404000Z","spacegroup":227},{"id":"mp-555085","created_at":"2022-09-04T14:40:15.347777Z","structure_string":"K2 Au2 N8 O24\n1.0\n7.345312 0.000000 0.000000\n0.000000 8.660385 0.000000\n0.000000 5.297277 8.937113\nK Au N O\n2 2 8 24\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Au\n0.500000 0.000000 0.500000 Au\n0.244181 0.696983 0.161502 N\n0.392372 0.166550 0.671036 N\n0.892372 0.833450 0.828964 N\n0.607628 0.833450 0.328964 N\n0.255819 0.696983 0.661502 N\n0.744181 0.303017 0.338498 N\n0.755819 0.303017 0.838498 N\n0.107628 0.166550 0.171036 N\n0.984024 0.069723 0.250824 O\n0.803653 0.434989 0.224457 O\n0.296255 0.755094 0.031837 O\n0.350892 0.170007 0.541305 O\n0.295844 0.267520 0.693278 O\n0.515976 0.069723 0.750824 O\n0.704156 0.732480 0.306722 O\n0.696347 0.434989 0.724457 O\n0.149108 0.170007 0.041305 O\n0.484024 0.930277 0.249176 O\n0.850892 0.829993 0.958695 O\n0.015976 0.930277 0.749176 O\n0.606071 0.217759 0.312695 O\n0.796255 0.244906 0.468163 O\n0.106071 0.782241 0.187305 O\n0.893929 0.217759 0.812695 O\n0.303653 0.565011 0.275543 O\n0.649108 0.829993 0.458695 O\n0.196347 0.565011 0.775543 O\n0.703745 0.244906 0.968163 O\n0.795844 0.732480 0.806722 O\n0.393929 0.782241 0.687305 O\n0.204156 0.267520 0.193278 O\n0.203745 0.755094 0.531837 O\n","nsites":36,"nelements":4,"elements":["K","Au","N","O"],"chemical_system":"Au-K-N-O","density":2.8278446437491507,"density_atomic":0.063322463865946,"volume":568.5186235995521,"volume_molar":9.510275488883224,"formula_full":"K2 Au2 N8 O24","formula_reduced":"KAu(NO3)4","formula_anonymous":"ABC4D12","energy":-227.65840188,"energy_per_atom":-6.323844496666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-211.17040188,"band_gap":3.3381,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":5.7e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:34:47.652000Z","spacegroup":14},{"id":"mp-1196758","created_at":"2022-09-04T14:40:15.361202Z","structure_string":"K4 Cd4 B12 O24\n1.0\n6.709031 3.649638 0.000000\n-6.709031 3.649638 0.000000\n0.000000 3.648363 12.359666\nK Cd B O\n4 4 12 24\ndirect\n0.166543 0.682523 0.131139 K\n0.317477 0.833457 0.368861 K\n0.833457 0.317477 0.868861 K\n0.682523 0.166543 0.631139 K\n0.522698 0.375773 0.122314 Cd\n0.624227 0.477302 0.377686 Cd\n0.477302 0.624227 0.877686 Cd\n0.375773 0.522698 0.622314 Cd\n0.685198 0.071924 0.125859 B\n0.928076 0.314802 0.374141 B\n0.314802 0.928076 0.874141 B\n0.071924 0.685199 0.625859 B\n0.814906 0.840258 0.157099 B\n0.159742 0.185094 0.342901 B\n0.185094 0.159742 0.842901 B\n0.840258 0.814906 0.657099 B\n0.075565 0.232271 0.088442 B\n0.767729 0.924435 0.411558 B\n0.924435 0.767729 0.911558 B\n0.232271 0.075565 0.588442 B\n0.278837 0.409232 0.060746 O\n0.590768 0.721163 0.439254 O\n0.721163 0.590768 0.939254 O\n0.409232 0.278837 0.560746 O\n0.648031 0.869914 0.163520 O\n0.130086 0.351969 0.336480 O\n0.351969 0.130086 0.836480 O\n0.869914 0.648031 0.663520 O\n0.902471 0.251815 0.087856 O\n0.748185 0.097529 0.412144 O\n0.097529 0.748185 0.912144 O\n0.251815 0.902471 0.587856 O\n0.775739 0.643902 0.184546 O\n0.356098 0.224261 0.315454 O\n0.224261 0.356098 0.815454 O\n0.643902 0.775739 0.684546 O\n0.027694 0.025429 0.121143 O\n0.974571 0.972306 0.378857 O\n0.972306 0.974571 0.878857 O\n0.025429 0.027694 0.621143 O\n0.519731 0.086556 0.126265 O\n0.913444 0.480269 0.373735 O\n0.480269 0.913444 0.873735 O\n0.086556 0.519731 0.626265 O\n","nsites":44,"nelements":4,"elements":["K","Cd","B","O"],"chemical_system":"B-Cd-K-O","density":3.0720318311183634,"density_atomic":0.07269530409281558,"volume":605.266056027799,"volume_molar":8.284084969657844,"formula_full":"K4 Cd4 B12 O24","formula_reduced":"KCd(BO2)3","formula_anonymous":"ABC3D6","energy":-319.61935475,"energy_per_atom":-7.264076244318182,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-303.13135475,"band_gap":3.7622,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001457,"is_theoretical":false,"updated_at":"2021-11-28T01:34:59.246000Z","spacegroup":15},{"id":"mp-14396","created_at":"2022-09-04T14:40:15.363964Z","structure_string":"Mg6 P4 O16\n1.0\n8.340386 0.000000 0.000000\n0.000000 5.122373 0.000000\n0.000000 4.551241 7.711524\nMg P O\n6 4 16\ndirect\n0.855871 0.516022 0.391761 Mg\n0.355871 0.483978 0.108239 Mg\n0.144129 0.483978 0.608239 Mg\n0.644129 0.516022 0.891761 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.805425 0.168800 0.798371 P\n0.305425 0.831200 0.701629 P\n0.194575 0.831200 0.201629 P\n0.694575 0.168800 0.298371 P\n0.575455 0.310915 0.143354 O\n0.075455 0.689085 0.356646 O\n0.424545 0.689085 0.856646 O\n0.924545 0.310915 0.643354 O\n0.862635 0.322336 0.237209 O\n0.362635 0.677664 0.262791 O\n0.137365 0.677664 0.762791 O\n0.637365 0.322336 0.737209 O\n0.698207 0.822874 0.373926 O\n0.198207 0.177126 0.126074 O\n0.855243 0.246732 0.938036 O\n0.355243 0.753268 0.561964 O\n0.144757 0.753268 0.061964 O\n0.644757 0.246732 0.438036 O\n0.801793 0.822874 0.873926 O\n0.301793 0.177126 0.626074 O\n","nsites":26,"nelements":3,"elements":["Mg","P","O"],"chemical_system":"Mg-O-P","density":2.6497339576423826,"density_atomic":0.0789179477848836,"volume":329.4561089053077,"volume_molar":7.630888700267895,"formula_full":"Mg6 P4 O16","formula_reduced":"Mg3(PO4)2","formula_anonymous":"A2B3C8","energy":-190.12480008,"energy_per_atom":-7.312492310769231,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-179.13280008,"band_gap":5.5403,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000138,"is_theoretical":false,"updated_at":"2021-11-28T01:34:53.485000Z","spacegroup":14},{"id":"mp-16866","created_at":"2022-09-04T14:40:15.368190Z","structure_string":"K2 Np2 N6 O22\n1.0\n6.903620 -4.767785 0.000000\n6.903620 4.767785 0.000000\n3.610887 0.000000 7.573192\nK Np N O\n2 2 6 22\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.750000 0.750000 0.750000 Np\n0.250000 0.250000 0.250000 Np\n0.750000 0.443401 0.056599 N\n0.056599 0.750000 0.443401 N\n0.443401 0.056599 0.750000 N\n0.250000 0.556599 0.943401 N\n0.943401 0.250000 0.556599 N\n0.556599 0.943401 0.250000 N\n0.655724 0.655724 0.655724 O\n0.844276 0.844276 0.844276 O\n0.155724 0.155724 0.155724 O\n0.344276 0.344276 0.344276 O\n0.874394 0.443620 0.911817 O\n0.588183 0.056380 0.625606 O\n0.056380 0.625606 0.588183 O\n0.625606 0.588183 0.056380 O\n0.685425 0.814575 0.250000 O\n0.814575 0.250000 0.685425 O\n0.250000 0.685425 0.814575 O\n0.314575 0.185425 0.750000 O\n0.185425 0.750000 0.314575 O\n0.750000 0.314575 0.185425 O\n0.556380 0.088183 0.125606 O\n0.088183 0.125606 0.556380 O\n0.125606 0.556380 0.088183 O\n0.411817 0.943620 0.374394 O\n0.943620 0.374394 0.411817 O\n0.374394 0.411817 0.943620 O\n0.443620 0.911817 0.874394 O\n0.911817 0.874394 0.443620 O\n","nsites":32,"nelements":4,"elements":["K","Np","N","O"],"chemical_system":"K-N-Np-O","density":3.2915602903006653,"density_atomic":0.06418705854041036,"volume":498.5428640549668,"volume_molar":9.382172819476732,"formula_full":"K2 Np2 N6 O22","formula_reduced":"KNpN3O11","formula_anonymous":"ABC3D11","energy":-238.95068839,"energy_per_atom":-7.4672090121875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-223.83668839,"band_gap":0.0981999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9941549,"is_theoretical":false,"updated_at":"2021-11-28T01:34:59.355000Z","spacegroup":167},{"id":"mp-1222810","created_at":"2022-09-04T14:40:15.381857Z","structure_string":"Li4 In2 P4 H2 O16\n1.0\n8.367902 0.000000 0.000000\n0.000000 4.892623 0.000000\n0.000000 1.801700 7.637773\nLi In P H O\n4 2 4 2 16\ndirect\n0.133232 0.635082 0.905919 Li\n0.365362 0.142913 0.411527 Li\n0.865362 0.857087 0.588473 Li\n0.633232 0.364918 0.094081 Li\n0.500200 0.750248 0.744684 In\n0.000200 0.249752 0.255316 In\n0.345645 0.115511 0.017437 P\n0.150969 0.609777 0.525373 P\n0.650969 0.390223 0.474627 P\n0.845645 0.884489 0.982563 P\n0.486275 0.795881 0.236088 H\n0.986275 0.204119 0.763912 H\n0.186627 0.246176 0.057283 O\n0.312657 0.746782 0.555953 O\n0.812657 0.253218 0.444047 O\n0.686627 0.753824 0.942717 O\n0.428815 0.991526 0.202218 O\n0.069630 0.481680 0.702159 O\n0.569630 0.518320 0.297841 O\n0.928815 0.008474 0.797782 O\n0.320350 0.883899 0.915689 O\n0.181036 0.388495 0.413891 O\n0.681036 0.611505 0.586109 O\n0.820350 0.116101 0.084311 O\n0.463355 0.340540 0.920220 O\n0.036848 0.838375 0.420301 O\n0.536849 0.161625 0.579699 O\n0.963355 0.659460 0.079780 O\n","nsites":28,"nelements":5,"elements":["Li","In","P","H","O"],"chemical_system":"H-In-Li-O-P","density":3.3949205837097733,"density_atomic":0.08954326928493918,"volume":312.69798638801194,"volume_molar":6.725397462132757,"formula_full":"Li4 In2 P4 H2 O16","formula_reduced":"Li2InP2HO8","formula_anonymous":"ABC2D2E8","energy":-190.31195863,"energy_per_atom":-6.796855665357143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-179.31995863,"band_gap":3.921,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.25e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:34:54.026000Z","spacegroup":4}]}