{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=51","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=49","results":[{"id":"mp-1033703","created_at":"2022-09-04T14:47:13.621392Z","structure_string":"Li1 Y1 Mg6 O8\n1.0\n8.742234 -0.000000 0.000000\n0.000000 4.361452 0.000000\n0.000000 0.000000 4.361452\nLi Y Mg O\n1 1 6 8\ndirect\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Y\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.258902 0.000000 0.500000 Mg\n0.741098 0.000000 0.500000 Mg\n0.258902 0.500000 -0.000000 Mg\n0.741098 0.500000 0.000000 Mg\n0.260968 0.000000 0.000000 O\n0.739032 -0.000000 -0.000000 O\n0.260444 0.500000 0.500000 O\n0.739556 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":16,"nelements":4,"elements":["Li","Y","Mg","O"],"chemical_system":"Li-Mg-O-Y","density":3.691314868527004,"density_atomic":0.09621335553145592,"volume":166.29707914894385,"volume_molar":6.259152616323756,"formula_full":"Li1 Y1 Mg6 O8","formula_reduced":"LiYMg6O8","formula_anonymous":"ABC6D8","energy":-106.24925434,"energy_per_atom":-6.64057839625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-100.75325434,"band_gap":5.5078,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:53.775000Z","spacegroup":123},{"id":"mp-6724","created_at":"2022-09-04T14:47:21.262756Z","structure_string":"K8 Cd8 S12 O48\n1.0\n10.378649 0.000000 0.000000\n0.000000 10.417683 0.000000\n0.000000 0.000000 10.483353\nK Cd S O\n8 8 12 48\ndirect\n0.420106 0.556121 0.062574 K\n0.079894 0.443879 0.562574 K\n0.786297 0.312511 0.188529 K\n0.920106 0.943879 0.937426 K\n0.713703 0.687489 0.688529 K\n0.286297 0.187489 0.811471 K\n0.213703 0.812511 0.311471 K\n0.579894 0.056121 0.437426 K\n0.444626 0.415937 0.406562 Cd\n0.555374 0.915937 0.093438 Cd\n0.944626 0.084063 0.593438 Cd\n0.055374 0.584063 0.906562 Cd\n0.353829 0.823524 0.663152 Cd\n0.853829 0.676476 0.336848 Cd\n0.146171 0.176476 0.163152 Cd\n0.646171 0.323524 0.836848 Cd\n0.747939 0.618520 0.032619 S\n0.252061 0.118520 0.467381 S\n0.247939 0.881480 0.967381 S\n0.752061 0.381480 0.532619 S\n0.135373 0.497466 0.239653 S\n0.864627 0.997466 0.260347 S\n0.635373 0.002534 0.760347 S\n0.364627 0.502534 0.739653 S\n0.965303 0.276161 0.879098 S\n0.534697 0.723839 0.379098 S\n0.465303 0.223839 0.120902 S\n0.034697 0.776161 0.620902 S\n0.851892 0.674302 0.950131 O\n0.148108 0.174302 0.549869 O\n0.351892 0.825698 0.049869 O\n0.648108 0.325698 0.450131 O\n0.683500 0.509361 0.967504 O\n0.316500 0.009361 0.532496 O\n0.183500 0.990639 0.032496 O\n0.816500 0.490639 0.467504 O\n0.650087 0.718327 0.059870 O\n0.349913 0.218327 0.440130 O\n0.150087 0.781673 0.940130 O\n0.849913 0.281673 0.559870 O\n0.806529 0.569671 0.154060 O\n0.193471 0.069671 0.345940 O\n0.306529 0.930329 0.845940 O\n0.693471 0.430329 0.654060 O\n0.076223 0.367999 0.257160 O\n0.923777 0.867999 0.242840 O\n0.059229 0.592464 0.315664 O\n0.576223 0.132001 0.742840 O\n0.269703 0.500161 0.290026 O\n0.730297 0.000161 0.209974 O\n0.769703 0.999839 0.709974 O\n0.230297 0.499839 0.790026 O\n0.141676 0.536681 0.103229 O\n0.858324 0.036681 0.396771 O\n0.641676 0.963319 0.896771 O\n0.358324 0.463319 0.603229 O\n0.445467 0.720306 0.489182 O\n0.554533 0.220306 0.010818 O\n0.945467 0.779694 0.510818 O\n0.054533 0.279694 0.989182 O\n0.668272 0.755479 0.423992 O\n0.331728 0.255479 0.076008 O\n0.168272 0.744521 0.576008 O\n0.831728 0.244521 0.923992 O\n0.489648 0.824966 0.288779 O\n0.510352 0.324966 0.211221 O\n0.989648 0.675034 0.711221 O\n0.010352 0.175034 0.788779 O\n0.534990 0.595336 0.315620 O\n0.465010 0.095336 0.184380 O\n0.034990 0.904664 0.684380 O\n0.965010 0.404664 0.815620 O\n0.440771 0.407536 0.815664 O\n0.559229 0.907536 0.684336 O\n0.940771 0.092464 0.184336 O\n0.423777 0.632001 0.757160 O\n","nsites":76,"nelements":4,"elements":["K","Cd","S","O"],"chemical_system":"Cd-K-O-S","density":3.464463921813925,"density_atomic":0.0670504072087153,"volume":1133.4755919293123,"volume_molar":8.98151258239821,"formula_full":"K8 Cd8 S12 O48","formula_reduced":"K2Cd2(SO4)3","formula_anonymous":"A2B2C3D12","energy":-456.11263092,"energy_per_atom":-6.001481985789474,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-423.13663092,"band_gap":3.7528,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:38:08.116000Z","spacegroup":19},{"id":"mp-1031004","created_at":"2022-09-04T14:47:10.457104Z","structure_string":"Rb1 La1 Mg6 O8\n1.0\n9.124194 0.000000 0.000000\n0.000000 4.736932 0.000000\n0.000000 0.000000 4.736932\nRb La Mg O\n1 1 6 8\ndirect\n0.000000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 La\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.276818 -0.000000 0.500000 Mg\n0.723182 0.000000 0.500000 Mg\n0.276818 0.500000 -0.000000 Mg\n0.723182 0.500000 0.000000 Mg\n0.273024 -0.000000 0.000000 O\n0.726976 0.000000 -0.000000 O\n0.285682 0.500000 0.500000 O\n0.714318 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":16,"nelements":4,"elements":["Rb","La","Mg","O"],"chemical_system":"La-Mg-O-Rb","density":4.040756455929039,"density_atomic":0.07815039387942795,"volume":204.7334530992273,"volume_molar":7.705835455277532,"formula_full":"Rb1 La1 Mg6 O8","formula_reduced":"RbLaMg6O8","formula_anonymous":"ABC6D8","energy":-96.80953125,"energy_per_atom":-6.050595703125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-91.31353125,"band_gap":3.7206,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:52.994000Z","spacegroup":123},{"id":"mp-757200","created_at":"2022-09-04T14:48:13.656040Z","structure_string":"Li6 Si4 Bi6 O20\n1.0\n6.905482 0.000000 0.000000\n0.000000 5.455064 0.000000\n0.000000 0.389376 12.904011\nLi Si Bi O\n6 4 6 20\ndirect\n0.269156 0.016297 0.463031 Li\n0.517335 0.979996 0.265840 Li\n0.482665 0.979996 0.765840 Li\n0.730844 0.016297 0.963031 Li\n0.961620 0.473779 0.058014 Li\n0.038380 0.473779 0.558014 Li\n0.262038 0.532175 0.341844 Si\n0.212215 0.004818 0.002516 Si\n0.737962 0.532175 0.841844 Si\n0.787785 0.004818 0.502516 Si\n0.257429 0.446692 0.824990 Bi\n0.492026 0.490287 0.594676 Bi\n0.507974 0.490287 0.094676 Bi\n0.742571 0.446692 0.324990 Bi\n0.033080 0.950886 0.711993 Bi\n0.966920 0.950886 0.211993 Bi\n0.321095 0.818502 0.345786 O\n0.256242 0.392040 0.457811 O\n0.220635 0.015503 0.873538 O\n0.198076 0.289887 0.041644 O\n0.299613 0.738235 0.698521 O\n0.235929 0.254524 0.677177 O\n0.411321 0.881997 0.050890 O\n0.417779 0.373111 0.269536 O\n0.582221 0.373111 0.769536 O\n0.588679 0.881997 0.550890 O\n0.678905 0.818502 0.845786 O\n0.779365 0.015503 0.373538 O\n0.801924 0.289887 0.541644 O\n0.743758 0.392040 0.957811 O\n0.764071 0.254524 0.177177 O\n0.700387 0.738235 0.198521 O\n0.987716 0.854610 0.541636 O\n0.948418 0.516717 0.780512 O\n0.051582 0.516717 0.280512 O\n0.012284 0.854610 0.041636 O\n","nsites":36,"nelements":4,"elements":["Li","Si","Bi","O"],"chemical_system":"Bi-Li-O-Si","density":5.902536397255522,"density_atomic":0.07406003763693123,"volume":486.0921105182915,"volume_molar":8.131430866296188,"formula_full":"Li6 Si4 Bi6 O20","formula_reduced":"Li3Si2Bi3O10","formula_anonymous":"A2B3C3D10","energy":-240.19638066,"energy_per_atom":-6.672121685,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-226.45638066,"band_gap":2.9044,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:32.870000Z","spacegroup":7},{"id":"mp-1105199","created_at":"2022-09-04T14:47:22.088348Z","structure_string":"Rb2 La2 Mn2 W2 O12\n1.0\n5.767439 -0.000009 -0.053684\n-0.000009 5.788331 -0.000016\n0.002053 -0.000023 8.359642\nRb La Mn W O\n2 2 2 2 12\ndirect\n0.243198 0.762006 0.000746 Rb\n0.756813 0.262009 0.999266 Rb\n0.245432 0.803301 0.499848 La\n0.754566 0.303306 0.500147 La\n0.254508 0.274418 0.752894 Mn\n0.745465 0.774417 0.247118 Mn\n0.757205 0.769072 0.744537 W\n0.242793 0.269069 0.255463 W\n0.536729 0.022048 0.691831 O\n0.463289 0.522029 0.308165 O\n0.504748 0.053173 0.308504 O\n0.495248 0.553172 0.691490 O\n0.986215 0.479928 0.256321 O\n0.013801 0.979904 0.743678 O\n0.959629 0.501257 0.746659 O\n0.040356 0.001268 0.253338 O\n0.819880 0.747988 0.503578 O\n0.180120 0.247977 0.496421 O\n0.719153 0.770224 0.967572 O\n0.280852 0.270218 0.032426 O\n","nsites":20,"nelements":5,"elements":["Rb","La","Mn","W","O"],"chemical_system":"La-Mn-O-Rb-W","density":6.653966466480637,"density_atomic":0.07166464533851122,"volume":279.07763870914437,"volume_molar":8.403224116374462,"formula_full":"Rb2 La2 Mn2 W2 O12","formula_reduced":"RbLaMnWO6","formula_anonymous":"ABCDE6","energy":-168.58709949,"energy_per_atom":-8.4293549745,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-148.13109949,"band_gap":1.6904000000000003,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:07.162000Z","spacegroup":4},{"id":"mp-29520","created_at":"2022-09-04T14:48:17.733330Z","structure_string":"Li2 Au2 I8\n1.0\n4.469893 0.000000 0.000000\n0.000000 7.211598 0.000000\n0.000000 6.744670 13.492392\nLi Au I\n2 2 8\ndirect\n0.500000 0.500000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Au\n0.500000 0.000000 0.500000 Au\n0.507327 0.202217 0.611972 I\n0.007327 0.797783 0.888028 I\n0.492673 0.797783 0.388028 I\n0.992673 0.202217 0.111972 I\n0.171560 0.692764 0.638145 I\n0.671560 0.307236 0.861855 I\n0.828440 0.307236 0.361855 I\n0.328440 0.692764 0.138145 I\n","nsites":12,"nelements":3,"elements":["Li","Au","I"],"chemical_system":"Au-I-Li","density":5.433153110501896,"density_atomic":0.02759075970595226,"volume":434.92821973333315,"volume_molar":21.82665799775285,"formula_full":"Li2 Au2 I8","formula_reduced":"LiAuI4","formula_anonymous":"ABC4","energy":-30.90982619,"energy_per_atom":-2.5758188491666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.87782619,"band_gap":0.7517999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:38:43.578000Z","spacegroup":14},{"id":"mp-1516247","created_at":"2022-09-04T14:47:56.605245Z","structure_string":"K1 Ca1 Zr1 Sb1 O6\n1.0\n0.000000 -4.086583 -4.086583\n4.086583 0.000000 -4.086583\n4.086583 -4.086583 0.000000\nK Ca Zr Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Sb\n0.756129 0.243871 0.243871 O\n0.243871 0.756129 0.756129 O\n0.756129 0.243871 0.756129 O\n0.243871 0.756129 0.243871 O\n0.756129 0.756129 0.243871 O\n0.243871 0.243871 0.756129 O\n","nsites":10,"nelements":5,"elements":["K","Ca","Zr","Sb","O"],"chemical_system":"Ca-K-O-Sb-Zr","density":4.722209131498714,"density_atomic":0.07326373111135298,"volume":136.49318494032303,"volume_molar":8.219811724913376,"formula_full":"K1 Ca1 Zr1 Sb1 O6","formula_reduced":"KCaZrSbO6","formula_anonymous":"ABCDE6","energy":-73.47502787,"energy_per_atom":-7.347502787000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-69.35302787,"band_gap":3.2186000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:18.254000Z","spacegroup":216},{"id":"mp-1221598","created_at":"2022-09-04T14:48:12.533839Z","structure_string":"Mn2 Te2 Pb4 O12\n1.0\n-4.097399 4.097402 -0.000002\n-4.097394 -4.097398 0.000003\n-0.000002 -0.000005 8.189524\nMn Te Pb O\n2 2 4 12\ndirect\n0.999990 0.500001 0.249993 Mn\n0.500009 0.000000 0.749993 Mn\n0.500000 0.000000 0.250001 Te\n0.999999 0.500000 0.750000 Te\n0.000004 0.000001 0.999998 Pb\n0.500000 0.500000 0.500003 Pb\n0.000001 0.999998 0.500003 Pb\n0.500000 0.500001 0.000001 Pb\n0.499999 0.000000 0.488517 O\n0.000000 0.500000 0.988519 O\n0.500000 0.000000 0.011484 O\n0.000000 0.500000 0.511482 O\n0.738442 0.761558 0.250001 O\n0.238438 0.261561 0.750001 O\n0.261557 0.238442 0.250000 O\n0.761561 0.738439 0.750001 O\n0.261557 0.761558 0.250001 O\n0.761561 0.261561 0.750001 O\n0.738442 0.238442 0.250000 O\n0.238438 0.738439 0.750001 O\n","nsites":20,"nelements":4,"elements":["Mn","Te","Pb","O"],"chemical_system":"Mn-O-Pb-Te","density":8.368858644854168,"density_atomic":0.07273190868332613,"volume":274.98247140852254,"volume_molar":8.279915746773991,"formula_full":"Mn2 Te2 Pb4 O12","formula_reduced":"MnTe(PbO3)2","formula_anonymous":"ABC2D6","energy":-131.73703398,"energy_per_atom":-6.586851699,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-120.15703398,"band_gap":1.0191,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:37.508000Z","spacegroup":225},{"id":"mp-1036765","created_at":"2022-09-04T14:39:20.662799Z","structure_string":"Mg30 Nb1 V1 O32\n1.0\n8.551735 0.000000 0.000000\n0.000000 8.551735 0.000000\n0.000000 0.000000 8.589575\nMg Nb V O\n30 1 1 32\ndirect\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.252359 0.248842 Mg\n0.000000 0.252359 0.751158 Mg\n0.000000 0.747641 0.248842 Mg\n0.000000 0.747641 0.751158 Mg\n0.500000 0.250105 0.249821 Mg\n0.500000 0.250105 0.750179 Mg\n0.500000 0.749895 0.249821 Mg\n0.500000 0.749895 0.750179 Mg\n0.252359 0.000000 0.248842 Mg\n0.252359 0.000000 0.751158 Mg\n0.250105 0.500000 0.249821 Mg\n0.250105 0.500000 0.750179 Mg\n0.747641 0.000000 0.248842 Mg\n0.747641 0.000000 0.751158 Mg\n0.749895 0.500000 0.249821 Mg\n0.749895 0.500000 0.750179 Mg\n0.250650 0.250650 0.000000 Mg\n0.251789 0.251789 0.500000 Mg\n0.250650 0.749350 0.000000 Mg\n0.251789 0.748211 0.500000 Mg\n0.749350 0.250650 0.000000 Mg\n0.748211 0.251789 0.500000 Mg\n0.749350 0.749350 0.000000 Mg\n0.748211 0.748211 0.500000 Mg\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 V\n0.255884 0.000000 0.000000 O\n0.262756 0.000000 0.500000 O\n0.250862 0.500000 0.000000 O\n0.251647 0.500000 0.500000 O\n0.744116 0.000000 0.000000 O\n0.737244 0.000000 0.500000 O\n0.749138 0.500000 0.000000 O\n0.748353 0.500000 0.500000 O\n0.249623 0.249623 0.249993 O\n0.249623 0.249623 0.750007 O\n0.249623 0.750377 0.249993 O\n0.249623 0.750377 0.750007 O\n0.750377 0.249623 0.249993 O\n0.750377 0.249623 0.750007 O\n0.750377 0.750377 0.249993 O\n0.750377 0.750377 0.750007 O\n0.000000 0.000000 0.243132 O\n0.000000 0.000000 0.756868 O\n0.000000 0.500000 0.248839 O\n0.000000 0.500000 0.751161 O\n0.500000 0.000000 0.248839 O\n0.500000 0.000000 0.751161 O\n0.500000 0.500000 0.249656 O\n0.500000 0.500000 0.750344 O\n0.000000 0.255884 0.000000 O\n0.000000 0.262756 0.500000 O\n0.000000 0.744116 0.000000 O\n0.000000 0.737244 0.500000 O\n0.500000 0.250862 0.000000 O\n0.500000 0.251647 0.500000 O\n0.500000 0.749138 0.000000 O\n0.500000 0.748353 0.500000 O\n","nsites":64,"nelements":4,"elements":["Mg","Nb","V","O"],"chemical_system":"Mg-Nb-O-V","density":3.6611037839228877,"density_atomic":0.1018825552757082,"volume":628.1742720999409,"volume_molar":5.910865450619352,"formula_full":"Mg30 Nb1 V1 O32","formula_reduced":"Mg30NbVO32","formula_anonymous":"ABC30D32","energy":-414.25809809,"energy_per_atom":-6.47278278265625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-390.57409809,"band_gap":0.1175000000000006,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:34:25.649000Z","spacegroup":123},{"id":"mp-689684","created_at":"2022-09-04T14:39:27.414259Z","structure_string":"P8 O20\n1.0\n8.185413 0.000000 0.000000\n0.278153 8.216536 0.000000\n0.003494 0.061496 8.470937\nP O\n8 20\ndirect\n0.015419 0.271814 0.023617 P\n0.273356 0.999401 0.026260 P\n0.962135 0.983952 0.203700 P\n0.893475 0.888992 0.868195 P\n0.783064 0.506825 0.519369 P\n0.489484 0.463677 0.704940 P\n0.382794 0.401496 0.367049 P\n0.511006 0.766421 0.527962 P\n0.285683 0.564146 0.337781 O\n0.287239 0.266470 0.303182 O\n0.430247 0.402713 0.854660 O\n0.065400 0.785529 0.864530 O\n0.858342 0.925896 0.055605 O\n0.899151 0.254081 0.885351 O\n0.682189 0.447853 0.677846 O\n0.903603 0.051934 0.777589 O\n0.772330 0.773359 0.809337 O\n0.955019 0.180352 0.183285 O\n0.383087 0.762917 0.397371 O\n0.233140 0.880007 0.883436 O\n0.680952 0.678424 0.475733 O\n0.419907 0.372726 0.553104 O\n0.561272 0.415303 0.283755 O\n0.903234 0.928742 0.356785 O\n0.148407 0.934824 0.164505 O\n0.184921 0.181119 0.981424 O\n0.446836 0.654742 0.674328 O\n0.724310 0.392286 0.375299 O\n","nsites":28,"nelements":2,"elements":["P","O"],"chemical_system":"O-P","density":1.6548815741320861,"density_atomic":0.04914702344416236,"volume":569.7191414208792,"volume_molar":12.25331736893886,"formula_full":"P8 O20","formula_reduced":"P2O5","formula_anonymous":"A2B5","energy":-190.03725366,"energy_per_atom":-6.787044773571429,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-180.73725366,"band_gap":1.1181,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:34:25.230000Z","spacegroup":1},{"id":"mp-20798","created_at":"2022-09-04T14:47:35.737819Z","structure_string":"Mn2 Ge2 O6\n1.0\n-5.094912 -0.000020 0.000177\n0.000224 2.941897 -4.851019\n2.547439 -4.412621 0.000049\nMn Ge O\n2 2 6\ndirect\n0.363076 0.089238 0.726133 Mn\n0.636929 0.910774 0.273876 Mn\n0.842988 0.528907 0.685937 Ge\n0.157008 0.471081 0.314055 Ge\n0.439233 0.277127 0.482180 O\n0.794889 0.277138 0.234143 O\n0.042930 0.277111 0.837840 O\n0.560765 0.722875 0.517820 O\n0.205112 0.722863 0.765857 O\n0.957070 0.722887 0.162160 O\n","nsites":10,"nelements":3,"elements":["Mn","Ge","O"],"chemical_system":"Ge-Mn-O","density":5.346699583547845,"density_atomic":0.09169400309445518,"volume":109.05838618147003,"volume_molar":6.567649526432514,"formula_full":"Mn2 Ge2 O6","formula_reduced":"MnGeO3","formula_anonymous":"ABC3","energy":-78.32737924,"energy_per_atom":-7.832737924,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-70.86937924,"band_gap":1.6731999999999996,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:38:13.061000Z","spacegroup":148},{"id":"mp-1517333","created_at":"2022-09-04T14:40:53.899337Z","structure_string":"Na1 Sr1 Y1 Se1 O6\n1.0\n0.000000 -4.027568 -4.027568\n4.027568 0.000000 -4.027568\n4.027568 -4.027568 0.000000\nNa Sr Y Se O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Se\n0.774018 0.225982 0.225982 O\n0.225982 0.774018 0.774018 O\n0.774018 0.225982 0.774018 O\n0.225982 0.774018 0.225982 O\n0.774018 0.774018 0.225982 O\n0.225982 0.225982 0.774018 O\n","nsites":10,"nelements":5,"elements":["Na","Sr","Y","Se","O"],"chemical_system":"Na-O-Se-Sr-Y","density":4.75893561884305,"density_atomic":0.07653169983022312,"volume":130.66480977403955,"volume_molar":7.8688187683789,"formula_full":"Na1 Sr1 Y1 Se1 O6","formula_reduced":"NaSrYSeO6","formula_anonymous":"ABCDE6","energy":-66.92188525,"energy_per_atom":-6.692188525000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-62.79988525,"band_gap":2.0769999999999995,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:34:58.112000Z","spacegroup":216}]}