{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formation_energy&page=10178","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formation_energy&page=10176","results":[{"id":"mp-1208220","created_at":"2022-09-04T14:40:55.437331Z","structure_string":"Ti10 Sn6 Au2\n1.0\n4.159965 -7.205270 0.000000\n4.159965 7.205270 0.000000\n0.000000 0.000000 5.656342\nTi Sn Au\n10 6 2\ndirect\n0.281769 0.000000 0.750000 Ti\n0.718231 0.000000 0.250000 Ti\n0.000000 0.281769 0.750000 Ti\n0.000000 0.718231 0.250000 Ti\n0.718231 0.718231 0.750000 Ti\n0.281769 0.281769 0.250000 Ti\n0.333333 0.666667 0.500000 Ti\n0.666667 0.333333 0.500000 Ti\n0.666667 0.333333 0.000000 Ti\n0.333333 0.666667 0.000000 Ti\n0.618004 0.000000 0.750000 Sn\n0.381996 0.000000 0.250000 Sn\n0.000000 0.618004 0.750000 Sn\n0.000000 0.381996 0.250000 Sn\n0.381996 0.381996 0.750000 Sn\n0.618004 0.618004 0.250000 Sn\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n","nsites":18,"nelements":3,"elements":["Ti","Sn","Au"],"chemical_system":"Au-Sn-Ti","density":7.761314275833481,"density_atomic":0.05308439997427343,"volume":339.08266851887623,"volume_molar":11.344464217206074,"formula_full":"Ti10 Sn6 Au2","formula_reduced":"Ti5Sn3Au","formula_anonymous":"AB3C5","energy":-116.20151632,"energy_per_atom":-6.455639795555555,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-116.20151632,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.363506,"is_theoretical":true,"updated_at":"2021-11-28T01:35:00.106000Z","spacegroup":193},{"id":"mp-1185218","created_at":"2022-09-04T14:40:55.438148Z","structure_string":"Li1 Ce2 Pb1\n1.0\n0.000000 3.843547 3.843547\n3.843547 0.000000 3.843547\n3.843547 3.843547 0.000000\nLi Ce Pb\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.750000 0.750000 0.750000 Ce\n0.250000 0.250000 0.250000 Ce\n0.000000 0.000000 0.000000 Pb\n","nsites":4,"nelements":3,"elements":["Li","Ce","Pb"],"chemical_system":"Ce-Li-Pb","density":7.228983897288506,"density_atomic":0.035223572967204256,"volume":113.56031381950646,"volume_molar":17.09690486427103,"formula_full":"Li1 Ce2 Pb1","formula_reduced":"LiCe2Pb","formula_anonymous":"ABC2","energy":-17.91886746,"energy_per_atom":-4.479716865,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.91886746,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.5846414,"is_theoretical":true,"updated_at":"2021-11-28T01:34:59.140000Z","spacegroup":225},{"id":"mp-754229","created_at":"2022-09-04T14:40:55.456735Z","structure_string":"Mn2 Ag2 O6\n1.0\n5.147896 -0.000257 0.001026\n-2.572992 1.486433 5.126007\n2.574171 -4.457803 0.000055\nMn Ag O\n2 2 6\ndirect\n0.338232 0.014324 0.338145 Mn\n0.661780 0.985704 0.661867 Mn\n0.137966 0.414636 0.138306 Ag\n0.861983 0.585215 0.861656 Ag\n0.060049 0.208942 0.453900 O\n0.546088 0.790915 0.305077 O\n0.305100 0.791009 0.940030 O\n0.694964 0.209034 0.059993 O\n0.453867 0.209122 0.694977 O\n0.939970 0.791099 0.546050 O\n","nsites":10,"nelements":3,"elements":["Mn","Ag","O"],"chemical_system":"Ag-Mn-O","density":5.95128898097606,"density_atomic":0.08500650913518489,"volume":117.63805032973549,"volume_molar":7.084328978176315,"formula_full":"Mn2 Ag2 O6","formula_reduced":"MnAgO3","formula_anonymous":"ABC3","energy":-65.58201580000001,"energy_per_atom":-6.55820158,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-58.1240158,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0013101,"is_theoretical":true,"updated_at":"2021-11-28T01:34:58.670000Z","spacegroup":148},{"id":"mp-1210694","created_at":"2022-09-04T14:40:55.411417Z","structure_string":"Mg4 Al8 Si4 H4 O28\n1.0\n2.770536 4.788187 0.000000\n-2.770536 4.788187 0.000000\n0.000000 3.555084 17.637647\nMg Al Si H O\n4 8 4 4 28\ndirect\n0.672387 0.167122 0.000469 Mg\n0.327613 0.832878 0.999531 Mg\n0.832878 0.327613 0.499531 Mg\n0.167122 0.672387 0.500469 Mg\n0.902341 0.097659 0.750000 Al\n0.097659 0.902341 0.250000 Al\n0.403250 0.097016 0.750460 Al\n0.596750 0.902984 0.249540 Al\n0.902984 0.596750 0.749540 Al\n0.097016 0.403250 0.250460 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.438410 0.633000 0.656289 Si\n0.561590 0.367000 0.343711 Si\n0.367000 0.561590 0.843711 Si\n0.633000 0.438410 0.156289 Si\n0.765386 0.964799 0.610690 H\n0.234614 0.035201 0.389310 H\n0.035201 0.234614 0.889310 H\n0.964799 0.765386 0.110690 H\n0.541563 0.736269 0.813116 O\n0.458437 0.263731 0.186884 O\n0.263731 0.458437 0.686884 O\n0.736269 0.541563 0.313116 O\n0.705740 0.824604 0.954271 O\n0.294260 0.175396 0.045729 O\n0.175396 0.294260 0.545729 O\n0.824604 0.705740 0.454271 O\n0.470841 0.671803 0.562297 O\n0.529159 0.328197 0.437703 O\n0.328197 0.529159 0.937703 O\n0.671803 0.470841 0.062297 O\n0.542358 0.247631 0.812588 O\n0.457642 0.752369 0.187412 O\n0.752369 0.457642 0.687412 O\n0.247631 0.542358 0.312588 O\n0.264066 0.946584 0.687920 O\n0.735934 0.053416 0.312080 O\n0.053416 0.735934 0.812080 O\n0.946584 0.264066 0.187920 O\n0.753899 0.948571 0.700630 O\n0.246101 0.051429 0.299370 O\n0.051429 0.246101 0.799370 O\n0.948571 0.753899 0.200630 O\n0.780697 0.986521 0.553321 O\n0.219303 0.013479 0.446679 O\n0.013479 0.219303 0.946679 O\n0.986521 0.780697 0.053321 O\n","nsites":48,"nelements":5,"elements":["Mg","Al","Si","H","O"],"chemical_system":"Al-H-Mg-O-Si","density":3.113548762656194,"density_atomic":0.10257362275026462,"volume":467.95656342240454,"volume_molar":5.87104228019914,"formula_full":"Mg4 Al8 Si4 H4 O28","formula_reduced":"MgAl2SiHO7","formula_anonymous":"ABCD2E7","energy":-346.94446207,"energy_per_atom":-7.228009626458333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-327.70846207,"band_gap":0.3550999999999997,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0005595,"is_theoretical":true,"updated_at":"2021-11-28T01:35:02.608000Z","spacegroup":15},{"id":"mp-1223841","created_at":"2022-09-04T14:40:55.426074Z","structure_string":"In2 Te1 As1\n1.0\n7.832435 -2.329022 0.000000\n7.832435 2.329022 0.000000\n7.139886 0.000000 3.974092\nIn Te As\n2 1 1\ndirect\n0.989686 0.989686 0.989686 In\n0.510327 0.510327 0.510327 In\n0.377175 0.377175 0.377175 Te\n0.872813 0.872813 0.872813 As\n","nsites":4,"nelements":3,"elements":["In","Te","As"],"chemical_system":"As-In-Te","density":4.949404509199061,"density_atomic":0.027588093457456987,"volume":144.99008444234522,"volume_molar":21.828767432902225,"formula_full":"In2 Te1 As1","formula_reduced":"In2TeAs","formula_anonymous":"ABC2","energy":-14.27987378,"energy_per_atom":-3.569968445,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.85787378,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0043156,"is_theoretical":true,"updated_at":"2021-11-28T01:34:58.644000Z","spacegroup":160},{"id":"mp-698587","created_at":"2022-09-04T14:40:55.441685Z","structure_string":"Ti10 Ni10 O30\n1.0\n-5.062602 0.000000 0.000000\n2.522938 4.875159 0.000000\n-0.046294 -1.748153 -20.937182\nTi Ni O\n10 10 30\ndirect\n0.606044 0.206710 0.228786 Ti\n0.000606 0.001455 0.427374 Ti\n0.207003 0.403628 0.167891 Ti\n0.401047 0.802707 0.627117 Ti\n0.600024 0.198654 0.370235 Ti\n0.802866 0.608448 0.828890 Ti\n0.000341 0.999879 0.569884 Ti\n0.404328 0.802607 0.769840 Ti\n0.513375 0.042950 0.935497 Ti\n0.794545 0.613427 0.976204 Ti\n0.214834 0.426560 0.031947 Ni\n0.490153 0.994943 0.074447 Ni\n0.892167 0.780588 0.269664 Ni\n0.920546 0.833557 0.133115 Ni\n0.289984 0.579822 0.469026 Ni\n0.307835 0.617430 0.328508 Ni\n0.691484 0.381603 0.669684 Ni\n0.709071 0.418975 0.529071 Ni\n0.097072 0.191803 0.869663 Ni\n0.109006 0.221164 0.729200 Ni\n0.235314 0.175808 0.092858 O\n0.748461 0.110322 0.154476 O\n0.774711 0.259593 0.005974 O\n0.613150 0.555662 0.190749 O\n0.675570 0.721519 0.047248 O\n0.628088 0.975344 0.289084 O\n0.175860 0.642597 0.113639 O\n0.145097 0.903990 0.354355 O\n0.196198 0.053091 0.213370 O\n0.009715 0.348983 0.390422 O\n0.052709 0.491511 0.246097 O\n0.027591 0.775161 0.488867 O\n0.574372 0.431083 0.314023 O\n0.544826 0.704340 0.554029 O\n0.591874 0.848583 0.411230 O\n0.409971 0.149645 0.590389 O\n0.452162 0.292064 0.446377 O\n0.427608 0.576884 0.688906 O\n0.973156 0.230883 0.513751 O\n0.948529 0.512273 0.755371 O\n0.991922 0.648871 0.611241 O\n0.813025 0.953677 0.789918 O\n0.852431 0.092809 0.646250 O\n0.833316 0.378711 0.886365 O\n0.374281 0.032588 0.713814 O\n0.369819 0.315587 0.948587 O\n0.397081 0.453567 0.810522 O\n0.225764 0.783632 0.983742 O\n0.269704 0.903574 0.849269 O\n0.764188 0.848378 0.914293 O\n","nsites":50,"nelements":3,"elements":["Ti","Ni","O"],"chemical_system":"Ni-O-Ti","density":4.966626181744278,"density_atomic":0.09675851741378852,"volume":516.7503733668699,"volume_molar":6.223886972395691,"formula_full":"Ti10 Ni10 O30","formula_reduced":"TiNiO3","formula_anonymous":"ABC3","energy":-414.03035975,"energy_per_atom":-8.280607195,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-368.01035975,"band_gap":1.7081999999999995,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":19.9998453,"is_theoretical":true,"updated_at":"2021-11-28T01:34:59.888000Z","spacegroup":1},{"id":"mp-27838","created_at":"2022-09-04T14:40:55.534561Z","structure_string":"Na6 Bi2\n1.0\n2.742293 -4.749790 0.000000\n2.742293 4.749790 0.000000\n0.000000 0.000000 9.761834\nNa Bi\n6 2\ndirect\n0.333333 0.666667 0.917251 Na\n0.666667 0.333333 0.417251 Na\n0.000000 0.000000 0.250000 Na\n0.000000 0.000000 0.750000 Na\n0.333333 0.666667 0.582749 Na\n0.666667 0.333333 0.082749 Na\n0.666667 0.333333 0.750000 Bi\n0.333333 0.666667 0.250000 Bi\n","nsites":8,"nelements":2,"elements":["Na","Bi"],"chemical_system":"Bi-Na","density":3.6299081609780646,"density_atomic":0.03145866648857267,"volume":254.30194261113996,"volume_molar":19.143026174321584,"formula_full":"Na6 Bi2","formula_reduced":"Na3Bi","formula_anonymous":"AB3","energy":-18.66982896,"energy_per_atom":-2.33372862,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.66982896,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0050298,"is_theoretical":false,"updated_at":"2021-11-28T01:34:56.877000Z","spacegroup":194},{"id":"mp-1175518","created_at":"2022-09-04T14:40:55.536877Z","structure_string":"Li9 Mn2 Co5 O16\n1.0\n5.891278 0.000000 0.000000\n-2.640425 -5.884731 0.000000\n-2.877475 0.143451 -8.124765\nLi Mn Co O\n9 2 5 16\ndirect\n0.757409 0.744921 0.257177 Li\n0.251977 0.998108 0.499050 Li\n0.246153 0.747477 0.254916 Li\n0.748023 0.001892 0.500950 Li\n0.753847 0.252523 0.745084 Li\n0.242591 0.255079 0.742823 Li\n0.244215 0.500818 0.000190 Li\n0.755785 0.499182 0.999810 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.515862 0.258448 0.254646 Co\n0.484138 0.741552 0.745354 Co\n0.500000 0.000000 0.000000 Co\n0.001378 0.254233 0.251283 Co\n0.998622 0.745767 0.748717 Co\n0.112600 0.012461 0.237329 O\n0.610601 0.257121 0.489158 O\n0.607983 0.010931 0.234167 O\n0.148670 0.269396 0.485663 O\n0.126220 0.520663 0.754494 O\n0.600901 0.503814 0.737909 O\n0.646661 0.779278 0.990671 O\n0.114779 0.762093 0.990286 O\n0.399099 0.496186 0.262091 O\n0.851330 0.730604 0.514337 O\n0.873780 0.479337 0.245506 O\n0.389399 0.742879 0.510842 O\n0.392017 0.989069 0.765833 O\n0.887400 0.987539 0.762671 O\n0.885221 0.237907 0.009714 O\n0.353339 0.220722 0.009329 O\n","nsites":32,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.262273698719275,"density_atomic":0.11360646271533016,"volume":281.67411637649633,"volume_molar":5.300878678962132,"formula_full":"Li9 Mn2 Co5 O16","formula_reduced":"Li9Mn2Co5O16","formula_anonymous":"A2B5C9D16","energy":-209.10006671,"energy_per_atom":-6.5343770846875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-186.58206671,"band_gap":0.6404000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":11.9999699,"is_theoretical":true,"updated_at":"2021-11-28T01:34:58.303000Z","spacegroup":2},{"id":"mp-1041123","created_at":"2022-09-04T14:40:55.549973Z","structure_string":"Zn6 W12 O24\n1.0\n3.189863 5.607753 0.000000\n-3.189863 5.607753 0.000000\n0.000000 0.373396 15.511793\nZn W O\n6 12 24\ndirect\n0.162731 0.162731 0.954292 Zn\n0.497042 0.497042 0.624307 Zn\n0.499584 0.499584 0.995533 Zn\n0.838028 0.838028 0.291772 Zn\n0.162459 0.162459 0.710159 Zn\n0.501929 0.501929 0.375738 Zn\n0.164143 0.658551 0.835027 W\n0.657646 0.657646 0.833466 W\n0.500455 0.998716 0.500466 W\n0.658551 0.164143 0.835027 W\n0.829910 0.829910 0.667455 W\n0.999743 0.999743 0.500102 W\n0.838174 0.338134 0.166056 W\n0.998716 0.500455 0.500466 W\n0.338134 0.838174 0.166056 W\n0.170900 0.170900 0.333117 W\n0.338990 0.338990 0.165001 W\n0.832537 0.832537 0.043341 W\n0.340857 0.340857 0.919033 O\n0.495397 0.495397 0.757943 O\n0.330936 0.811334 0.913170 O\n0.811334 0.330936 0.913170 O\n0.515032 0.988254 0.753820 O\n0.674662 0.674662 0.582287 O\n0.988254 0.515032 0.753820 O\n0.818142 0.818142 0.907749 O\n0.672397 0.145118 0.580222 O\n0.836247 0.836247 0.424227 O\n0.983851 0.983851 0.751720 O\n0.145118 0.672397 0.580222 O\n0.855327 0.326583 0.419469 O\n0.016678 0.016678 0.249185 O\n0.326583 0.855327 0.419469 O\n0.162869 0.162869 0.576001 O\n0.173819 0.173819 0.090280 O\n0.012078 0.485795 0.245890 O\n0.324876 0.324876 0.418192 O\n0.485795 0.012078 0.245890 O\n0.183000 0.676402 0.091323 O\n0.501220 0.501220 0.241883 O\n0.676402 0.183000 0.091323 O\n0.648223 0.648223 0.077366 O\n","nsites":42,"nelements":3,"elements":["Zn","W","O"],"chemical_system":"O-W-Zn","density":8.924409710302783,"density_atomic":0.07568265981370023,"volume":554.9487835573807,"volume_molar":7.957094498031714,"formula_full":"Zn6 W12 O24","formula_reduced":"Zn(WO2)2","formula_anonymous":"AB2C4","energy":-345.12213807,"energy_per_atom":-8.217193763571428,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-275.37813807,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":36.0004725,"is_theoretical":true,"updated_at":"2021-11-28T01:35:01.006000Z","spacegroup":8},{"id":"mp-1202088","created_at":"2022-09-04T14:40:55.653315Z","structure_string":"Mg4 B8 H32\n1.0\n-4.189958 4.189958 5.332222\n4.189958 -4.189958 5.332222\n4.189958 4.189958 -5.332222\nMg B H\n4 8 32\ndirect\n0.750000 0.250000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.250000 0.750000 0.500000 Mg\n0.644124 0.409561 0.765437 B\n0.159561 0.894124 0.265437 B\n0.628687 0.894124 0.734563 B\n0.644124 0.878687 0.234563 B\n0.105876 0.840439 0.734563 B\n0.590439 0.355876 0.234563 B\n0.121313 0.355876 0.765437 B\n0.105876 0.371313 0.265437 B\n0.737752 0.450537 0.958167 H\n0.492371 0.450537 0.712785 H\n0.200537 0.987752 0.458167 H\n0.529586 0.987753 0.787215 H\n0.737752 0.779586 0.287215 H\n0.492371 0.779586 0.041833 H\n0.200537 0.742371 0.212785 H\n0.529586 0.742371 0.541833 H\n0.012247 0.799463 0.541833 H\n0.257629 0.799463 0.787215 H\n0.549463 0.262247 0.041833 H\n0.220414 0.262247 0.712785 H\n0.012247 0.470414 0.212785 H\n0.257629 0.470414 0.458167 H\n0.549463 0.507629 0.287215 H\n0.220414 0.507629 0.958167 H\n0.588199 0.950915 0.362716 H\n0.700915 0.838199 0.862716 H\n0.975484 0.838199 0.137284 H\n0.588199 0.225484 0.637284 H\n0.161801 0.299085 0.137284 H\n0.049085 0.411801 0.637284 H\n0.774516 0.411801 0.362716 H\n0.161801 0.024516 0.862716 H\n0.758486 0.511456 0.752970 H\n0.261456 0.008486 0.252970 H\n0.755516 0.008486 0.747030 H\n0.758486 0.005516 0.247030 H\n0.991514 0.738544 0.747030 H\n0.488544 0.241514 0.247030 H\n0.994484 0.241514 0.752970 H\n0.991514 0.244484 0.252970 H\n","nsites":44,"nelements":3,"elements":["Mg","B","H"],"chemical_system":"B-H-Mg","density":0.9577210789465078,"density_atomic":0.11750737468449804,"volume":374.44458373900363,"volume_molar":5.124904522945198,"formula_full":"Mg4 B8 H32","formula_reduced":"Mg(BH4)2","formula_anonymous":"AB2C8","energy":-182.78470384,"energy_per_atom":-4.154197814545454,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-177.05670384,"band_gap":5.8926,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0006896,"is_theoretical":true,"updated_at":"2021-11-28T01:35:24.100000Z","spacegroup":141},{"id":"mp-1026578","created_at":"2022-09-04T14:40:55.656355Z","structure_string":"Ba1 Mg14 Ga1\n1.0\n6.647034 0.082076 0.000000\n-3.252437 5.633385 0.000000\n0.000000 0.000000 10.468030\nBa Mg Ga\n1 14 1\ndirect\n0.148145 0.324072 0.125000 Ba\n0.168081 0.334040 0.625000 Mg\n0.159163 0.829581 0.625000 Mg\n0.643240 0.312704 0.125000 Mg\n0.667599 0.340649 0.625000 Mg\n0.643240 0.830536 0.125000 Mg\n0.667599 0.826949 0.625000 Mg\n0.338610 0.160543 0.388025 Mg\n0.338610 0.160543 0.861975 Mg\n0.338610 0.678068 0.388025 Mg\n0.338610 0.678068 0.861975 Mg\n0.820723 0.160362 0.393119 Mg\n0.820723 0.160362 0.856881 Mg\n0.844584 0.672293 0.358609 Mg\n0.844584 0.672293 0.891391 Mg\n0.217878 0.858938 0.125000 Ga\n","nsites":16,"nelements":3,"elements":["Ba","Mg","Ga"],"chemical_system":"Ba-Ga-Mg","density":2.302199888330237,"density_atomic":0.040529625929904646,"volume":394.7729502283527,"volume_molar":14.858614215722588,"formula_full":"Ba1 Mg14 Ga1","formula_reduced":"BaMg14Ga","formula_anonymous":"ABC14","energy":-26.80230898,"energy_per_atom":-1.67514431125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.80230898,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.3e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:01.094000Z","spacegroup":38},{"id":"mp-1075040","created_at":"2022-09-04T14:40:55.659648Z","structure_string":"Mg6 Si8\n1.0\n4.598123 0.000000 0.000000\n0.096932 7.416494 0.000000\n0.228396 3.062291 7.324351\nMg Si\n6 8\ndirect\n0.178664 0.798484 0.478170 Mg\n0.669847 0.959661 0.191985 Mg\n0.689159 0.417848 0.098608 Mg\n0.178479 0.664862 0.148693 Mg\n0.681885 0.093684 0.518585 Mg\n0.676020 0.258570 0.797733 Mg\n0.192298 0.198468 0.317688 Si\n0.182431 0.363566 0.557792 Si\n0.677184 0.652337 0.704585 Si\n0.177582 0.510256 0.815987 Si\n0.166665 0.170103 0.014386 Si\n0.672725 0.851861 0.882091 Si\n0.688641 0.556378 0.425990 Si\n0.174958 0.004062 0.800988 Si\n","nsites":14,"nelements":2,"elements":["Mg","Si"],"chemical_system":"Mg-Si","density":2.463232110293943,"density_atomic":0.05605052088994089,"volume":249.7746636019668,"volume_molar":10.744129874947806,"formula_full":"Mg6 Si8","formula_reduced":"Mg3Si4","formula_anonymous":"A3B4","energy":-50.64299926,"energy_per_atom":-3.61735709,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.21099926,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0200468,"is_theoretical":true,"updated_at":"2021-11-28T01:35:00.536000Z","spacegroup":1}]}