{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_uncorrected&page=10180","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_uncorrected&page=10178","results":[{"id":"mp-1026735","created_at":"2022-09-04T14:43:12.887468Z","structure_string":"Ce1 Mg14 Sb1\n1.0\n6.421629 0.000000 0.000000\n-3.210815 5.561293 -0.000000\n0.000000 0.000000 10.552706\nCe Mg Sb\n1 14 1\ndirect\n0.166667 0.333333 0.125000 Ce\n0.179204 0.839602 0.125000 Mg\n0.159992 0.829995 0.625000 Mg\n0.660398 0.320796 0.125000 Mg\n0.670005 0.340008 0.625000 Mg\n0.660398 0.839602 0.125000 Mg\n0.670005 0.829995 0.625000 Mg\n0.332955 0.167045 0.378890 Mg\n0.332955 0.167045 0.871110 Mg\n0.332955 0.665911 0.378890 Mg\n0.332955 0.665911 0.871110 Mg\n0.834089 0.167045 0.378890 Mg\n0.834089 0.167045 0.871110 Mg\n0.833333 0.666667 0.361469 Mg\n0.833333 0.666667 0.888531 Mg\n0.166667 0.333333 0.625000 Sb\n","nsites":16,"nelements":3,"elements":["Ce","Mg","Sb"],"chemical_system":"Ce-Mg-Sb","density":2.6531760994961955,"density_atomic":0.042455616910863324,"volume":376.8641504748928,"volume_molar":14.184556009735157,"formula_full":"Ce1 Mg14 Sb1","formula_reduced":"CeMg14Sb","formula_anonymous":"ABC14","energy":-32.52810605,"energy_per_atom":-2.033006628125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33610605,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.6027906,"is_theoretical":true,"updated_at":"2021-11-28T01:36:06.379000Z","spacegroup":187},{"id":"mp-8121","created_at":"2022-09-04T14:45:23.021441Z","structure_string":"Sm2 Cu2 Si2\n1.0\n2.095511 -3.629531 0.000000\n2.095511 3.629531 0.000000\n0.000000 0.000000 7.747202\nSm Cu Si\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n0.666667 0.333333 0.250000 Si\n0.333333 0.666667 0.750000 Si\n","nsites":6,"nelements":3,"elements":["Sm","Cu","Si"],"chemical_system":"Cu-Si-Sm","density":6.819678075126769,"density_atomic":0.05091384778451952,"volume":117.84613147671614,"volume_molar":11.828099862904187,"formula_full":"Sm2 Cu2 Si2","formula_reduced":"SmCuSi","formula_anonymous":"ABC","energy":-32.193886549999995,"energy_per_atom":-5.365647758333332,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33588655,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.46e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:37:05.443000Z","spacegroup":194},{"id":"mp-866608","created_at":"2022-09-04T14:44:05.169862Z","structure_string":"Gd2 Tl1 Cd1\n1.0\n0.000000 4.092260 4.092260\n4.092260 0.000000 4.092260\n4.092260 4.092260 0.000000\nGd Tl Cd\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Gd\n0.250000 0.250000 0.250000 Gd\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Cd\n","nsites":4,"nelements":3,"elements":["Gd","Tl","Cd"],"chemical_system":"Cd-Gd-Tl","density":7.6482365911389065,"density_atomic":0.029183699161255208,"volume":137.0628163995903,"volume_molar":20.63528933300923,"formula_full":"Gd2 Tl1 Cd1","formula_reduced":"Gd2TlCd","formula_anonymous":"ABC2","energy":-32.33500655,"energy_per_atom":-8.0837516375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33500655,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.8404279,"is_theoretical":true,"updated_at":"2021-11-28T01:36:30.391000Z","spacegroup":225},{"id":"mp-1026548","created_at":"2022-09-04T14:41:29.194168Z","structure_string":"Ba1 Hf1 Mg14\n1.0\n6.590472 -0.005826 0.000000\n-3.300282 5.716255 0.000000\n0.000000 0.000000 10.484140\nBa Hf Mg\n1 1 14\ndirect\n0.163057 0.331528 0.125000 Ba\n0.187378 0.843689 0.125000 Hf\n0.167860 0.333930 0.625000 Mg\n0.164137 0.832068 0.625000 Mg\n0.663881 0.330826 0.125000 Mg\n0.666737 0.336718 0.625000 Mg\n0.663881 0.833055 0.125000 Mg\n0.666737 0.830018 0.625000 Mg\n0.335733 0.155780 0.385609 Mg\n0.335733 0.155780 0.864391 Mg\n0.335733 0.679954 0.385609 Mg\n0.335733 0.679954 0.864391 Mg\n0.818884 0.159442 0.389706 Mg\n0.818884 0.159442 0.860294 Mg\n0.837816 0.668908 0.369905 Mg\n0.837816 0.668908 0.880096 Mg\n","nsites":16,"nelements":3,"elements":["Ba","Hf","Mg"],"chemical_system":"Ba-Hf-Mg","density":2.7597600052333244,"density_atomic":0.04053038873460823,"volume":394.7655203794743,"volume_molar":14.858334568249019,"formula_full":"Ba1 Hf1 Mg14","formula_reduced":"BaHfMg14","formula_anonymous":"ABC14","energy":-32.33496786,"energy_per_atom":-2.02093549125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33496786,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":5.7e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.933000Z","spacegroup":38},{"id":"mp-13082","created_at":"2022-09-04T14:45:57.245476Z","structure_string":"Mn2 Co1 Si1\n1.0\n0.000000 2.813287 2.813287\n2.813287 0.000000 2.813287\n2.813287 2.813287 0.000000\nMn Co Si\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Co\n0.250000 0.250000 0.250000 Si\n","nsites":4,"nelements":3,"elements":["Mn","Co","Si"],"chemical_system":"Co-Mn-Si","density":7.341946189742852,"density_atomic":0.0898230665119071,"volume":44.53199111688926,"volume_molar":6.704447970724418,"formula_full":"Mn2 Co1 Si1","formula_reduced":"Mn2CoSi","formula_anonymous":"ABC2","energy":-32.26379883,"energy_per_atom":-8.0659497075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33479883,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.9957666,"is_theoretical":true,"updated_at":"2021-11-28T01:37:08.002000Z","spacegroup":216},{"id":"mp-1028362","created_at":"2022-09-04T14:45:08.862122Z","structure_string":"Mg14 Ni1 Sn1\n1.0\n6.235837 0.000000 -0.000000\n-3.117918 5.400393 0.000000\n-0.000000 0.000000 10.295446\nMg Ni Sn\n14 1 1\ndirect\n0.161218 0.830609 0.125000 Mg\n0.167020 0.833510 0.625000 Mg\n0.669391 0.338782 0.125000 Mg\n0.666490 0.332980 0.625000 Mg\n0.669391 0.830609 0.125000 Mg\n0.666490 0.833510 0.625000 Mg\n0.328344 0.171656 0.358529 Mg\n0.328344 0.171656 0.891471 Mg\n0.328344 0.656690 0.358529 Mg\n0.328344 0.656690 0.891471 Mg\n0.843310 0.171656 0.358529 Mg\n0.843310 0.171656 0.891471 Mg\n0.833333 0.666667 0.373870 Mg\n0.833333 0.666667 0.876130 Mg\n0.166667 0.333333 0.125000 Ni\n0.166667 0.333333 0.625000 Sn\n","nsites":16,"nelements":3,"elements":["Mg","Ni","Sn"],"chemical_system":"Mg-Ni-Sn","density":2.4793604094533617,"density_atomic":0.046148192696504726,"volume":346.70913561500845,"volume_molar":13.049570109071938,"formula_full":"Mg14 Ni1 Sn1","formula_reduced":"Mg14NiSn","formula_anonymous":"ABC14","energy":-32.33464792,"energy_per_atom":-2.020915495,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33464792,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.02e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:56.573000Z","spacegroup":187},{"id":"mp-1206546","created_at":"2022-09-04T14:45:55.052706Z","structure_string":"Cs2 Ag1 F6\n1.0\n0.000000 4.629052 4.629052\n4.629052 0.000000 4.629052\n4.629052 4.629052 0.000000\nCs Ag F\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Cs\n0.750000 0.750000 0.750000 Cs\n0.000000 0.000000 0.000000 Ag\n0.781336 0.218664 0.218664 F\n0.218664 0.781336 0.781336 F\n0.218664 0.781336 0.218664 F\n0.781336 0.218664 0.781336 F\n0.218664 0.218664 0.781336 F\n0.781336 0.781336 0.218664 F\n","nsites":9,"nelements":3,"elements":["Cs","Ag","F"],"chemical_system":"Ag-Cs-F","density":4.081958064019345,"density_atomic":0.04536661078529809,"volume":198.38378587709312,"volume_molar":13.274389811706165,"formula_full":"Cs2 Ag1 F6","formula_reduced":"Cs2AgF6","formula_anonymous":"AB2C6","energy":-35.10547035,"energy_per_atom":-3.9006078166666662,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33347035,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.999624,"is_theoretical":true,"updated_at":"2021-11-28T01:37:06.621000Z","spacegroup":225},{"id":"mp-1221281","created_at":"2022-09-04T14:48:25.875378Z","structure_string":"Na2 U1 I6\n1.0\n7.666890 -3.959353 0.000000\n7.666890 3.959353 0.000000\n5.622192 0.000000 6.545888\nNa U I\n2 1 6\ndirect\n0.498455 0.498455 0.498455 Na\n0.681383 0.681383 0.681383 Na\n0.998761 0.998761 0.998761 U\n0.093047 0.769818 0.382167 I\n0.382167 0.093047 0.769818 I\n0.769818 0.382167 0.093047 I\n0.905399 0.239295 0.616675 I\n0.616675 0.905399 0.239295 I\n0.239295 0.616675 0.905399 I\n","nsites":9,"nelements":3,"elements":["Na","U","I"],"chemical_system":"I-Na-U","density":4.368217184898399,"density_atomic":0.02264646851137023,"volume":397.4129562620911,"volume_molar":26.59196402731151,"formula_full":"Na2 U1 I6","formula_reduced":"Na2UI6","formula_anonymous":"AB2C6","energy":-34.606776090000004,"energy_per_atom":-3.845197343333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33277609,"band_gap":0.2271,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":1.9996718,"is_theoretical":true,"updated_at":"2021-11-28T01:39:39.574000Z","spacegroup":146},{"id":"mp-1226673","created_at":"2022-09-04T14:43:44.320208Z","structure_string":"Ce1 Zn1 Ni4\n1.0\n2.502682 -4.334772 0.000000\n2.502682 4.334772 0.000000\n0.000000 0.000000 3.916891\nCe Zn Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.000000 Zn\n0.666667 0.333333 0.000000 Ni\n0.995452 0.497726 0.500000 Ni\n0.502274 0.497726 0.500000 Ni\n0.502274 0.004548 0.500000 Ni\n","nsites":6,"nelements":3,"elements":["Ce","Zn","Ni"],"chemical_system":"Ce-Ni-Zn","density":8.603060772395558,"density_atomic":0.07060051013939776,"volume":84.98522161034319,"volume_molar":8.52988278428801,"formula_full":"Ce1 Zn1 Ni4","formula_reduced":"CeZnNi4","formula_anonymous":"ABC4","energy":-32.33218344,"energy_per_atom":-5.38869724,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.33218344,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0695015,"is_theoretical":true,"updated_at":"2021-11-28T01:36:17.674000Z","spacegroup":187},{"id":"mp-1080332","created_at":"2022-09-04T14:40:02.263627Z","structure_string":"Ce2 Se4\n1.0\n-4.489085 4.489085 4.902428\n4.489085 -4.489085 4.902428\n4.489085 4.489085 -4.902428\nCe Se\n2 4\ndirect\n0.750000 0.250000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.770306 0.125000 0.145306 Se\n0.979694 0.625000 0.854694 Se\n0.375000 0.229694 0.354694 Se\n0.875000 0.020306 0.645306 Se\n","nsites":6,"nelements":2,"elements":["Ce","Se"],"chemical_system":"Ce-Se","density":2.5047301655694243,"density_atomic":0.015183237221097282,"volume":395.1726441883508,"volume_molar":39.663088130060736,"formula_full":"Ce2 Se4","formula_reduced":"CeSe2","formula_anonymous":"AB2","energy":-34.21752488,"energy_per_atom":-5.702920813333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.32952488,"band_gap":0.9663,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003337,"is_theoretical":true,"updated_at":"2021-11-28T01:34:45.322000Z","spacegroup":122},{"id":"mp-1184564","created_at":"2022-09-04T14:39:27.862984Z","structure_string":"Hf3 Ag1\n1.0\n4.371479 0.000000 0.000000\n0.000000 4.371479 0.000000\n0.000000 0.000000 4.371479\nHf Ag\n3 1\ndirect\n0.000000 0.500000 0.500000 Hf\n0.500000 0.000000 0.500000 Hf\n0.500000 0.500000 0.000000 Hf\n0.000000 0.000000 0.000000 Ag\n","nsites":4,"nelements":2,"elements":["Hf","Ag"],"chemical_system":"Ag-Hf","density":12.788018261107105,"density_atomic":0.04788227780439642,"volume":83.53821462588672,"volume_molar":12.576972182904514,"formula_full":"Hf3 Ag1","formula_reduced":"Hf3Ag","formula_anonymous":"AB3","energy":-32.32922495,"energy_per_atom":-8.0823062375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.32922495,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0413348,"is_theoretical":true,"updated_at":"2021-11-28T01:34:39.631000Z","spacegroup":221},{"id":"mp-1021293","created_at":"2022-09-04T14:48:11.609141Z","structure_string":"Li2 La2 Mg12\n1.0\n5.203115 0.000000 0.000000\n0.000000 6.700003 0.000000\n0.000000 0.000000 11.654603\nLi La Mg\n2 2 12\ndirect\n0.500000 0.000000 0.163341 Li\n0.500000 0.500000 0.663341 Li\n0.500000 0.500000 0.165979 La\n0.500000 0.000000 0.665979 La\n0.500000 0.257764 0.419447 Mg\n0.500000 0.742236 0.419447 Mg\n0.000000 0.761501 0.080502 Mg\n0.000000 0.238499 0.080502 Mg\n0.000000 0.000000 0.332124 Mg\n0.000000 0.500000 0.338653 Mg\n0.500000 0.757764 0.919447 Mg\n0.500000 0.242236 0.919447 Mg\n0.000000 0.261501 0.580502 Mg\n0.000000 0.738499 0.580502 Mg\n0.000000 0.500000 0.832124 Mg\n0.000000 0.000000 0.838653 Mg\n","nsites":16,"nelements":3,"elements":["Li","La","Mg"],"chemical_system":"La-Li-Mg","density":2.384210421958746,"density_atomic":0.03938075846147315,"volume":406.2897878326306,"volume_molar":15.292089322991483,"formula_full":"Li2 La2 Mg12","formula_reduced":"LiLaMg6","formula_anonymous":"ABC6","energy":-32.32922046,"energy_per_atom":-2.02057627875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.32922046,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0085681,"is_theoretical":true,"updated_at":"2021-11-28T01:38:36.124000Z","spacegroup":38}]}