{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=27","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=25","results":[{"id":"mp-1027893","created_at":"2022-09-04T14:43:22.669747Z","structure_string":"Mg14 Zn1 Ga1\n1.0\n6.275586 0.000000 -0.000000\n-3.137793 5.434817 -0.000000\n0.000000 0.000000 10.262491\nMg Zn Ga\n14 1 1\ndirect\n0.165900 0.832950 0.125000 Mg\n0.166900 0.833449 0.625000 Mg\n0.667050 0.334100 0.125000 Mg\n0.666551 0.333100 0.625000 Mg\n0.667050 0.832950 0.125000 Mg\n0.666551 0.833449 0.625000 Mg\n0.330646 0.169354 0.373556 Mg\n0.330646 0.169354 0.876444 Mg\n0.330646 0.661292 0.373556 Mg\n0.330646 0.661292 0.876444 Mg\n0.838708 0.169354 0.373556 Mg\n0.838708 0.169354 0.876444 Mg\n0.833333 0.666667 0.373635 Mg\n0.833333 0.666667 0.876365 Mg\n0.166667 0.333333 0.125000 Zn\n0.166667 0.333333 0.625000 Ga\n","nsites":16,"nelements":3,"elements":["Mg","Zn","Ga"],"chemical_system":"Ga-Mg-Zn","density":2.255371571739168,"density_atomic":0.04571176419387184,"volume":350.0193064555792,"volume_molar":13.17415957620672,"formula_full":"Mg14 Zn1 Ga1","formula_reduced":"Mg14ZnGa","formula_anonymous":"ABC14","energy":-27.08474348,"energy_per_atom":-1.6927964675,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.08474348,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":8e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:36:13.874000Z","spacegroup":187},{"id":"mp-557634","created_at":"2022-09-04T14:43:22.766058Z","structure_string":"Na2 V6 P6 O24\n1.0\n-3.284192 5.339437 6.680157\n3.284192 -5.339437 6.680157\n3.284192 5.339437 -6.680157\nNa V P O\n2 6 6 24\ndirect\n0.250000 0.649384 0.399384 Na\n0.750000 0.350616 0.600616 Na\n0.386041 0.886041 0.000000 V\n0.000000 0.000000 0.000000 V\n0.113959 0.113959 0.500000 V\n0.613959 0.113959 0.000000 V\n0.886041 0.886041 0.500000 V\n0.500000 0.500000 0.000000 V\n0.676522 0.676522 0.500000 P\n0.176522 0.676522 0.000000 P\n0.750000 0.833432 0.083432 P\n0.250000 0.166568 0.916568 P\n0.823478 0.323478 0.000000 P\n0.323478 0.323478 0.500000 P\n0.365418 0.712256 0.065664 O\n0.649707 0.429149 0.349812 O\n0.920663 0.570851 0.220558 O\n0.344535 0.391581 0.047045 O\n0.134582 0.200245 0.346837 O\n0.655465 0.608419 0.952955 O\n0.853408 0.200245 0.065664 O\n0.079337 0.429149 0.779442 O\n0.420663 0.200105 0.349812 O\n0.865226 0.983903 0.349129 O\n0.146592 0.799755 0.934336 O\n0.646592 0.712256 0.346837 O\n0.353408 0.287744 0.653163 O\n0.634774 0.983903 0.118677 O\n0.365226 0.016097 0.881323 O\n0.155465 0.202510 0.047045 O\n0.634582 0.287744 0.934336 O\n0.844535 0.797490 0.952955 O\n0.865418 0.799755 0.653163 O\n0.149707 0.799895 0.220558 O\n0.850293 0.200105 0.779442 O\n0.350293 0.570851 0.650188 O\n0.134774 0.016097 0.650871 O\n0.579337 0.799895 0.650188 O\n","nsites":38,"nelements":4,"elements":["Na","V","P","O"],"chemical_system":"Na-O-P-V","density":3.265527671349639,"density_atomic":0.08109852028976072,"volume":468.56588584141866,"volume_molar":7.425709789134511,"formula_full":"Na2 V6 P6 O24","formula_reduced":"NaV3(PO4)3","formula_anonymous":"AB3C3D12","energy":-310.04085099,"energy_per_atom":-8.158969762894737,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-283.35285099,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.0018859,"is_theoretical":false,"updated_at":"2021-11-28T01:36:16.050000Z","spacegroup":74},{"id":"mp-1214190","created_at":"2022-09-04T14:43:22.771873Z","structure_string":"Bi8 Se4\n1.0\n-2.116687 -3.666209 0.000000\n-2.116687 3.666209 0.000000\n0.000000 0.000000 -24.448134\nBi Se\n8 4\ndirect\n0.666667 0.333333 0.460297 Bi\n0.333333 0.666667 0.539703 Bi\n0.666667 0.333333 0.703979 Bi\n0.333333 0.666667 0.296021 Bi\n0.666667 0.333333 0.946636 Bi\n0.333333 0.666667 0.053364 Bi\n0.000000 0.000000 0.866280 Bi\n0.000000 0.000000 0.133720 Bi\n0.666667 0.333333 0.224081 Se\n0.333333 0.666667 0.775919 Se\n0.000000 0.000000 0.635910 Se\n0.000000 0.000000 0.364090 Se\n","nsites":12,"nelements":2,"elements":["Bi","Se"],"chemical_system":"Bi-Se","density":8.698546508820444,"density_atomic":0.03162508281095863,"volume":379.4456467270275,"volume_molar":19.042292461328277,"formula_full":"Bi8 Se4","formula_reduced":"Bi2Se","formula_anonymous":"AB2","energy":-48.80746436999999,"energy_per_atom":-4.0672886974999996,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-46.91946437,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002997,"is_theoretical":true,"updated_at":"2021-11-28T01:36:14.274000Z","spacegroup":164},{"id":"mp-758157","created_at":"2022-09-04T14:43:22.776020Z","structure_string":"Na8 H4 Ru2 N12 O26\n1.0\n6.524938 4.000989 0.000000\n-6.524938 4.000989 0.000000\n0.000000 1.029929 12.248679\nNa H Ru N O\n8 4 2 12 26\ndirect\n0.722408 0.971990 0.380673 Na\n0.028010 0.277592 0.119327 Na\n0.277592 0.028010 0.619327 Na\n0.971990 0.722408 0.880673 Na\n0.344042 0.169869 0.306375 Na\n0.830131 0.655958 0.193625 Na\n0.655958 0.830131 0.693625 Na\n0.169869 0.344042 0.806375 Na\n0.467517 0.563265 0.312341 H\n0.436735 0.532483 0.187659 H\n0.532483 0.436735 0.687659 H\n0.563265 0.467517 0.812341 H\n0.000000 0.500000 0.500000 Ru\n0.500000 0.000000 0.000000 Ru\n0.012160 0.758816 0.432314 N\n0.241184 0.987840 0.067686 N\n0.987840 0.241184 0.567686 N\n0.758816 0.012160 0.932314 N\n0.697505 0.347512 0.484732 N\n0.652488 0.302495 0.015268 N\n0.302495 0.652488 0.515268 N\n0.347512 0.697505 0.984732 N\n0.042669 0.423707 0.343879 N\n0.576293 0.957331 0.156121 N\n0.957331 0.576293 0.656121 N\n0.423707 0.042669 0.843879 N\n0.156576 0.923176 0.444063 O\n0.076824 0.843424 0.055937 O\n0.843424 0.076824 0.555937 O\n0.923176 0.156576 0.944063 O\n0.878106 0.757369 0.375536 O\n0.242631 0.121894 0.124464 O\n0.121894 0.242631 0.624464 O\n0.757369 0.878106 0.875536 O\n0.634619 0.246223 0.403403 O\n0.753777 0.365381 0.096597 O\n0.365381 0.753777 0.596597 O\n0.246223 0.634619 0.903403 O\n0.570598 0.344023 0.554660 O\n0.655977 0.429402 0.945340 O\n0.429402 0.655977 0.445340 O\n0.344023 0.570598 0.054660 O\n0.057246 0.529731 0.259503 O\n0.470269 0.942754 0.240497 O\n0.942754 0.470269 0.740497 O\n0.529731 0.057246 0.759503 O\n0.049918 0.263433 0.329431 O\n0.736567 0.950082 0.170569 O\n0.950082 0.736567 0.670569 O\n0.263433 0.049918 0.829431 O\n0.497476 0.502524 0.250000 O\n0.502524 0.497476 0.750000 O\n","nsites":52,"nelements":5,"elements":["Na","H","Ru","N","O"],"chemical_system":"H-N-Na-O-Ru","density":2.5293797560620317,"density_atomic":0.08130932354720238,"volume":639.5330539161664,"volume_molar":7.40645782953043,"formula_full":"Na8 H4 Ru2 N12 O26","formula_reduced":"Na4H2RuN6O13","formula_anonymous":"AB2C4D6E13","energy":-332.15637830000003,"energy_per_atom":-6.387622659615385,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-314.2943783,"band_gap":2.1724,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0046338,"is_theoretical":false,"updated_at":"2021-11-28T01:36:15.050000Z","spacegroup":15},{"id":"mp-13190","created_at":"2022-09-04T14:43:22.780082Z","structure_string":"K1 Rb2 Ga1 F6\n1.0\n0.000000 4.491797 4.491797\n4.491797 0.000000 4.491797\n4.491797 4.491797 0.000000\nK Rb Ga F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Ga\n0.215090 0.215090 0.784910 F\n0.215090 0.784910 0.784910 F\n0.784910 0.784910 0.215090 F\n0.215090 0.784910 0.215090 F\n0.784910 0.215090 0.784910 F\n0.784910 0.215090 0.215090 F\n","nsites":10,"nelements":4,"elements":["K","Rb","Ga","F"],"chemical_system":"F-Ga-K-Rb","density":3.6072508922090134,"density_atomic":0.055170845813406616,"volume":181.25515120469626,"volume_molar":10.915440340297645,"formula_full":"K1 Rb2 Ga1 F6","formula_reduced":"KRb2GaF6","formula_anonymous":"ABC2D6","energy":-48.26939788,"energy_per_atom":-4.826939788,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-45.49739788,"band_gap":5.8494,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0002416,"is_theoretical":false,"updated_at":"2021-11-28T01:36:14.381000Z","spacegroup":225},{"id":"mp-1211898","created_at":"2022-09-04T14:43:23.024387Z","structure_string":"K1 Mg1 H1 C2 O10\n1.0\n5.133221 0.000000 0.000000\n1.420477 6.370965 0.000000\n0.930612 2.932616 6.158510\nK Mg H C O\n1 1 1 2 10\ndirect\n0.000000 0.500000 0.000000 K\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 H\n0.659311 0.205925 0.797200 C\n0.340689 0.794075 0.202800 C\n0.838979 0.178239 0.925448 O\n0.161021 0.821761 0.074552 O\n0.598606 0.634694 0.744787 O\n0.401394 0.365306 0.255213 O\n0.481295 0.398961 0.725180 O\n0.518705 0.601039 0.274820 O\n0.798409 0.711678 0.599588 O\n0.201591 0.288322 0.400412 O\n0.636372 0.052492 0.736295 O\n0.363628 0.947508 0.263705 O\n","nsites":15,"nelements":5,"elements":["K","Mg","H","C","O"],"chemical_system":"C-H-K-Mg-O","density":2.048219188759833,"density_atomic":0.0744767002422163,"volume":201.40527106083326,"volume_molar":8.085939280895284,"formula_full":"K1 Mg1 H1 C2 O10","formula_reduced":"KMgH(CO5)2","formula_anonymous":"ABCD2E10","energy":-90.95735178,"energy_per_atom":-6.063823451999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-89.34735178,"band_gap":0.8211,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0022003,"is_theoretical":true,"updated_at":"2021-11-28T01:36:16.759000Z","spacegroup":2},{"id":"mp-776553","created_at":"2022-09-04T14:43:22.616088Z","structure_string":"Li4 Mn2 V2 P4 H4 O20\n1.0\n5.469233 0.000000 0.000000\n-2.570430 6.956330 0.000000\n-1.188427 -3.370534 9.584148\nLi Mn V P H O\n4 2 2 4 4 20\ndirect\n0.107735 0.711602 0.541012 Li\n0.392560 0.783977 0.960683 Li\n0.613777 0.216761 0.037962 Li\n0.887785 0.286770 0.460895 Li\n0.252999 0.252804 0.751761 Mn\n0.500601 0.501407 0.500589 Mn\n0.744695 0.746255 0.249269 V\n0.000680 0.998720 0.998259 V\n0.088534 0.454672 0.222216 P\n0.589315 0.954996 0.720499 P\n0.403687 0.044743 0.277745 P\n0.916347 0.544834 0.779091 P\n0.218229 0.154816 0.488755 H\n0.289145 0.351744 0.011222 H\n0.711169 0.647802 0.987186 H\n0.783627 0.847967 0.513588 H\n0.043504 0.781032 0.851426 O\n0.150142 0.948353 0.328601 O\n0.148773 0.481843 0.826385 O\n0.335843 0.995422 0.115988 O\n0.147569 0.504091 0.381528 O\n0.267594 0.219795 0.942923 O\n0.459873 0.719235 0.648947 O\n0.240345 0.287397 0.556544 O\n0.344017 0.550983 0.171828 O\n0.630954 0.977057 0.321850 O\n0.357183 0.020975 0.680574 O\n0.669183 0.452583 0.833812 O\n0.761073 0.714353 0.445431 O\n0.531157 0.279869 0.349250 O\n0.736203 0.780926 0.056542 O\n0.851274 0.495018 0.619345 O\n0.665017 0.003510 0.882450 O\n0.860885 0.519689 0.172703 O\n0.834360 0.048241 0.664906 O\n0.964163 0.219758 0.148234 O\n","nsites":36,"nelements":6,"elements":["Li","Mn","V","P","H","O"],"chemical_system":"H-Li-Mn-O-P-V","density":3.130563049959933,"density_atomic":0.09872846560045687,"volume":364.63647825428586,"volume_molar":6.09970055077219,"formula_full":"Li4 Mn2 V2 P4 H4 O20","formula_reduced":"Li2MnVP2(HO5)2","formula_anonymous":"ABC2D2E2F10","energy":-264.8572706,"energy_per_atom":-7.3571464055555555,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-244.3812706,"band_gap":0.2936000000000001,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":11.9999997,"is_theoretical":true,"updated_at":"2021-11-28T01:36:16.584000Z","spacegroup":1},{"id":"mp-11537","created_at":"2022-09-04T14:43:22.628829Z","structure_string":"Nb1 Al1 Ru2\n1.0\n0.000000 3.102159 3.102159\n3.102159 0.000000 3.102159\n3.102159 3.102159 0.000000\nNb Al Ru\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n","nsites":4,"nelements":3,"elements":["Nb","Al","Ru"],"chemical_system":"Al-Nb-Ru","density":8.956131588802092,"density_atomic":0.0669942970733314,"volume":59.70657465995401,"volume_molar":8.989034922492305,"formula_full":"Nb1 Al1 Ru2","formula_reduced":"NbAlRu2","formula_anonymous":"ABC2","energy":-34.9834678,"energy_per_atom":-8.74586695,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-34.9834678,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0084929,"is_theoretical":false,"updated_at":"2021-11-28T01:36:17.586000Z","spacegroup":225},{"id":"mp-1227585","created_at":"2022-09-04T14:43:22.630488Z","structure_string":"Ca1 Ti8 Mn1 P12 O48\n1.0\n14.751072 -4.282942 0.000000\n14.751072 4.282942 0.000000\n13.507529 0.000000 7.313301\nCa Ti Mn P O\n1 8 1 12 48\ndirect\n0.500000 0.500000 0.500000 Ca\n0.319646 0.319646 0.319646 Ti\n0.819600 0.819600 0.819600 Ti\n0.180400 0.180400 0.180400 Ti\n0.680354 0.680354 0.680354 Ti\n0.574079 0.574079 0.574079 Ti\n0.073377 0.073377 0.073377 Ti\n0.926623 0.926623 0.926623 Ti\n0.425921 0.425921 0.425921 Ti\n0.000000 0.000000 0.000000 Mn\n0.910056 0.631244 0.337679 P\n0.409406 0.129770 0.838432 P\n0.631244 0.337679 0.910056 P\n0.129770 0.838432 0.409406 P\n0.337679 0.910056 0.631244 P\n0.838432 0.409406 0.129770 P\n0.590594 0.870230 0.161568 P\n0.089944 0.368756 0.662321 P\n0.870230 0.161568 0.590594 P\n0.368756 0.662321 0.089944 P\n0.161568 0.590594 0.870230 P\n0.662321 0.089944 0.368756 P\n0.148503 0.414276 0.050989 O\n0.649592 0.914247 0.550061 O\n0.414276 0.050989 0.148503 O\n0.914247 0.550061 0.649592 O\n0.050989 0.148503 0.414276 O\n0.550061 0.649592 0.914247 O\n0.350408 0.085753 0.449939 O\n0.851497 0.585724 0.949011 O\n0.085753 0.449939 0.350408 O\n0.585724 0.949011 0.851497 O\n0.449939 0.350408 0.085753 O\n0.949011 0.851497 0.585724 O\n0.448507 0.810697 0.701735 O\n0.946799 0.311259 0.202381 O\n0.810697 0.701735 0.448507 O\n0.311259 0.202381 0.946799 O\n0.701735 0.448507 0.810697 O\n0.202381 0.946799 0.311259 O\n0.053201 0.688741 0.797619 O\n0.551493 0.189303 0.298265 O\n0.688741 0.797619 0.053201 O\n0.189303 0.298265 0.551493 O\n0.797619 0.053201 0.688741 O\n0.298265 0.551493 0.189303 O\n0.543436 0.720601 0.364141 O\n0.042765 0.216329 0.864851 O\n0.720601 0.364141 0.543436 O\n0.216329 0.864851 0.042765 O\n0.364141 0.543436 0.720601 O\n0.864851 0.042765 0.216329 O\n0.957235 0.783671 0.135149 O\n0.456564 0.279399 0.635859 O\n0.783671 0.135149 0.957235 O\n0.279399 0.635859 0.456564 O\n0.135149 0.957235 0.783671 O\n0.635859 0.456564 0.279399 O\n0.784759 0.597249 0.406596 O\n0.283960 0.094640 0.909107 O\n0.597249 0.406596 0.784759 O\n0.094640 0.909107 0.283960 O\n0.406596 0.784759 0.597249 O\n0.909107 0.283960 0.094640 O\n0.716040 0.905360 0.090893 O\n0.215241 0.402751 0.593404 O\n0.905360 0.090893 0.716040 O\n0.402751 0.593404 0.215241 O\n0.090893 0.716040 0.905360 O\n0.593404 0.215241 0.402751 O\n","nsites":70,"nelements":5,"elements":["Ca","Ti","Mn","P","O"],"chemical_system":"Ca-Mn-O-P-Ti","density":2.9067873926984507,"density_atomic":0.07575107840882367,"volume":924.0792536604499,"volume_molar":7.949907627055677,"formula_full":"Ca1 Ti8 Mn1 P12 O48","formula_reduced":"CaTi8Mn(PO4)12","formula_anonymous":"ABC8D12E48","energy":-589.83215403,"energy_per_atom":-8.426173628999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-555.18815403,"band_gap":2.6538,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":5.0816172,"is_theoretical":true,"updated_at":"2021-11-28T01:36:15.165000Z","spacegroup":148},{"id":"mp-765582","created_at":"2022-09-04T14:43:22.639350Z","structure_string":"Li4 Ni8 O4 F12\n1.0\n-2.937200 4.266916 6.077552\n2.937200 -4.266916 6.077552\n2.937200 4.266916 -6.077552\nLi Ni O F\n4 8 4 12\ndirect\n0.510838 0.864767 0.646071 Li\n0.781305 0.135233 0.646071 Li\n0.733912 0.370800 0.363112 Li\n0.992312 0.629200 0.363112 Li\n0.735967 0.748775 0.987192 Ni\n0.130997 0.139623 0.506764 Ni\n0.367140 0.860377 0.991374 Ni\n0.983831 0.000000 0.983831 Ni\n0.238417 0.251225 0.987192 Ni\n0.519289 0.500000 0.019289 Ni\n0.130997 0.624233 0.991374 Ni\n0.367140 0.375767 0.506764 Ni\n0.491973 0.729062 0.762911 O\n0.033849 0.270938 0.762911 O\n0.284461 0.500000 0.784461 O\n0.218961 0.000000 0.218961 O\n0.629175 0.866414 0.245455 F\n0.755520 0.000000 0.755520 F\n0.379042 0.133586 0.762762 F\n0.124280 0.887023 0.759036 F\n0.629175 0.383720 0.762762 F\n0.470479 0.237916 0.232563 F\n0.872013 0.112977 0.237257 F\n0.124280 0.365244 0.237257 F\n0.379042 0.616280 0.245455 F\n0.748951 0.500000 0.248951 F\n0.994647 0.762084 0.232563 F\n0.872013 0.634756 0.759036 F\n","nsites":28,"nelements":4,"elements":["Li","Ni","O","F"],"chemical_system":"F-Li-Ni-O","density":4.301790057553245,"density_atomic":0.09190131883963518,"volume":304.6746265835324,"volume_molar":6.552833883165965,"formula_full":"Li4 Ni8 O4 F12","formula_reduced":"LiNi2OF3","formula_anonymous":"ABC2D3","energy":-157.76952886,"energy_per_atom":-5.634626030714286,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-129.14952886,"band_gap":2.2779000000000003,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":16.0000138,"is_theoretical":true,"updated_at":"2021-11-28T01:36:13.160000Z","spacegroup":44},{"id":"mp-1184003","created_at":"2022-09-04T14:43:22.645951Z","structure_string":"Ce2 Sm6\n1.0\n3.601217 -6.237492 0.000000\n3.601217 6.237492 0.000000\n0.000000 0.000000 5.859089\nCe Sm\n2 6\ndirect\n0.333333 0.666667 0.750000 Ce\n0.666667 0.333333 0.250000 Ce\n0.166410 0.332820 0.250000 Sm\n0.667180 0.833590 0.250000 Sm\n0.166410 0.833590 0.250000 Sm\n0.833590 0.667180 0.750000 Sm\n0.332820 0.166410 0.750000 Sm\n0.833590 0.166410 0.750000 Sm\n","nsites":8,"nelements":2,"elements":["Ce","Sm"],"chemical_system":"Ce-Sm","density":7.459181868687929,"density_atomic":0.030392792362060647,"volume":263.22030252101507,"volume_molar":19.814371408391697,"formula_full":"Ce2 Sm6","formula_reduced":"CeSm3","formula_anonymous":"AB3","energy":-39.45841734,"energy_per_atom":-4.9323021675,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-39.45841734,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.2292096,"is_theoretical":true,"updated_at":"2021-11-28T01:36:16.439000Z","spacegroup":194},{"id":"mp-1226478","created_at":"2022-09-04T14:43:21.709677Z","structure_string":"Cr8 B12 Os4\n1.0\n2.917886 0.000000 0.000000\n0.000000 4.263817 0.000000\n0.000000 0.137906 17.377786\nCr B Os\n8 12 4\ndirect\n0.000000 0.888114 0.605252 Cr\n0.000000 0.886571 0.273403 Cr\n0.500000 0.387459 0.892963 Cr\n0.500000 0.376348 0.563535 Cr\n0.500000 0.377150 0.234458 Cr\n0.500000 0.110567 0.720010 Cr\n0.500000 0.109393 0.389341 Cr\n0.500000 0.118869 0.062974 Cr\n0.000000 0.121206 0.819905 B\n0.000000 0.114379 0.488495 B\n0.000000 0.115155 0.158436 B\n0.000000 0.383248 0.989835 B\n0.000000 0.383437 0.652410 B\n0.000000 0.385113 0.322810 B\n0.500000 0.900523 0.841496 B\n0.500000 0.900264 0.511935 B\n0.500000 0.902102 0.181291 B\n0.500000 0.607648 0.672197 B\n0.500000 0.609701 0.342950 B\n0.500000 0.600251 0.011722 B\n0.000000 0.613429 0.768840 Os\n0.000000 0.609618 0.441369 Os\n0.000000 0.607122 0.113238 Os\n0.000000 0.892333 0.941136 Os\n","nsites":24,"nelements":3,"elements":["Cr","B","Os"],"chemical_system":"B-Cr-Os","density":10.035461358505858,"density_atomic":0.11100688600092354,"volume":216.20280384948668,"volume_molar":5.425015489534495,"formula_full":"Cr8 B12 Os4","formula_reduced":"Cr2B3Os","formula_anonymous":"AB2C3","energy":-209.36494865000003,"energy_per_atom":-8.723539527083334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-209.36494865000003,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.6131533,"is_theoretical":true,"updated_at":"2021-11-28T01:36:20.002000Z","spacegroup":6}]}