{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_magnetic&page=10171","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_magnetic&page=10169","results":[{"id":"mp-753488","created_at":"2022-09-04T14:45:55.760795Z","structure_string":"Li8 Ni1 O4 F2\n1.0\n5.307990 0.000000 0.000000\n-1.767567 5.016352 0.000000\n-2.423852 -0.980116 5.127458\nLi Ni O F\n8 1 4 2\ndirect\n0.217385 0.452708 0.323300 Li\n0.076668 0.200393 0.631927 Li\n0.423880 0.889911 0.645868 Li\n0.666807 0.307285 0.000634 Li\n0.333193 0.692715 0.999366 Li\n0.576120 0.110089 0.354132 Li\n0.923332 0.799607 0.368073 Li\n0.782615 0.547292 0.676700 Li\n0.000000 0.000000 0.000000 Ni\n0.875301 0.116144 0.244089 O\n0.203776 0.796672 0.247080 O\n0.796224 0.203328 0.752920 O\n0.124699 0.883856 0.755911 O\n0.426983 0.523292 0.722388 F\n0.573017 0.476708 0.277612 F\n","nsites":15,"nelements":4,"elements":["Li","Ni","O","F"],"chemical_system":"F-Li-Ni-O","density":2.6297612761699996,"density_atomic":0.10986795673810065,"volume":136.5275230862486,"volume_molar":5.481253077596925,"formula_full":"Li8 Ni1 O4 F2","formula_reduced":"Li8Ni(O2F)2","formula_anonymous":"AB2C4D8","energy":-76.78484884,"energy_per_atom":-5.118989922666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-70.57184884,"band_gap":2.9593,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004703,"is_theoretical":true,"updated_at":"2021-11-28T01:37:15.739000Z","spacegroup":2},{"id":"mp-1021167","created_at":"2022-09-04T14:45:55.769743Z","structure_string":"Ce2 Mg12 Mo2\n1.0\n5.177327 0.000000 0.000000\n0.000000 5.766389 0.000000\n0.000000 0.000000 11.808897\nCe Mg Mo\n2 12 2\ndirect\n0.500000 0.000000 0.177554 Ce\n0.500000 0.500000 0.677554 Ce\n0.500000 0.249810 0.425632 Mg\n0.500000 0.750190 0.425632 Mg\n0.000000 0.740134 0.080916 Mg\n0.000000 0.259866 0.080916 Mg\n0.000000 0.000000 0.336643 Mg\n0.000000 0.500000 0.305098 Mg\n0.500000 0.749810 0.925632 Mg\n0.500000 0.250190 0.925632 Mg\n0.000000 0.240134 0.580916 Mg\n0.000000 0.759866 0.580916 Mg\n0.000000 0.500000 0.836643 Mg\n0.000000 0.000000 0.805098 Mg\n0.500000 0.500000 0.167605 Mo\n0.500000 0.000000 0.667605 Mo\n","nsites":16,"nelements":3,"elements":["Ce","Mg","Mo"],"chemical_system":"Ce-Mg-Mo","density":3.5974433483461916,"density_atomic":0.04538382706326642,"volume":352.5484965755646,"volume_molar":13.269354194402675,"formula_full":"Ce2 Mg12 Mo2","formula_reduced":"CeMg6Mo","formula_anonymous":"ABC6","energy":-49.36525667,"energy_per_atom":-3.085328541875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-49.36525667,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0125086,"is_theoretical":true,"updated_at":"2021-11-28T01:37:15.463000Z","spacegroup":38},{"id":"mp-6138","created_at":"2022-09-04T14:45:55.773182Z","structure_string":"Na4 Ti2 Si2 O10\n1.0\n6.535252 0.000000 0.000000\n0.000000 6.535252 0.000000\n0.000000 0.000000 5.174733\nNa Ti Si O\n4 2 2 10\ndirect\n0.250000 0.250000 0.500000 Na\n0.750000 0.250000 0.500000 Na\n0.250000 0.750000 0.500000 Na\n0.750000 0.750000 0.500000 Na\n0.000000 0.500000 0.063704 Ti\n0.500000 0.000000 0.936296 Ti\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.500000 0.731252 O\n0.500000 0.000000 0.268748 O\n0.292764 0.500000 0.182251 O\n0.707236 0.500000 0.182251 O\n0.000000 0.792764 0.182251 O\n0.000000 0.207236 0.182251 O\n0.500000 0.292764 0.817749 O\n0.792764 0.000000 0.817749 O\n0.500000 0.707236 0.817749 O\n0.207236 0.000000 0.817749 O\n","nsites":18,"nelements":4,"elements":["Na","Ti","Si","O"],"chemical_system":"Na-O-Si-Ti","density":3.0343470189129014,"density_atomic":0.08144414740586509,"volume":221.01035584913933,"volume_molar":7.394197068562257,"formula_full":"Na4 Ti2 Si2 O10","formula_reduced":"Na2TiSiO5","formula_anonymous":"ABC2D5","energy":-135.41062891,"energy_per_atom":-7.522812717222223,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-128.54062891,"band_gap":2.9703,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0015962,"is_theoretical":false,"updated_at":"2021-11-28T01:37:16.426000Z","spacegroup":129},{"id":"mp-977559","created_at":"2022-09-04T14:45:55.772911Z","structure_string":"Dy4 Mg2 Ge4\n1.0\n7.265952 0.000000 0.000000\n0.000000 7.265952 0.000000\n0.000000 0.000000 4.252429\nDy Mg Ge\n4 2 4\ndirect\n0.177238 0.322762 0.500000 Dy\n0.322762 0.822762 0.500000 Dy\n0.677238 0.177238 0.500000 Dy\n0.822762 0.677238 0.500000 Dy\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.123554 0.623554 0.000000 Ge\n0.376446 0.123554 0.000000 Ge\n0.623554 0.876446 0.000000 Ge\n0.876446 0.376446 0.000000 Ge\n","nsites":10,"nelements":3,"elements":["Dy","Mg","Ge"],"chemical_system":"Dy-Ge-Mg","density":7.3164079608163535,"density_atomic":0.044542837543442466,"volume":224.5029852498067,"volume_molar":13.519885782145398,"formula_full":"Dy4 Mg2 Ge4","formula_reduced":"Dy2MgGe2","formula_anonymous":"AB2C2","energy":-47.8774962,"energy_per_atom":-4.7877496200000005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-47.8774962,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.5e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:37:13.897000Z","spacegroup":127},{"id":"mp-1233960","created_at":"2022-09-04T14:45:56.107926Z","structure_string":"Ba6 Mg1 Sc2 C2 O6 F14\n1.0\n5.962239 0.000000 0.000000\n0.000000 8.980456 -0.541857\n0.000000 1.182542 10.837430\nBa Mg Sc C O F\n6 1 2 2 6 14\ndirect\n0.250000 0.828394 0.588469 Ba\n0.750000 0.552101 0.779809 Ba\n0.250000 0.451724 0.224236 Ba\n0.750000 0.005177 0.878418 Ba\n0.250000 0.969167 0.175603 Ba\n0.750000 0.173110 0.404895 Ba\n0.250000 0.304159 0.936559 Mg\n0.250000 0.241732 0.658225 Sc\n0.750000 0.759574 0.296245 Sc\n0.250000 0.477863 0.520859 C\n0.750000 0.539309 0.472009 C\n0.250000 0.590337 0.447704 O\n0.750000 0.678549 0.500967 O\n0.250000 0.485980 0.640888 O\n0.250000 0.340577 0.480750 O\n0.750000 0.431656 0.553849 O\n0.750000 0.514753 0.354396 O\n0.482189 0.207255 0.228357 F\n0.250000 0.077274 0.946511 F\n0.750000 0.929651 0.125780 F\n0.517453 0.797496 0.781299 F\n0.477328 0.088643 0.611255 F\n0.490281 0.699291 0.194456 F\n0.016367 0.272944 0.795022 F\n0.483633 0.272944 0.795022 F\n0.022672 0.088643 0.611255 F\n0.981457 0.908828 0.371526 F\n0.982547 0.797496 0.781299 F\n0.017811 0.207255 0.228357 F\n0.009719 0.699291 0.194456 F\n0.518543 0.908828 0.371526 F\n","nsites":31,"nelements":6,"elements":["Ba","Mg","Sc","C","O","F"],"chemical_system":"Ba-C-F-Mg-O-Sc","density":3.76452538523028,"density_atomic":0.053073494289969755,"volume":584.0957037919891,"volume_molar":11.346795308214917,"formula_full":"Ba6 Mg1 Sc2 C2 O6 F14","formula_reduced":"Ba6MgSc2C2(O3F7)2","formula_anonymous":"AB2C2D6E6F14","energy":-208.66782166,"energy_per_atom":-6.731220053548387,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-198.07782166,"band_gap":0.4683999999999999,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:11.049000Z","spacegroup":6},{"id":"mp-1203040","created_at":"2022-09-04T14:45:56.115213Z","structure_string":"B8 Pb16 O28\n1.0\n5.103704 -5.549433 0.000000\n5.103704 5.549433 0.000000\n0.000000 0.000000 15.762750\nB Pb O\n8 16 28\ndirect\n0.609108 0.363642 0.754596 B\n0.363642 0.609108 0.245404 B\n0.109108 0.863642 0.745404 B\n0.863642 0.109108 0.254596 B\n0.597088 0.373088 0.007960 B\n0.373088 0.597088 0.992040 B\n0.097088 0.873088 0.492040 B\n0.873088 0.097088 0.507960 B\n0.773177 0.680812 0.882217 Pb\n0.680812 0.773177 0.117783 Pb\n0.273177 0.180812 0.617783 Pb\n0.180812 0.273177 0.382217 Pb\n0.420835 0.024560 0.876412 Pb\n0.024560 0.420835 0.123588 Pb\n0.920835 0.524560 0.623588 Pb\n0.524560 0.920835 0.376412 Pb\n0.768342 0.018450 0.699959 Pb\n0.018450 0.768342 0.300041 Pb\n0.268342 0.518450 0.800041 Pb\n0.518450 0.268342 0.199959 Pb\n0.903460 0.151426 0.917987 Pb\n0.151426 0.903460 0.082013 Pb\n0.403460 0.651426 0.582013 Pb\n0.651426 0.403460 0.417987 Pb\n0.469987 0.230498 0.758614 O\n0.230498 0.469987 0.241386 O\n0.969987 0.730498 0.741386 O\n0.730498 0.969987 0.258614 O\n0.708370 0.962750 0.840923 O\n0.962750 0.708370 0.159077 O\n0.208370 0.462750 0.659077 O\n0.462750 0.208370 0.340923 O\n0.480514 0.718125 0.946140 O\n0.718125 0.480514 0.053860 O\n0.980514 0.218125 0.553860 O\n0.218125 0.980514 0.446140 O\n0.782156 0.322153 0.737723 O\n0.322153 0.782156 0.262277 O\n0.282156 0.822153 0.762277 O\n0.822153 0.282156 0.237723 O\n0.070863 0.040463 0.734294 O\n0.040463 0.070863 0.265706 O\n0.570863 0.540463 0.765706 O\n0.540463 0.570863 0.234294 O\n0.910228 0.910228 0.000000 O\n0.410228 0.410228 0.500000 O\n0.635794 0.217447 0.970175 O\n0.217447 0.635794 0.029825 O\n0.135794 0.717447 0.529825 O\n0.717447 0.135794 0.470175 O\n0.419062 0.419062 0.000000 O\n0.919062 0.919062 0.500000 O\n","nsites":52,"nelements":3,"elements":["B","Pb","O"],"chemical_system":"B-O-Pb","density":7.159400557471153,"density_atomic":0.058238109590218884,"volume":892.8861250114036,"volume_molar":10.340549860518518,"formula_full":"B8 Pb16 O28","formula_reduced":"B2Pb4O7","formula_anonymous":"A2B4C7","energy":-357.79427654,"energy_per_atom":-6.880659164230769,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-338.55827654,"band_gap":2.5254,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0004239,"is_theoretical":false,"updated_at":"2021-11-28T01:37:11.379000Z","spacegroup":41},{"id":"mp-1220857","created_at":"2022-09-04T14:45:56.118979Z","structure_string":"Na1 Tl1 O2\n1.0\n3.454808 0.000000 0.000000\n0.000000 3.454808 0.000000\n0.000000 0.000000 4.519273\nNa Tl O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n","nsites":4,"nelements":3,"elements":["Na","Tl","O"],"chemical_system":"Na-O-Tl","density":7.9846440309411015,"density_atomic":0.0741555364857694,"volume":53.94067913954891,"volume_molar":8.120959061708982,"formula_full":"Na1 Tl1 O2","formula_reduced":"NaTlO2","formula_anonymous":"ABC2","energy":-18.70634553,"energy_per_atom":-4.6765863825,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.33234553,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004252,"is_theoretical":true,"updated_at":"2021-11-28T01:37:13.718000Z","spacegroup":123},{"id":"mp-1207646","created_at":"2022-09-04T14:45:56.131617Z","structure_string":"Y2 Tl2 W4 O16\n1.0\n5.335843 5.480200 0.000000\n-5.335843 5.480200 0.000000\n0.000000 4.845967 5.712305\nY Tl W O\n2 2 4 16\ndirect\n0.775994 0.224006 0.750000 Y\n0.224006 0.775994 0.250000 Y\n0.205944 0.794056 0.750000 Tl\n0.794056 0.205944 0.250000 Tl\n0.700669 0.690082 0.782052 W\n0.299331 0.309918 0.217948 W\n0.309918 0.299331 0.717948 W\n0.690082 0.700669 0.282052 W\n0.620466 0.753713 0.559483 O\n0.379534 0.246287 0.440517 O\n0.246287 0.379534 0.940517 O\n0.753713 0.620466 0.059483 O\n0.374740 0.062043 0.875579 O\n0.625260 0.937957 0.124421 O\n0.937957 0.625260 0.624421 O\n0.062043 0.374740 0.375579 O\n0.590132 0.370330 0.966753 O\n0.409868 0.629670 0.033247 O\n0.629670 0.409868 0.533247 O\n0.370330 0.590132 0.466753 O\n0.782828 0.955248 0.690007 O\n0.217172 0.044752 0.309993 O\n0.044752 0.217172 0.809993 O\n0.955248 0.782828 0.190007 O\n","nsites":24,"nelements":4,"elements":["Y","Tl","W","O"],"chemical_system":"O-Tl-W-Y","density":7.843242418162665,"density_atomic":0.07184067549815315,"volume":334.0725826083996,"volume_molar":8.382633818852128,"formula_full":"Y2 Tl2 W4 O16","formula_reduced":"YTl(WO4)2","formula_anonymous":"ABC2D8","energy":-208.63900921000004,"energy_per_atom":-8.693292050416668,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-179.89500921,"band_gap":2.9371,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":4.03e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:17.293000Z","spacegroup":15},{"id":"mp-10057","created_at":"2022-09-04T14:45:56.855021Z","structure_string":"V2 Co2 B6\n1.0\n1.506083 -8.745201 0.000000\n1.506083 8.745201 0.000000\n0.000000 0.000000 2.979181\nV Co B\n2 2 6\ndirect\n0.925584 0.074416 0.250000 V\n0.074416 0.925584 0.750000 V\n0.203840 0.796160 0.250000 Co\n0.796160 0.203840 0.750000 Co\n0.624555 0.375445 0.250000 B\n0.375445 0.624555 0.750000 B\n0.525021 0.474979 0.250000 B\n0.474979 0.525021 0.750000 B\n0.679136 0.320864 0.750000 B\n0.320864 0.679136 0.250000 B\n","nsites":10,"nelements":3,"elements":["V","Co","B"],"chemical_system":"B-Co-V","density":6.022293121955156,"density_atomic":0.12742493261143373,"volume":78.47757730815319,"volume_molar":4.726030170534804,"formula_full":"V2 Co2 B6","formula_reduced":"VCoB3","formula_anonymous":"ABC3","energy":-78.61651258,"energy_per_atom":-7.861651258,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-78.61651258,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0060561,"is_theoretical":false,"updated_at":"2021-11-28T01:37:11.531000Z","spacegroup":63},{"id":"mp-28088","created_at":"2022-09-04T14:45:56.152145Z","structure_string":"Ca10 Al4 Bi12\n1.0\n4.587922 0.000000 0.000000\n0.000000 7.587673 0.000000\n0.000000 0.000000 23.580293\nCa Al Bi\n10 4 12\ndirect\n0.000000 0.534730 0.411371 Ca\n0.000000 0.465270 0.588629 Ca\n0.000000 0.034730 0.088629 Ca\n0.000000 0.965270 0.911371 Ca\n0.000000 0.270801 0.755167 Ca\n0.000000 0.729199 0.244833 Ca\n0.000000 0.770801 0.744833 Ca\n0.000000 0.229199 0.255167 Ca\n0.000000 0.500000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.817656 0.620819 Al\n0.500000 0.182344 0.379181 Al\n0.500000 0.317656 0.879181 Al\n0.500000 0.682344 0.120819 Al\n0.000000 0.036668 0.636215 Bi\n0.000000 0.963332 0.363785 Bi\n0.000000 0.536668 0.863785 Bi\n0.000000 0.463332 0.136215 Bi\n0.500000 0.989339 0.188335 Bi\n0.500000 0.010661 0.811665 Bi\n0.500000 0.489339 0.311665 Bi\n0.500000 0.510661 0.688335 Bi\n0.500000 0.793289 0.002526 Bi\n0.500000 0.206711 0.997474 Bi\n0.500000 0.293289 0.497474 Bi\n0.500000 0.706711 0.502526 Bi\n","nsites":26,"nelements":3,"elements":["Ca","Al","Bi"],"chemical_system":"Al-Bi-Ca","density":6.1020310918935,"density_atomic":0.03167375250293026,"volume":820.8689512742338,"volume_molar":19.013032192642374,"formula_full":"Ca10 Al4 Bi12","formula_reduced":"Ca5(AlBi3)2","formula_anonymous":"A2B5C6","energy":-97.0543674,"energy_per_atom":-3.7328602846153847,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-97.0543674,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0005926,"is_theoretical":false,"updated_at":"2021-11-28T01:37:12.377000Z","spacegroup":55},{"id":"mp-12109","created_at":"2022-09-04T14:45:56.159205Z","structure_string":"Zr4 Re8\n1.0\n2.655817 -4.600010 0.000000\n2.655817 4.600010 0.000000\n0.000000 0.000000 8.691802\nZr Re\n4 8\ndirect\n0.333333 0.666667 0.438343 Zr\n0.666667 0.333333 0.938343 Zr\n0.666667 0.333333 0.561657 Zr\n0.333333 0.666667 0.061657 Zr\n0.657292 0.828646 0.750000 Re\n0.342708 0.171354 0.250000 Re\n0.828646 0.171354 0.250000 Re\n0.171354 0.342708 0.750000 Re\n0.171354 0.828646 0.750000 Re\n0.828646 0.657292 0.250000 Re\n0.000000 0.000000 0.500000 Re\n0.000000 0.000000 0.000000 Re\n","nsites":12,"nelements":2,"elements":["Zr","Re"],"chemical_system":"Re-Zr","density":14.500780213931964,"density_atomic":0.05650469090646094,"volume":212.37174838926302,"volume_molar":10.657771352062044,"formula_full":"Zr4 Re8","formula_reduced":"ZrRe2","formula_anonymous":"AB2","energy":-138.05708054,"energy_per_atom":-11.504756711666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-138.05708054,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004842,"is_theoretical":false,"updated_at":"2021-11-28T01:37:11.465000Z","spacegroup":194},{"id":"mp-1209774","created_at":"2022-09-04T14:45:56.173990Z","structure_string":"P2 H2 Pb2 O8\n1.0\n6.666016 0.000000 0.000000\n0.000000 4.796977 0.000000\n0.000000 0.719075 5.806592\nP H Pb O\n2 2 2 8\ndirect\n0.711295 0.000000 0.750000 P\n0.288705 0.000000 0.250000 P\n0.000000 0.000000 0.500000 H\n0.000000 0.000000 0.000000 H\n0.300550 0.500000 0.750000 Pb\n0.699450 0.500000 0.250000 Pb\n0.581277 0.757913 0.871362 O\n0.418723 0.242087 0.128638 O\n0.581277 0.242087 0.628638 O\n0.418723 0.757913 0.371362 O\n0.846695 0.882197 0.565504 O\n0.153305 0.117803 0.434496 O\n0.846695 0.117803 0.934496 O\n0.153305 0.882197 0.065504 O\n","nsites":14,"nelements":4,"elements":["P","H","Pb","O"],"chemical_system":"H-O-P-Pb","density":5.422796943238326,"density_atomic":0.07540024141046114,"volume":185.67579808912413,"volume_molar":7.9868985129860315,"formula_full":"P2 H2 Pb2 O8","formula_reduced":"PHPbO4","formula_anonymous":"ABCD4","energy":-95.09580791,"energy_per_atom":-6.792557707857143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-89.59980791,"band_gap":3.9234,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001104,"is_theoretical":true,"updated_at":"2021-11-28T01:37:14.455000Z","spacegroup":13}]}