{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=100","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=98","results":[{"id":"mp-22024","created_at":"2022-09-04T14:46:52.582847Z","structure_string":"Gd2 V2 O8\n1.0\n-3.648866 3.648866 3.207732\n3.648866 -3.648866 3.207732\n3.648866 3.648866 -3.207732\nGd V O\n2 2 8\ndirect\n0.250000 0.750000 0.500000 Gd\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.000000 V\n0.750000 0.250000 0.500000 V\n0.326220 0.509501 0.183281 O\n0.326220 0.142939 0.816719 O\n0.490500 0.673780 0.816719 O\n0.923780 0.607061 0.683281 O\n0.923780 0.240499 0.316719 O\n0.857061 0.673780 0.183281 O\n0.392939 0.076220 0.316719 O\n0.759500 0.076220 0.683281 O\n","nsites":12,"nelements":3,"elements":["Gd","V","O"],"chemical_system":"Gd-O-V","density":5.29146496847342,"density_atomic":0.07024369501446183,"volume":170.83383779183924,"volume_molar":8.573211814612197,"formula_full":"Gd2 V2 O8","formula_reduced":"GdVO4","formula_anonymous":"ABC4","energy":-124.02287869,"energy_per_atom":-10.335239890833334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-115.12687869,"band_gap":2.7181,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":14.00001,"is_theoretical":false,"updated_at":"2021-11-28T01:37:39.677000Z","spacegroup":141},{"id":"mp-1096993","created_at":"2022-09-04T14:42:40.761865Z","structure_string":"Hf2 C2\n1.0\n1.671433 -2.895007 0.000000\n1.671433 2.895007 0.000000\n0.000000 0.000000 5.202714\nHf C\n2 2\ndirect\n0.333333 0.666667 0.250000 Hf\n0.666667 0.333333 0.750000 Hf\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n","nsites":4,"nelements":2,"elements":["Hf","C"],"chemical_system":"C-Hf","density":12.565423483591927,"density_atomic":0.07944406393609087,"volume":50.34989150627815,"volume_molar":7.580353347538385,"formula_full":"Hf2 C2","formula_reduced":"HfC","formula_anonymous":"AB","energy":-41.33859969,"energy_per_atom":-10.3346499225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-41.33859969,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":5.37e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:52.289000Z","spacegroup":194},{"id":"mp-1184442","created_at":"2022-09-04T14:46:13.797514Z","structure_string":"Eu1 Gd1 Rh2\n1.0\n0.000000 3.501457 3.501457\n3.501457 0.000000 3.501457\n3.501457 3.501457 0.000000\nEu Gd Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Eu\n0.000000 0.000000 0.000000 Gd\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n","nsites":4,"nelements":3,"elements":["Eu","Gd","Rh"],"chemical_system":"Eu-Gd-Rh","density":9.960955975060541,"density_atomic":0.046589023062342694,"volume":85.85713408601497,"volume_molar":12.926093667904404,"formula_full":"Eu1 Gd1 Rh2","formula_reduced":"EuGdRh2","formula_anonymous":"ABC2","energy":-41.32711616,"energy_per_atom":-10.33177904,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-41.32711616,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.4296279,"is_theoretical":true,"updated_at":"2021-11-28T01:37:26.431000Z","spacegroup":225},{"id":"mp-1224314","created_at":"2022-09-04T14:48:21.904435Z","structure_string":"Hf1 Mo1\n1.0\n1.671203 -2.472467 0.000000\n1.671204 2.472467 0.000000\n0.000000 0.000000 4.447011\nHf Mo\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 Mo\n","nsites":2,"nelements":2,"elements":["Hf","Mo"],"chemical_system":"Hf-Mo","density":12.400027359926678,"density_atomic":0.054421681459851774,"volume":36.75005891678392,"volume_molar":11.065701386758294,"formula_full":"Hf1 Mo1","formula_reduced":"HfMo","formula_anonymous":"AB","energy":-20.66236651,"energy_per_atom":-10.331183255,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-20.66236651,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003187,"is_theoretical":true,"updated_at":"2021-11-28T01:39:36.396000Z","spacegroup":65},{"id":"mp-20084","created_at":"2022-09-04T14:43:00.288952Z","structure_string":"Gd2 Rh4\n1.0\n0.000000 3.798787 3.798787\n3.798787 0.000000 3.798787\n3.798787 3.798787 0.000000\nGd Rh\n2 4\ndirect\n0.000000 0.000000 0.000000 Gd\n0.250000 0.250000 0.250000 Gd\n0.625000 0.625000 0.625000 Rh\n0.125000 0.625000 0.625000 Rh\n0.625000 0.125000 0.625000 Rh\n0.625000 0.625000 0.125000 Rh\n","nsites":6,"nelements":2,"elements":["Gd","Rh"],"chemical_system":"Gd-Rh","density":10.997497391489757,"density_atomic":0.05472508255266026,"volume":109.63893922364366,"volume_molar":11.004352079697789,"formula_full":"Gd2 Rh4","formula_reduced":"GdRh2","formula_anonymous":"AB2","energy":-61.98228616,"energy_per_atom":-10.330381026666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-61.98228616,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.0420647,"is_theoretical":false,"updated_at":"2021-11-28T01:36:06.182000Z","spacegroup":227},{"id":"mp-1233057","created_at":"2022-09-04T14:39:45.613115Z","structure_string":"Ca1 Hf8 N8 O4\n1.0\n5.586934 -0.073007 -0.575447\n2.854254 -4.792409 -0.657671\n3.754969 0.768681 -10.682338\nCa Hf N O\n1 8 8 4\ndirect\n0.735924 0.385730 0.636988 Ca\n0.057405 0.404418 0.271973 Hf\n0.189863 0.061494 0.798354 Hf\n0.346501 0.462297 0.959364 Hf\n0.520463 0.070166 0.504214 Hf\n0.255782 0.742278 0.462432 Hf\n0.769470 0.079019 0.210751 Hf\n0.591989 0.725076 0.059987 Hf\n0.943058 0.730574 0.765642 Hf\n0.365181 0.060540 0.359469 N\n0.499247 0.400070 0.123283 N\n0.181255 0.385324 0.637983 N\n0.662794 0.368200 0.374351 N\n0.492473 0.771039 0.890917 N\n0.907465 0.711177 0.124766 N\n0.323710 0.826561 0.619423 N\n0.758249 0.131812 0.849335 N\n0.185981 0.084382 0.142624 O\n0.973630 0.732729 0.373363 O\n0.040018 0.418935 0.913053 O\n0.804262 0.955225 0.603249 O\n","nsites":21,"nelements":4,"elements":["Ca","Hf","N","O"],"chemical_system":"Ca-Hf-N-O","density":9.920842109040972,"density_atomic":0.07631394856306957,"volume":275.17905173841945,"volume_molar":7.89127135129564,"formula_full":"Ca1 Hf8 N8 O4","formula_reduced":"CaHf8(N2O)4","formula_anonymous":"AB4C8D8","energy":-216.91390857,"energy_per_atom":-10.32923374142857,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-211.27790857,"band_gap":0.2834000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:34:41.238000Z","spacegroup":1},{"id":"mp-1018055","created_at":"2022-09-04T14:40:21.932744Z","structure_string":"Hf2 Ir2\n1.0\n3.066005 0.000000 0.000000\n0.000000 4.664248 0.000000\n0.000000 0.000000 4.951987\nHf Ir\n2 2\ndirect\n0.500000 0.250000 0.268654 Hf\n0.500000 0.750000 0.731346 Hf\n0.000000 0.750000 0.206072 Ir\n0.000000 0.250000 0.793928 Ir\n","nsites":4,"nelements":2,"elements":["Hf","Ir"],"chemical_system":"Hf-Ir","density":17.385047887907657,"density_atomic":0.056484072616109784,"volume":70.81642336921652,"volume_molar":10.661661741229384,"formula_full":"Hf2 Ir2","formula_reduced":"HfIr","formula_anonymous":"AB","energy":-41.3068139,"energy_per_atom":-10.326703475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-41.3068139,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0041806,"is_theoretical":true,"updated_at":"2021-11-28T01:34:47.842000Z","spacegroup":51},{"id":"mp-1101173","created_at":"2022-09-04T14:40:38.635233Z","structure_string":"W2 N4\n1.0\n-2.911400 2.911400 4.307051\n2.911400 -2.911400 4.307051\n2.911400 2.911400 -4.307051\nW N\n2 4\ndirect\n0.500000 0.500000 0.000000 W\n0.250000 0.750000 0.500000 W\n0.875000 0.549993 0.174993 N\n0.299993 0.125000 0.674993 N\n0.375000 0.700007 0.825007 N\n0.450007 0.625000 0.325007 N\n","nsites":6,"nelements":2,"elements":["W","N"],"chemical_system":"N-W","density":4.818044096286074,"density_atomic":0.041087289246831075,"volume":146.03056346587186,"volume_molar":14.656943474226562,"formula_full":"W2 N4","formula_reduced":"WN2","formula_anonymous":"AB2","energy":-61.95378292,"energy_per_atom":-10.325630486666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-60.509782920000006,"band_gap":0.8721999999999999,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.3e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:04.240000Z","spacegroup":122},{"id":"mp-1226535","created_at":"2022-09-04T14:43:10.173743Z","structure_string":"Ce1 U2 O6\n1.0\n1.925323 -3.334757 0.000000\n1.925323 3.334757 0.000000\n0.000000 0.000000 9.390964\nCe U O\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.666309 U\n0.666667 0.333333 0.333691 U\n0.000000 0.000000 0.262587 O\n0.333333 0.666667 0.905174 O\n0.666667 0.333333 0.581759 O\n0.666667 0.333333 0.094826 O\n0.000000 0.000000 0.737413 O\n0.333333 0.666667 0.418241 O\n","nsites":9,"nelements":3,"elements":["Ce","U","O"],"chemical_system":"Ce-O-U","density":9.806746375584533,"density_atomic":0.07463362675094593,"volume":120.5890748152063,"volume_molar":8.06893758505937,"formula_full":"Ce1 U2 O6","formula_reduced":"CeU2O6","formula_anonymous":"AB2C6","energy":-92.92938302,"energy_per_atom":-10.325487002222223,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-88.80738302,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0000667,"is_theoretical":true,"updated_at":"2021-11-28T01:36:01.933000Z","spacegroup":164},{"id":"mp-1218084","created_at":"2022-09-04T14:43:05.503361Z","structure_string":"Ta12 Cr6 Co6 C4\n1.0\n-4.025407 4.041209 5.708985\n4.025407 -4.041209 5.708985\n4.025407 4.041209 -5.708985\nTa Cr Co C\n12 6 6 4\ndirect\n0.571692 0.071692 0.500000 Ta\n0.179314 0.679314 0.500000 Ta\n0.179072 0.070337 0.500489 Ta\n0.569849 0.678584 0.499511 Ta\n0.569849 0.070337 0.891265 Ta\n0.179072 0.678584 0.108735 Ta\n0.929553 0.929553 0.000000 Ta\n0.319675 0.319675 0.000000 Ta\n0.318878 0.929792 0.999848 Ta\n0.929945 0.319031 0.000152 Ta\n0.929945 0.929792 0.610914 Ta\n0.318878 0.319031 0.389086 Ta\n0.751309 0.502503 0.248806 Cr\n0.253697 0.502503 0.751194 Cr\n0.749105 0.502116 0.753011 Cr\n0.749105 0.996094 0.246989 Cr\n0.952913 0.298895 0.654018 Cr\n0.644876 0.298895 0.345982 Cr\n0.954254 0.299371 0.345117 Co\n0.954254 0.609137 0.654883 Co\n0.548793 0.700768 0.848025 Co\n0.852743 0.700768 0.151975 Co\n0.547579 0.702031 0.154452 Co\n0.547579 0.393127 0.845548 Co\n0.249279 0.999521 0.249759 C\n0.749762 0.999521 0.750241 C\n0.249515 0.998792 0.749278 C\n0.249515 0.500237 0.250722 C\n","nsites":28,"nelements":4,"elements":["Ta","Cr","Co","C"],"chemical_system":"C-Co-Cr-Ta","density":12.895965972545252,"density_atomic":0.0753733866184605,"volume":371.48390507827094,"volume_molar":7.989744165913665,"formula_full":"Ta12 Cr6 Co6 C4","formula_reduced":"Ta6Cr3Co3C2","formula_anonymous":"A2B3C3D6","energy":-289.11007837,"energy_per_atom":-10.325359941785715,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-289.11007837,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0023305,"is_theoretical":true,"updated_at":"2021-11-28T01:35:54.939000Z","spacegroup":44},{"id":"mp-16788","created_at":"2022-09-04T14:44:22.407261Z","structure_string":"Gd8 Si4 Te4 O16\n1.0\n6.235713 0.000000 0.000000\n0.000000 7.100632 0.000000\n0.000000 0.000000 11.202563\nGd Si Te O\n8 4 4 16\ndirect\n0.387954 0.750000 0.500000 Gd\n0.387954 0.750000 0.000000 Gd\n0.612046 0.250000 0.500000 Gd\n0.612046 0.250000 0.000000 Gd\n0.888780 0.966696 0.750000 Gd\n0.888780 0.533304 0.250000 Gd\n0.111220 0.466696 0.750000 Gd\n0.111220 0.033304 0.250000 Gd\n0.114747 0.250000 0.000000 Si\n0.885253 0.750000 0.000000 Si\n0.885253 0.750000 0.500000 Si\n0.114747 0.250000 0.500000 Si\n0.591492 0.592192 0.750000 Te\n0.591492 0.907808 0.250000 Te\n0.408508 0.092192 0.750000 Te\n0.408508 0.407808 0.250000 Te\n0.273180 0.072516 0.466491 O\n0.273180 0.427484 0.533509 O\n0.726820 0.572516 0.033509 O\n0.726820 0.927484 0.966491 O\n0.726820 0.927484 0.533509 O\n0.726820 0.572516 0.466491 O\n0.273180 0.427484 0.966491 O\n0.273180 0.072516 0.033509 O\n0.050135 0.764926 0.383230 O\n0.050135 0.764926 0.116770 O\n0.949865 0.264926 0.116770 O\n0.949865 0.235074 0.883230 O\n0.949865 0.235074 0.616770 O\n0.949865 0.264926 0.383230 O\n0.050135 0.735074 0.883230 O\n0.050135 0.735074 0.616770 O\n","nsites":32,"nelements":4,"elements":["Gd","Si","Te","O"],"chemical_system":"Gd-O-Si-Te","density":7.153172761510723,"density_atomic":0.064513330002843,"volume":496.0215198717817,"volume_molar":9.334723164553147,"formula_full":"Gd8 Si4 Te4 O16","formula_reduced":"Gd2SiTeO4","formula_anonymous":"ABC2D4","energy":-330.39865763,"energy_per_atom":-10.3249580509375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-317.71865763,"band_gap":0.0,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":55.9939991,"is_theoretical":false,"updated_at":"2021-11-28T01:36:36.021000Z","spacegroup":57},{"id":"mp-754628","created_at":"2022-09-04T14:42:59.357265Z","structure_string":"W4 N8\n1.0\n5.889180 0.000000 0.000000\n0.000000 6.007305 0.000000\n0.000000 0.000000 8.134127\nW N\n4 8\ndirect\n0.051451 0.374146 0.124253 W\n0.448549 0.874146 0.624253 W\n0.551451 0.374146 0.375747 W\n0.948549 0.874146 0.875747 W\n0.010231 0.096046 0.028120 N\n0.152114 0.904808 0.702258 N\n0.347886 0.404808 0.202258 N\n0.489769 0.596046 0.528120 N\n0.652114 0.904808 0.797742 N\n0.510231 0.096046 0.471880 N\n0.989769 0.596046 0.971880 N\n0.847886 0.404808 0.297742 N\n","nsites":12,"nelements":2,"elements":["W","N"],"chemical_system":"N-W","density":4.889889750160208,"density_atomic":0.041699974208375894,"volume":287.76996215958496,"volume_molar":14.441593488540786,"formula_full":"W4 N8","formula_reduced":"WN2","formula_anonymous":"AB2","energy":-123.89944708000002,"energy_per_atom":-10.324953923333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-121.01144708,"band_gap":0.8351,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004916,"is_theoretical":true,"updated_at":"2021-11-28T01:36:13.114000Z","spacegroup":33}]}