{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-volume&page=10129","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-volume&page=10127","results":[{"id":"mp-1185814","created_at":"2022-09-04T14:43:17.591929Z","structure_string":"Mg5 Hg1\n1.0\n2.699164 -4.675090 0.000000\n2.699164 4.675090 0.000000\n0.000000 0.000000 5.235032\nMg Hg\n5 1\ndirect\n0.327862 0.000000 0.500000 Mg\n0.672138 0.672138 0.500000 Mg\n0.000000 0.327862 0.500000 Mg\n0.333333 0.666667 0.000000 Mg\n0.666667 0.333333 0.000000 Mg\n0.000000 0.000000 0.000000 Hg\n","nsites":6,"nelements":2,"elements":["Mg","Hg"],"chemical_system":"Hg-Mg","density":4.048474997231734,"density_atomic":0.045413258566217946,"volume":132.12000612665318,"volume_molar":13.260754568446131,"formula_full":"Mg5 Hg1","formula_reduced":"Mg5Hg","formula_anonymous":"AB5","energy":-8.74538433,"energy_per_atom":-1.457564055,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.74538433,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0017238,"is_theoretical":true,"updated_at":"2021-11-28T01:36:11.374000Z","spacegroup":189},{"id":"mp-972471","created_at":"2022-09-04T14:39:07.698360Z","structure_string":"Sm3 Ho1\n1.0\n-2.544370 2.544370 5.101933\n2.544370 -2.544370 5.101933\n2.544370 2.544370 -5.101933\nSm Ho\n3 1\ndirect\n0.750000 0.250000 0.500000 Sm\n0.250000 0.750000 0.500000 Sm\n0.500000 0.500000 0.000000 Sm\n0.000000 0.000000 0.000000 Ho\n","nsites":4,"nelements":2,"elements":["Sm","Ho"],"chemical_system":"Ho-Sm","density":7.7425106334503955,"density_atomic":0.030276433606857858,"volume":132.11595698292442,"volume_molar":19.890522239831892,"formula_full":"Sm3 Ho1","formula_reduced":"Sm3Ho","formula_anonymous":"AB3","energy":-18.66985442,"energy_per_atom":-4.667463605,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.66985442,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.002006,"is_theoretical":true,"updated_at":"2021-11-28T01:34:41.165000Z","spacegroup":139},{"id":"mp-11192","created_at":"2022-09-04T14:39:46.300009Z","structure_string":"Ta3 Si6\n1.0\n2.403116 -4.162319 0.000000\n2.403116 4.162319 0.000000\n0.000000 0.000000 6.604105\nTa Si\n3 6\ndirect\n0.000000 0.500000 0.333333 Ta\n0.500000 0.500000 0.666667 Ta\n0.500000 0.000000 0.000000 Ta\n0.840893 0.681786 0.000000 Si\n0.159107 0.840893 0.666667 Si\n0.681786 0.840893 0.333333 Si\n0.159107 0.318214 0.000000 Si\n0.840893 0.159107 0.666667 Si\n0.318214 0.159107 0.333333 Si\n","nsites":9,"nelements":2,"elements":["Ta","Si"],"chemical_system":"Si-Ta","density":8.94092445626548,"density_atomic":0.0681221659179113,"volume":132.1155879107719,"volume_molar":8.840207410986919,"formula_full":"Ta3 Si6","formula_reduced":"TaSi2","formula_anonymous":"AB2","energy":-71.995942,"energy_per_atom":-7.999549111111111,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-72.421942,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0332282,"is_theoretical":false,"updated_at":"2021-11-28T01:34:42.180000Z","spacegroup":181},{"id":"mp-1518228","created_at":"2022-09-04T14:41:20.695522Z","structure_string":"Eu1 Nb1 Zn1 Bi1 O6\n1.0\n0.000000 -4.042398 -4.042398\n4.042398 -0.000000 -4.042398\n4.042398 -4.042398 0.000000\nEu Nb Zn Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Eu\n0.000000 -0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Bi\n0.753442 0.246558 0.246558 O\n0.246558 0.753442 0.753442 O\n0.753442 0.246558 0.753442 O\n0.246558 0.753442 0.246558 O\n0.753442 0.753442 0.246558 O\n0.246558 0.246558 0.753442 O\n","nsites":10,"nelements":5,"elements":["Eu","Nb","Zn","Bi","O"],"chemical_system":"Bi-Eu-Nb-O-Zn","density":7.7331756615710106,"density_atomic":0.07569249019470302,"volume":132.11350259817192,"volume_molar":7.95606108942817,"formula_full":"Eu1 Nb1 Zn1 Bi1 O6","formula_reduced":"EuNbZnBiO6","formula_anonymous":"ABCDE6","energy":-78.81568139,"energy_per_atom":-7.881568139,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-74.69368139,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.8686054,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.297000Z","spacegroup":216},{"id":"mp-978906","created_at":"2022-09-04T14:41:54.655588Z","structure_string":"Sm3 Dy1\n1.0\n-2.548217 2.548217 5.086440\n2.548217 -2.548217 5.086440\n2.548217 2.548217 -5.086440\nSm Dy\n3 1\ndirect\n0.750000 0.250000 0.500000 Sm\n0.250000 0.750000 0.500000 Sm\n0.500000 0.500000 0.000000 Sm\n0.000000 0.000000 0.000000 Dy\n","nsites":4,"nelements":2,"elements":["Sm","Dy"],"chemical_system":"Dy-Sm","density":7.712116082269415,"density_atomic":0.030277028991124888,"volume":132.1133589815738,"volume_molar":19.890131101586192,"formula_full":"Sm3 Dy1","formula_reduced":"Sm3Dy","formula_anonymous":"AB3","energy":-18.69647715,"energy_per_atom":-4.6741192875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.69647715,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0070298,"is_theoretical":true,"updated_at":"2021-11-28T01:35:33.033000Z","spacegroup":139},{"id":"mp-1025559","created_at":"2022-09-04T14:39:15.127777Z","structure_string":"Tb2 Fe2 Si4\n1.0\n1.999924 -8.299986 0.000000\n1.999924 8.299986 0.000000\n0.000000 0.000000 3.979396\nTb Fe Si\n2 2 4\ndirect\n0.607675 0.392325 0.250000 Tb\n0.392325 0.607675 0.750000 Tb\n0.248793 0.751207 0.250000 Fe\n0.751207 0.248793 0.750000 Fe\n0.962660 0.037340 0.250000 Si\n0.037340 0.962660 0.750000 Si\n0.813779 0.186221 0.250000 Si\n0.186221 0.813779 0.750000 Si\n","nsites":8,"nelements":3,"elements":["Tb","Fe","Si"],"chemical_system":"Fe-Si-Tb","density":6.811086202086563,"density_atomic":0.06055527493552947,"volume":132.11070395629855,"volume_molar":9.944865689093984,"formula_full":"Tb2 Fe2 Si4","formula_reduced":"TbFeSi2","formula_anonymous":"ABC2","energy":-53.06110736,"energy_per_atom":-6.63263842,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-53.34510736,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.2728589,"is_theoretical":true,"updated_at":"2021-11-28T01:34:34.805000Z","spacegroup":63},{"id":"mp-1519311","created_at":"2022-09-04T14:43:37.081097Z","structure_string":"Sr2 V1 W1 O6\n1.0\n0.000000 -4.042321 -4.042321\n4.042321 -0.000000 -4.042321\n4.042321 -4.042321 -0.000000\nSr V W O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.000000 -0.000000 -0.000000 V\n0.500000 0.500000 0.500000 W\n0.741467 0.258533 0.258533 O\n0.258533 0.741467 0.741467 O\n0.741467 0.258533 0.741467 O\n0.258533 0.741467 0.258533 O\n0.741467 0.741467 0.258533 O\n0.258533 0.258533 0.741467 O\n","nsites":10,"nelements":4,"elements":["Sr","V","W","O"],"chemical_system":"O-Sr-V-W","density":6.360519499245032,"density_atomic":0.07569681575378127,"volume":132.1059532084805,"volume_molar":7.955606454554433,"formula_full":"Sr2 V1 W1 O6","formula_reduced":"Sr2VWO6","formula_anonymous":"ABC2D6","energy":-82.99964919000001,"energy_per_atom":-8.299964919,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-72.73964919,"band_gap":0.8022,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.0000004,"is_theoretical":true,"updated_at":"2021-11-28T01:36:18.401000Z","spacegroup":225},{"id":"mp-754112","created_at":"2022-09-04T14:47:06.317961Z","structure_string":"Ce2 Br2 O2\n1.0\n4.015234 0.000000 0.000000\n0.000000 4.015234 0.000000\n0.000000 0.000000 8.193977\nCe Br O\n2 2 2\ndirect\n0.000000 0.500000 0.149197 Ce\n0.500000 0.000000 0.850803 Ce\n0.000000 0.500000 0.655276 Br\n0.500000 0.000000 0.344724 Br\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":6,"nelements":3,"elements":["Ce","Br","O"],"chemical_system":"Br-Ce-O","density":5.933491631176784,"density_atomic":0.045418709411485146,"volume":132.10414998015696,"volume_molar":13.259163102677608,"formula_full":"Ce2 Br2 O2","formula_reduced":"CeBrO","formula_anonymous":"ABC","energy":-44.41161197,"energy_per_atom":-7.401935328333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-41.96961197,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9988853,"is_theoretical":true,"updated_at":"2021-11-28T01:37:50.893000Z","spacegroup":129},{"id":"mp-1223265","created_at":"2022-09-04T14:42:01.935913Z","structure_string":"La2 Ge3\n1.0\n4.170893 0.000000 0.000000\n0.000000 4.313543 0.000000\n2.085447 2.156772 7.342243\nLa Ge\n2 3\ndirect\n0.750349 0.250349 0.499302 La\n0.000313 0.000313 0.999373 La\n0.408386 0.408386 0.183228 Ge\n0.178442 0.678442 0.643116 Ge\n0.577509 0.577509 0.844982 Ge\n","nsites":5,"nelements":2,"elements":["La","Ge"],"chemical_system":"Ge-La","density":6.231651942136451,"density_atomic":0.03785106208606015,"volume":132.0966896155183,"volume_molar":15.91009717589363,"formula_full":"La2 Ge3","formula_reduced":"La2Ge3","formula_anonymous":"A2B3","energy":-27.36478029,"energy_per_atom":-5.472956057999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.36478029,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001137,"is_theoretical":true,"updated_at":"2021-11-28T01:35:43.036000Z","spacegroup":44},{"id":"mp-517","created_at":"2022-09-04T14:47:00.678945Z","structure_string":"Ta3 Si6\n1.0\n2.403015 -4.162144 0.000000\n2.403015 4.162144 0.000000\n0.000000 0.000000 6.603700\nTa Si\n3 6\ndirect\n0.000000 0.500000 0.166667 Ta\n0.500000 0.500000 0.833333 Ta\n0.500000 0.000000 0.500000 Ta\n0.840882 0.681765 0.500000 Si\n0.159118 0.840882 0.833333 Si\n0.681765 0.840882 0.166667 Si\n0.159118 0.318235 0.500000 Si\n0.840882 0.159118 0.833333 Si\n0.318235 0.159118 0.166667 Si\n","nsites":9,"nelements":2,"elements":["Ta","Si"],"chemical_system":"Si-Ta","density":8.942224577092395,"density_atomic":0.06813207172207257,"volume":132.09637946594677,"volume_molar":8.838922122558944,"formula_full":"Ta3 Si6","formula_reduced":"TaSi2","formula_anonymous":"AB2","energy":-71.99589021,"energy_per_atom":-7.999543356666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-72.42189021,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0307308,"is_theoretical":false,"updated_at":"2021-11-28T01:37:45.096000Z","spacegroup":180},{"id":"mp-1223844","created_at":"2022-09-04T14:45:57.880021Z","structure_string":"In2 Sb1 As1\n1.0\n7.516493 -2.269833 0.000000\n7.516493 2.269833 0.000000\n6.831048 0.000000 3.871252\nIn Sb As\n2 1 1\ndirect\n0.004911 0.004911 0.004911 In\n0.495133 0.495133 0.495133 In\n0.624691 0.624691 0.624691 Sb\n0.125265 0.125265 0.125265 As\n","nsites":4,"nelements":3,"elements":["In","Sb","As"],"chemical_system":"As-In-Sb","density":5.3590987332702005,"density_atomic":0.030280942592699703,"volume":132.09628424725267,"volume_molar":19.887560440248155,"formula_full":"In2 Sb1 As1","formula_reduced":"In2SbAs","formula_anonymous":"ABC2","energy":-15.03132775,"energy_per_atom":-3.7578319375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.83932775,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001572,"is_theoretical":true,"updated_at":"2021-11-28T01:37:13.660000Z","spacegroup":160},{"id":"mp-1094694","created_at":"2022-09-04T14:46:51.915629Z","structure_string":"Mg2 Cd4\n1.0\n2.626726 4.784368 0.000000\n-2.626726 4.784368 0.000000\n0.000000 3.460233 5.255242\nMg Cd\n2 4\ndirect\n0.083790 0.916210 0.250000 Mg\n0.916210 0.083790 0.750000 Mg\n0.247683 0.419891 0.743686 Cd\n0.580109 0.752317 0.756314 Cd\n0.419891 0.247683 0.243686 Cd\n0.752317 0.580109 0.256314 Cd\n","nsites":6,"nelements":2,"elements":["Mg","Cd"],"chemical_system":"Cd-Mg","density":6.26379918742398,"density_atomic":0.04542439849403304,"volume":132.08760487578414,"volume_molar":13.257502486887242,"formula_full":"Mg2 Cd4","formula_reduced":"MgCd2","formula_anonymous":"AB2","energy":-7.2833059,"energy_per_atom":-1.2138843166666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-7.2833059,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0035272,"is_theoretical":true,"updated_at":"2021-11-28T01:37:38.846000Z","spacegroup":15}]}