{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=42","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=40","results":[{"id":"mp-1097533","created_at":"2022-09-04T14:43:14.631472Z","structure_string":"V1 Sn1 Ru2\n1.0\n-4.637719 6.106793 9.901735\n4.637719 -6.106793 9.901735\n4.637719 6.106793 -9.901735\nV Sn Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.500000 0.500000 Sn\n0.000000 0.218826 0.218826 Ru\n0.000000 0.781174 0.781174 Ru\n","nsites":4,"nelements":3,"elements":["V","Sn","Ru"],"chemical_system":"Ru-Sn-V","density":0.5503761847608724,"density_atomic":0.003565915688472858,"volume":1121.7315128706937,"volume_molar":168.88062663587672,"formula_full":"V1 Sn1 Ru2","formula_reduced":"VSnRu2","formula_anonymous":"ABC2","energy":-20.16655524,"energy_per_atom":-5.04163881,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-20.16655524,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.260811,"is_theoretical":true,"updated_at":"2021-11-28T01:36:01.937000Z","spacegroup":71},{"id":"mp-1199352","created_at":"2022-09-04T14:43:14.643690Z","structure_string":"Sb4 Xe4 F28\n1.0\n11.233197 0.000000 0.000000\n0.000000 5.605943 0.000000\n0.000000 0.886182 11.416071\nSb Xe F\n4 4 28\ndirect\n0.488723 0.903053 0.771071 Sb\n0.988723 0.096947 0.728929 Sb\n0.511277 0.096947 0.228929 Sb\n0.011277 0.903053 0.271071 Sb\n0.731791 0.534774 0.972926 Xe\n0.231791 0.465226 0.527074 Xe\n0.268209 0.465226 0.027074 Xe\n0.768209 0.534774 0.472926 Xe\n0.880758 0.367780 0.026350 F\n0.380758 0.632220 0.473650 F\n0.119242 0.632220 0.973650 F\n0.619242 0.367780 0.526350 F\n0.422208 0.075314 0.637341 F\n0.922208 0.924686 0.862659 F\n0.577792 0.924686 0.362659 F\n0.077792 0.075314 0.137341 F\n0.369626 0.001842 0.875995 F\n0.869626 0.998158 0.624005 F\n0.630374 0.998158 0.124005 F\n0.130374 0.001842 0.375995 F\n0.556060 0.710984 0.917767 F\n0.056060 0.289016 0.582233 F\n0.443940 0.289016 0.082233 F\n0.943940 0.710984 0.417767 F\n0.617793 0.773214 0.688782 F\n0.117793 0.226786 0.811218 F\n0.382207 0.226786 0.311218 F\n0.882207 0.773214 0.188782 F\n0.395430 0.624457 0.750273 F\n0.895430 0.375543 0.749727 F\n0.604570 0.375543 0.249727 F\n0.104570 0.624457 0.250273 F\n0.587331 0.159631 0.812557 F\n0.087331 0.840369 0.687443 F\n0.412669 0.840369 0.187443 F\n0.912669 0.159631 0.312557 F\n","nsites":36,"nelements":3,"elements":["Sb","Xe","F"],"chemical_system":"F-Sb-Xe","density":3.5667669343597774,"density_atomic":0.05007647920021328,"volume":718.9003814758341,"volume_molar":12.025886915736583,"formula_full":"Sb4 Xe4 F28","formula_reduced":"SbXeF7","formula_anonymous":"ABC7","energy":-143.29786817000002,"energy_per_atom":-3.980496338055556,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-130.36186817,"band_gap":2.7566,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0003739,"is_theoretical":false,"updated_at":"2021-11-28T01:36:11.186000Z","spacegroup":14},{"id":"mp-1235174","created_at":"2022-09-04T14:43:14.652304Z","structure_string":"Li1 Eu2 Cr2 O8\n1.0\n6.025146 -0.081969 -1.738214\n-3.473888 4.921525 -1.733392\n-0.005485 -0.004219 6.247063\nLi Eu Cr O\n1 2 2 8\ndirect\n0.148824 0.855689 0.750172 Li\n0.127587 0.872790 0.249409 Eu\n0.859509 0.140929 0.750207 Eu\n0.385373 0.614249 0.749616 Cr\n0.623886 0.377351 0.250418 Cr\n0.811246 0.726179 0.457622 O\n0.355827 0.793472 0.581983 O\n0.729856 0.802940 0.936412 O\n0.787741 0.373853 0.071912 O\n0.626400 0.212070 0.428184 O\n0.197420 0.269812 0.563815 O\n0.206571 0.644874 0.916838 O\n0.275177 0.190790 0.043411 O\n","nsites":13,"nelements":4,"elements":["Li","Eu","Cr","O"],"chemical_system":"Cr-Eu-Li-O","density":4.916534836766919,"density_atomic":0.07090362074259733,"volume":183.34747737628422,"volume_molar":8.493417821160762,"formula_full":"Li1 Eu2 Cr2 O8","formula_reduced":"LiEu2Cr2O8","formula_anonymous":"AB2C2D8","energy":-113.80056632,"energy_per_atom":-8.753889716923076,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-104.30656632,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.9870481,"is_theoretical":true,"updated_at":"2021-11-28T01:36:00.999000Z","spacegroup":5},{"id":"mp-1213437","created_at":"2022-09-04T14:43:14.686792Z","structure_string":"Na1 Tl3 O6\n1.0\n4.837010 -6.833503 0.000000\n4.837010 6.833503 0.000000\n0.000000 0.000000 36.471203\nNa Tl O\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Tl\n0.500000 0.000000 0.000000 Tl\n0.000000 0.500000 0.000000 Tl\n0.000000 0.000000 0.244112 O\n0.000000 0.000000 0.755888 O\n0.282034 0.027815 0.000000 O\n0.717966 0.972185 0.000000 O\n0.027815 0.282034 0.000000 O\n0.972185 0.717966 0.000000 O\n","nsites":10,"nelements":3,"elements":["Na","Tl","O"],"chemical_system":"Na-O-Tl","density":0.5042436544934279,"density_atomic":0.004147625548256231,"volume":2411.018035175393,"volume_molar":145.1948998272485,"formula_full":"Na1 Tl3 O6","formula_reduced":"NaTl3O6","formula_anonymous":"AB3C6","energy":-35.945375760000005,"energy_per_atom":-3.5945375760000005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-31.82337576,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":5.4228548,"is_theoretical":true,"updated_at":"2021-11-28T01:36:13.040000Z","spacegroup":65},{"id":"mp-1075282","created_at":"2022-09-04T14:43:14.694551Z","structure_string":"Mg6 Si8\n1.0\n1.813690 9.012438 0.000000\n-1.813690 9.012438 0.000000\n0.000000 4.265622 8.000237\nMg Si\n6 8\ndirect\n0.953462 0.953462 0.653285 Mg\n0.326485 0.326485 0.925360 Mg\n0.707773 0.707773 0.838867 Mg\n0.765394 0.765394 0.479690 Mg\n0.524156 0.524156 0.341159 Mg\n0.032313 0.032313 0.047882 Mg\n0.348100 0.348100 0.588492 Si\n0.393939 0.393939 0.271978 Si\n0.706291 0.706291 0.234695 Si\n0.600845 0.600845 0.539218 Si\n0.116626 0.116626 0.703266 Si\n0.860608 0.860608 0.134187 Si\n0.492175 0.492175 0.858835 Si\n0.158224 0.158224 0.129714 Si\n","nsites":14,"nelements":2,"elements":["Mg","Si"],"chemical_system":"Mg-Si","density":2.3524235750990954,"density_atomic":0.05352908732679146,"volume":261.5400467138725,"volume_molar":11.250221254913685,"formula_full":"Mg6 Si8","formula_reduced":"Mg3Si4","formula_anonymous":"A3B4","energy":-50.64391542,"energy_per_atom":-3.61742253,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.21191542,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":3.77e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:07.964000Z","spacegroup":8},{"id":"mp-1276783","created_at":"2022-09-04T14:43:14.519833Z","structure_string":"Li8 Al8 Fe4 O24\n1.0\n2.504027 -4.328819 -0.011143\n4.925582 -0.036150 -0.005307\n-0.949977 1.645121 19.635485\nLi Al Fe O\n8 8 4 24\ndirect\n0.359642 0.001785 0.124782 Li\n0.124188 0.001448 0.374930 Li\n0.875250 0.001319 0.625112 Li\n0.637984 0.002388 0.875222 Li\n0.035607 0.691021 0.124297 Li\n0.774427 0.701753 0.374932 Li\n0.524450 0.700762 0.625116 Li\n0.274638 0.690896 0.875572 Li\n0.417525 0.664078 0.249997 Al\n0.167873 0.664393 0.500042 Al\n0.918076 0.664304 0.750028 Al\n0.670388 0.658486 0.000035 Al\n0.334625 0.330456 0.999994 Al\n0.089900 0.320198 0.249935 Al\n0.839981 0.320295 0.500028 Al\n0.589831 0.320289 0.750042 Al\n0.250406 0.999711 0.750424 Fe\n0.999677 0.999978 0.999973 Fe\n0.749938 0.999218 0.249518 Fe\n0.499874 0.000032 0.500038 Fe\n0.346281 0.671169 0.052152 O\n0.091737 0.668258 0.301805 O\n0.841970 0.668754 0.552044 O\n0.591781 0.669263 0.802288 O\n0.738730 0.669245 0.197689 O\n0.489366 0.668966 0.448050 O\n0.239656 0.668576 0.698181 O\n0.982757 0.671872 0.947769 O\n0.091398 0.986074 0.195718 O\n0.841709 0.986494 0.445835 O\n0.591663 0.986320 0.695952 O\n0.319592 0.989070 0.948968 O\n0.691066 0.989404 0.050976 O\n0.422043 0.986085 0.304037 O\n0.172054 0.986383 0.554251 O\n0.922414 0.986182 0.804255 O\n0.027701 0.334543 0.050347 O\n0.774665 0.333346 0.299397 O\n0.524990 0.333923 0.549747 O\n0.275315 0.334009 0.800002 O\n0.390476 0.334063 0.199957 O\n0.141332 0.334001 0.450352 O\n0.891641 0.333760 0.700562 O\n0.636499 0.335208 0.949649 O\n","nsites":44,"nelements":4,"elements":["Li","Al","Fe","O"],"chemical_system":"Al-Fe-Li-O","density":3.500943656239278,"density_atomic":0.10556632043707179,"volume":416.7995987529797,"volume_molar":5.704604210004464,"formula_full":"Li8 Al8 Fe4 O24","formula_reduced":"Li2Al2FeO6","formula_anonymous":"AB2C2D6","energy":-310.12609679,"energy_per_atom":-7.0483203815909095,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.61409679,"band_gap":0.0381,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.2343035,"is_theoretical":true,"updated_at":"2021-11-28T01:36:11.815000Z","spacegroup":5},{"id":"mp-1226741","created_at":"2022-09-04T14:43:14.527778Z","structure_string":"Cd1 Hg1 Te2\n1.0\n7.793424 -2.353037 0.000000\n7.793424 2.353037 0.000000\n7.082981 0.000000 4.013180\nCd Hg Te\n1 1 2\ndirect\n0.999952 0.999952 0.999952 Cd\n0.500015 0.500015 0.500015 Hg\n0.124757 0.124757 0.124757 Te\n0.625276 0.625276 0.625276 Te\n","nsites":4,"nelements":3,"elements":["Cd","Hg","Te"],"chemical_system":"Cd-Hg-Te","density":6.410256318738219,"density_atomic":0.027175922515068795,"volume":147.18911557766023,"volume_molar":22.159839308714464,"formula_full":"Cd1 Hg1 Te2","formula_reduced":"CdHgTe2","formula_anonymous":"ABC2","energy":-9.5751474,"energy_per_atom":-2.39378685,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.7311474,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.71e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:11.257000Z","spacegroup":160},{"id":"mp-881","created_at":"2022-09-04T14:43:14.531292Z","structure_string":"Np1 Sn3\n1.0\n4.662666 0.000000 0.000000\n0.000000 4.662666 0.000000\n0.000000 0.000000 4.662666\nNp Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n","nsites":4,"nelements":2,"elements":["Np","Sn"],"chemical_system":"Np-Sn","density":9.716191543334341,"density_atomic":0.03945999908640713,"volume":101.3684767513816,"volume_molar":15.261380890590187,"formula_full":"Np1 Sn3","formula_reduced":"NpSn3","formula_anonymous":"AB3","energy":-25.51718471,"energy_per_atom":-6.3792961775,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-25.51718471,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.1210575,"is_theoretical":false,"updated_at":"2021-11-28T01:36:04.536000Z","spacegroup":221},{"id":"mp-1077109","created_at":"2022-09-04T14:43:14.561217Z","structure_string":"Sm2 Si2 Pt2\n1.0\n-2.089681 2.089681 7.238707\n2.089681 -2.089681 7.238707\n2.089681 2.089681 -7.238707\nSm Si Pt\n2 2 2\ndirect\n0.752324 0.252324 0.500000 Sm\n0.002324 0.002324 0.000000 Sm\n0.332515 0.832515 0.500000 Si\n0.582515 0.582515 0.000000 Si\n0.165161 0.665161 0.500000 Pt\n0.415161 0.415161 0.000000 Pt\n","nsites":6,"nelements":3,"elements":["Sm","Si","Pt"],"chemical_system":"Pt-Si-Sm","density":9.811220181842465,"density_atomic":0.04745372104438323,"volume":126.4389781865205,"volume_molar":12.690555403163268,"formula_full":"Sm2 Si2 Pt2","formula_reduced":"SmSiPt","formula_anonymous":"ABC","energy":-39.16067523,"energy_per_atom":-6.526779205,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-39.30267523,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":3.1e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:36:06.148000Z","spacegroup":109},{"id":"mp-775316","created_at":"2022-09-04T14:43:14.568961Z","structure_string":"Li8 Ti4 Fe12 O32\n1.0\n8.397925 0.000000 0.000000\n-0.021878 8.407316 0.000000\n-0.001843 -0.009397 8.612375\nLi Ti Fe O\n8 4 12 32\ndirect\n0.999349 0.002154 0.999407 Li\n0.747858 0.747265 0.251147 Li\n0.250145 0.750396 0.750592 Li\n0.501887 0.501007 0.999241 Li\n0.996188 0.501200 0.500029 Li\n0.251359 0.247072 0.249743 Li\n0.752509 0.249228 0.750487 Li\n0.497647 0.999406 0.498312 Li\n0.624567 0.875935 0.873416 Ti\n0.127568 0.627731 0.133188 Ti\n0.374143 0.381115 0.618648 Ti\n0.877503 0.121057 0.370655 Ti\n0.376695 0.874740 0.123406 Fe\n0.127934 0.876827 0.376499 Fe\n0.874247 0.874146 0.626445 Fe\n0.378273 0.626128 0.373520 Fe\n0.626306 0.625255 0.626010 Fe\n0.874667 0.625700 0.873340 Fe\n0.628567 0.373090 0.377606 Fe\n0.877437 0.376154 0.128183 Fe\n0.123398 0.375445 0.876062 Fe\n0.623929 0.123333 0.122898 Fe\n0.373132 0.125926 0.877805 Fe\n0.124424 0.128739 0.622673 Fe\n0.618015 0.883809 0.106411 O\n0.388785 0.884986 0.885162 O\n0.115180 0.896376 0.615201 O\n0.131892 0.856024 0.131394 O\n0.884935 0.890750 0.384551 O\n0.364992 0.862047 0.360365 O\n0.634342 0.867331 0.641470 O\n0.860847 0.867152 0.864966 O\n0.358055 0.629183 0.135107 O\n0.133438 0.634426 0.358705 O\n0.866117 0.637106 0.638368 O\n0.380386 0.608999 0.614202 O\n0.633486 0.640305 0.864162 O\n0.614833 0.609261 0.388766 O\n0.887936 0.608765 0.114241 O\n0.117722 0.603249 0.890761 O\n0.385840 0.382459 0.392061 O\n0.605569 0.381409 0.620167 O\n0.897303 0.383696 0.885731 O\n0.865186 0.359106 0.368159 O\n0.106736 0.387653 0.120573 O\n0.647429 0.364378 0.134467 O\n0.351812 0.368478 0.861047 O\n0.137079 0.360124 0.630741 O\n0.640877 0.135261 0.364310 O\n0.869321 0.139821 0.141330 O\n0.131031 0.149596 0.865230 O\n0.615708 0.111572 0.884626 O\n0.355681 0.138801 0.636749 O\n0.386598 0.115132 0.112375 O\n0.110880 0.115437 0.381799 O\n0.892114 0.118256 0.607628 O\n","nsites":56,"nelements":4,"elements":["Li","Ti","Fe","O"],"chemical_system":"Fe-Li-O-Ti","density":3.9026942404052734,"density_atomic":0.09209493218165891,"volume":608.068203900069,"volume_molar":6.539057706368922,"formula_full":"Li8 Ti4 Fe12 O32","formula_reduced":"Li2TiFe3O8","formula_anonymous":"AB2C3D8","energy":-427.27896629,"energy_per_atom":-7.6299815408928575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-378.22296629,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":56.0000001,"is_theoretical":true,"updated_at":"2021-11-28T01:36:04.577000Z","spacegroup":1},{"id":"mp-1233244","created_at":"2022-09-04T14:43:14.574201Z","structure_string":"Mg1 Mn6 O4 F8\n1.0\n-5.185322 0.105417 0.063275\n-0.045267 4.909873 -6.446523\n0.150485 -4.889058 -3.214657\nMg Mn O F\n1 6 4 8\ndirect\n0.487952 0.828081 0.830643 Mg\n0.489556 0.039770 0.451697 Mn\n0.668896 0.641019 0.229527 Mn\n0.491301 0.338649 0.838437 Mn\n0.953363 0.677208 0.687681 Mn\n0.009603 0.335306 0.345642 Mn\n0.993509 0.010672 0.998894 Mn\n0.825455 0.767688 0.972550 O\n0.659204 0.781272 0.528538 O\n0.683633 0.405467 0.121287 O\n0.320461 0.260223 0.550340 O\n0.787611 0.428790 0.657805 F\n0.851316 0.090545 0.317700 F\n0.641604 0.075484 0.820583 F\n0.303289 0.607428 0.840113 F\n0.355009 0.907162 0.139903 F\n0.086459 0.596593 0.385844 F\n0.199124 0.241149 0.025563 F\n0.178761 0.917491 0.684336 F\n","nsites":19,"nelements":4,"elements":["Mg","Mn","O","F"],"chemical_system":"F-Mg-Mn-O","density":3.860841394149952,"density_atomic":0.07751290576448407,"volume":245.12047139259334,"volume_molar":7.769210430967107,"formula_full":"Mg1 Mn6 O4 F8","formula_reduced":"MgMn6(OF2)4","formula_anonymous":"AB4C6D8","energy":-140.91624258000002,"energy_per_atom":-7.41664434631579,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-124.46424258,"band_gap":0.3479999999999998,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":27.999757,"is_theoretical":true,"updated_at":"2021-11-28T01:36:06.610000Z","spacegroup":1},{"id":"mp-1246939","created_at":"2022-09-04T14:43:13.219277Z","structure_string":"Fe12 W2 N8\n1.0\n6.763394 0.000000 0.000000\n0.000000 6.763394 0.000000\n0.000000 0.000000 4.646413\nFe W N\n12 2 8\ndirect\n0.000000 0.500000 0.513044 Fe\n0.500000 0.000000 0.986956 Fe\n0.500000 0.000000 0.486956 Fe\n0.000000 0.500000 0.013044 Fe\n0.194222 0.194222 0.500000 Fe\n0.805778 0.805778 0.500000 Fe\n0.694222 0.694222 0.000000 Fe\n0.305778 0.305778 0.000000 Fe\n0.805778 0.194222 0.500000 Fe\n0.194222 0.805778 0.500000 Fe\n0.305778 0.694222 0.000000 Fe\n0.694222 0.305778 0.000000 Fe\n0.500000 0.500000 0.500000 W\n0.000000 0.000000 0.000000 W\n0.230616 0.500000 0.285733 N\n0.769384 0.500000 0.285733 N\n0.730616 0.000000 0.214267 N\n0.269384 0.000000 0.214267 N\n0.500000 0.230616 0.714267 N\n0.500000 0.769384 0.714267 N\n0.000000 0.730616 0.785733 N\n0.000000 0.269384 0.785733 N\n","nsites":22,"nelements":3,"elements":["Fe","W","N"],"chemical_system":"Fe-N-W","density":8.983633273459464,"density_atomic":0.10350837612144044,"volume":212.54318562768933,"volume_molar":5.818022642857973,"formula_full":"Fe12 W2 N8","formula_reduced":"Fe6WN4","formula_anonymous":"AB4C6","energy":-193.31667011,"energy_per_atom":-8.787121368636363,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-190.42867011,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.2623555,"is_theoretical":true,"updated_at":"2021-11-28T01:36:06.330000Z","spacegroup":137}]}