{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=10203","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=10201","results":[{"id":"mp-1179735","created_at":"2022-09-04T14:43:07.911880Z","structure_string":"Rh4 N12 Cl24 O4\n1.0\n6.910900 0.000000 0.000000\n0.000000 11.803874 0.000000\n0.000000 0.000000 13.667397\nRh N Cl O\n4 12 24 4\ndirect\n0.250000 0.730334 0.595415 Rh\n0.250000 0.230334 0.904585 Rh\n0.750000 0.269666 0.404585 Rh\n0.750000 0.769666 0.095415 Rh\n0.250000 0.973205 0.031997 N\n0.250000 0.473205 0.468003 N\n0.750000 0.026795 0.968003 N\n0.750000 0.526795 0.531997 N\n0.250000 0.501705 0.797159 N\n0.250000 0.001705 0.702841 N\n0.750000 0.498295 0.202841 N\n0.750000 0.998295 0.297159 N\n0.250000 0.607770 0.129501 N\n0.250000 0.107770 0.370499 N\n0.750000 0.392230 0.870499 N\n0.750000 0.892230 0.629501 N\n0.250000 0.873967 0.741952 Cl\n0.250000 0.373967 0.758048 Cl\n0.750000 0.126033 0.258048 Cl\n0.750000 0.626033 0.241952 Cl\n0.250000 0.604737 0.455345 Cl\n0.250000 0.104737 0.044655 Cl\n0.750000 0.395263 0.544655 Cl\n0.750000 0.895263 0.955345 Cl\n0.012821 0.627455 0.673270 Cl\n0.487179 0.127455 0.826730 Cl\n0.512821 0.372545 0.326730 Cl\n0.987179 0.872545 0.173270 Cl\n0.987179 0.372545 0.326730 Cl\n0.512821 0.872545 0.173270 Cl\n0.487179 0.627455 0.673270 Cl\n0.012821 0.127455 0.826730 Cl\n0.012717 0.842040 0.514444 Cl\n0.487283 0.342040 0.985556 Cl\n0.512717 0.157960 0.485556 Cl\n0.987283 0.657960 0.014444 Cl\n0.987283 0.157960 0.485556 Cl\n0.512717 0.657960 0.014444 Cl\n0.487283 0.842040 0.514444 Cl\n0.012717 0.342040 0.985556 Cl\n0.250000 0.013081 0.354929 O\n0.250000 0.513081 0.145071 O\n0.750000 0.986919 0.645071 O\n0.750000 0.486919 0.854929 O\n","nsites":44,"nelements":4,"elements":["Rh","N","Cl","O"],"chemical_system":"Cl-N-O-Rh","density":2.2259784508624447,"density_atomic":0.03946459888422428,"volume":1114.9232791920942,"volume_molar":15.259602099762663,"formula_full":"Rh4 N12 Cl24 O4","formula_reduced":"RhN3Cl6O","formula_anonymous":"ABC3D6","energy":-188.19464396,"energy_per_atom":-4.277150999090909,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-170.71064396,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.1584896,"is_theoretical":true,"updated_at":"2021-11-28T01:36:00.193000Z","spacegroup":62},{"id":"mp-1190669","created_at":"2022-09-04T14:40:15.600494Z","structure_string":"K4 Ti4 I12 O1\n1.0\n-6.937170 6.937170 4.107874\n6.937170 -6.937170 4.107874\n6.937170 6.937170 -4.107874\nK Ti I O\n4 4 12 1\ndirect\n0.818679 0.584278 0.402957 K\n0.181321 0.415722 0.597043 K\n0.415722 0.818679 0.234401 K\n0.584278 0.181321 0.765599 K\n0.141465 0.028556 0.170020 Ti\n0.858535 0.971444 0.829980 Ti\n0.971444 0.141465 0.112909 Ti\n0.028556 0.858535 0.887091 Ti\n0.062761 0.650589 0.713350 I\n0.937239 0.349411 0.286650 I\n0.349411 0.062761 0.412172 I\n0.650589 0.937239 0.587828 I\n0.873993 0.931618 0.289466 I\n0.642151 0.584527 0.710534 I\n0.584527 0.873993 0.942376 I\n0.931618 0.642151 0.057624 I\n0.126007 0.068382 0.710534 I\n0.357849 0.415473 0.289466 I\n0.415473 0.126007 0.057624 I\n0.068382 0.357849 0.942376 I\n0.000000 0.000000 0.000000 O\n","nsites":21,"nelements":4,"elements":["K","Ti","I","O"],"chemical_system":"I-K-O-Ti","density":3.961990635614677,"density_atomic":0.026556908343475252,"volume":790.7546966083299,"volume_molar":22.676362331459323,"formula_full":"K4 Ti4 I12 O1","formula_reduced":"K4Ti4I12O","formula_anonymous":"AB4C4D12","energy":-89.81975817999998,"energy_per_atom":-4.277131341904761,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-84.58475818,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0001248,"is_theoretical":false,"updated_at":"2021-11-28T01:34:53.693000Z","spacegroup":87},{"id":"mp-1219080","created_at":"2022-09-04T14:39:38.958741Z","structure_string":"Sm1 Be1 Cu4\n1.0\n2.561647 -4.436903 0.000000\n2.561647 4.436903 0.000000\n0.000000 0.000000 3.862197\nSm Be Cu\n1 1 4\ndirect\n0.333333 0.666667 0.000000 Sm\n0.666667 0.333333 0.000000 Be\n0.000000 0.000000 0.000000 Cu\n0.343498 0.171749 0.500000 Cu\n0.828251 0.171749 0.500000 Cu\n0.828251 0.656502 0.500000 Cu\n","nsites":6,"nelements":3,"elements":["Sm","Be","Cu"],"chemical_system":"Be-Cu-Sm","density":7.822039049339607,"density_atomic":0.06834198919306929,"volume":87.79375711540561,"volume_molar":8.811772719970401,"formula_full":"Sm1 Be1 Cu4","formula_reduced":"SmBeCu4","formula_anonymous":"ABC4","energy":-25.66219435,"energy_per_atom":-4.277032391666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-25.66219435,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0173556,"is_theoretical":true,"updated_at":"2021-11-28T01:34:26.289000Z","spacegroup":187},{"id":"mp-1214207","created_at":"2022-09-04T14:41:57.158067Z","structure_string":"C8 Cl24\n1.0\n6.649382 0.000000 0.000000\n0.000000 10.551708 0.000000\n0.000000 0.000000 11.889427\nC Cl\n8 24\ndirect\n0.786639 0.750000 0.611124 C\n0.213361 0.250000 0.388876 C\n0.286639 0.250000 0.888876 C\n0.713361 0.750000 0.111124 C\n0.020838 0.750000 0.640343 C\n0.979162 0.250000 0.359657 C\n0.520838 0.250000 0.859657 C\n0.479162 0.750000 0.140343 C\n0.081545 0.612630 0.719949 Cl\n0.918455 0.387370 0.280051 Cl\n0.581545 0.387370 0.780051 Cl\n0.918455 0.112630 0.280051 Cl\n0.418455 0.612630 0.219949 Cl\n0.081545 0.887370 0.719949 Cl\n0.418455 0.887370 0.219949 Cl\n0.581545 0.112630 0.780051 Cl\n0.726867 0.612460 0.531444 Cl\n0.273133 0.387540 0.468556 Cl\n0.226867 0.387540 0.968556 Cl\n0.273133 0.112460 0.468556 Cl\n0.773133 0.612460 0.031444 Cl\n0.726867 0.887540 0.531444 Cl\n0.773133 0.887540 0.031444 Cl\n0.226867 0.112460 0.968556 Cl\n0.162726 0.750000 0.513373 Cl\n0.837274 0.250000 0.486627 Cl\n0.662726 0.250000 0.986627 Cl\n0.337274 0.750000 0.013373 Cl\n0.644775 0.750000 0.737641 Cl\n0.355225 0.250000 0.262359 Cl\n0.144775 0.250000 0.762359 Cl\n0.855225 0.750000 0.237641 Cl\n","nsites":32,"nelements":2,"elements":["C","Cl"],"chemical_system":"C-Cl","density":1.8850143421322216,"density_atomic":0.03836056594504162,"volume":834.1899868173407,"volume_molar":15.698779753739283,"formula_full":"C8 Cl24","formula_reduced":"CCl3","formula_anonymous":"AB3","energy":-136.86381648,"energy_per_atom":-4.276994265,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-122.12781648,"band_gap":4.7139,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:32.608000Z","spacegroup":62},{"id":"mp-758302","created_at":"2022-09-04T14:45:12.935557Z","structure_string":"Li2 Ag2 F4\n1.0\n1.565309 -5.732172 0.000000\n1.565309 5.732172 0.000000\n0.000000 0.000000 5.727083\nLi Ag F\n2 2 4\ndirect\n0.893593 0.106407 0.250000 Li\n0.106407 0.893593 0.750000 Li\n0.630428 0.369572 0.250000 Ag\n0.369572 0.630428 0.750000 Ag\n0.697981 0.302019 0.750000 F\n0.302019 0.697981 0.250000 F\n0.000000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n","nsites":8,"nelements":3,"elements":["Li","Ag","F"],"chemical_system":"Ag-F-Li","density":4.937837006019652,"density_atomic":0.07784078705027543,"volume":102.77388375881912,"volume_molar":7.736484930593583,"formula_full":"Li2 Ag2 F4","formula_reduced":"LiAgF2","formula_anonymous":"ABC2","energy":-34.21590962,"energy_per_atom":-4.2769887025,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.36790962,"band_gap":1.4668,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.7e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:36:51.525000Z","spacegroup":63},{"id":"mp-558139","created_at":"2022-09-04T14:43:17.609366Z","structure_string":"Cu2 S2\n1.0\n1.671601 -2.895298 0.000000\n1.671601 2.895298 0.000000\n0.000000 0.000000 6.179820\nCu S\n2 2\ndirect\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n","nsites":4,"nelements":2,"elements":["Cu","S"],"chemical_system":"Cu-S","density":5.308297319071935,"density_atomic":0.06686953104230485,"volume":59.817975954839724,"volume_molar":9.005806779458506,"formula_full":"Cu2 S2","formula_reduced":"CuS","formula_anonymous":"AB","energy":-17.10792621,"energy_per_atom":-4.2769815525,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.10192621,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006365,"is_theoretical":false,"updated_at":"2021-11-28T01:36:07.026000Z","spacegroup":194},{"id":"mp-1185520","created_at":"2022-09-04T14:47:03.710938Z","structure_string":"Lu2 Bi6\n1.0\n3.411532 -5.908947 0.000000\n3.411532 5.908947 0.000000\n0.000000 0.000000 5.960349\nLu Bi\n2 6\ndirect\n0.333333 0.666667 0.750000 Lu\n0.666667 0.333333 0.250000 Lu\n0.172917 0.345834 0.250000 Bi\n0.654166 0.827083 0.250000 Bi\n0.172917 0.827083 0.250000 Bi\n0.827083 0.654166 0.750000 Bi\n0.345834 0.172917 0.750000 Bi\n0.827083 0.172917 0.750000 Bi\n","nsites":8,"nelements":2,"elements":["Lu","Bi"],"chemical_system":"Bi-Lu","density":11.082621927826121,"density_atomic":0.033291146922949925,"volume":240.30412705562387,"volume_molar":18.08931597922364,"formula_full":"Lu2 Bi6","formula_reduced":"LuBi3","formula_anonymous":"AB3","energy":-34.21554932,"energy_per_atom":-4.276943665,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-34.21554932,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.1381768,"is_theoretical":true,"updated_at":"2021-11-28T01:37:51.342000Z","spacegroup":194},{"id":"mp-1111412","created_at":"2022-09-04T14:44:13.201803Z","structure_string":"Na2 Sb1 Au1 F6\n1.0\n0.000000 4.619286 4.619286\n4.619286 0.000000 4.619286\n4.619286 4.619286 0.000000\nNa Sb Au F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.766000 0.234000 0.234000 F\n0.234000 0.234000 0.766000 F\n0.234000 0.766000 0.766000 F\n0.234000 0.766000 0.234000 F\n0.766000 0.234000 0.766000 F\n0.766000 0.766000 0.234000 F\n","nsites":10,"nelements":4,"elements":["Na","Sb","Au","F"],"chemical_system":"Au-F-Na-Sb","density":4.032318439599403,"density_atomic":0.05072773225483955,"volume":197.1308307212171,"volume_molar":11.871496107389019,"formula_full":"Na2 Sb1 Au1 F6","formula_reduced":"Na2SbAuF6","formula_anonymous":"ABC2D6","energy":-42.76863174,"energy_per_atom":-4.276863174,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-39.99663174,"band_gap":0.7439999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003666,"is_theoretical":true,"updated_at":"2021-11-28T01:36:30.364000Z","spacegroup":225},{"id":"mp-30282","created_at":"2022-09-04T14:43:35.278076Z","structure_string":"La4 I10\n1.0\n4.437137 0.000000 0.000000\n0.000000 9.239680 0.000000\n0.000000 0.819741 14.973877\nLa I\n4 10\ndirect\n0.250000 0.905122 0.153968 La\n0.750000 0.094878 0.846032 La\n0.250000 0.417158 0.656479 La\n0.750000 0.582842 0.343521 La\n0.250000 0.358910 0.280909 I\n0.750000 0.641090 0.719091 I\n0.250000 0.860344 0.929064 I\n0.750000 0.139656 0.070936 I\n0.750000 0.314462 0.512760 I\n0.250000 0.685538 0.487240 I\n0.750000 0.941084 0.312532 I\n0.250000 0.058916 0.687468 I\n0.750000 0.652995 0.125267 I\n0.250000 0.347005 0.874733 I\n","nsites":14,"nelements":2,"elements":["La","I"],"chemical_system":"I-La","density":4.935584427052898,"density_atomic":0.02280520632322169,"volume":613.8949063462023,"volume_molar":26.406868127598912,"formula_full":"La4 I10","formula_reduced":"La2I5","formula_anonymous":"A2B5","energy":-59.87449589,"energy_per_atom":-4.276749706428571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-56.08449589,"band_gap":0.1718000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0014587,"is_theoretical":false,"updated_at":"2021-11-28T01:36:26.294000Z","spacegroup":11},{"id":"mp-23015","created_at":"2022-09-04T14:46:57.442392Z","structure_string":"Cs6 Mo4 Br18\n1.0\n3.956223 -6.852379 0.000000\n3.956223 6.852379 0.000000\n0.000000 0.000000 19.074806\nCs Mo Br\n6 4 18\ndirect\n0.666667 0.333333 0.930558 Cs\n0.333333 0.666667 0.430558 Cs\n0.666667 0.333333 0.569442 Cs\n0.333333 0.666667 0.069442 Cs\n0.000000 0.000000 0.750000 Cs\n0.000000 0.000000 0.250000 Cs\n0.333333 0.666667 0.674774 Mo\n0.666667 0.333333 0.174774 Mo\n0.666667 0.333333 0.325226 Mo\n0.333333 0.666667 0.825226 Mo\n0.820316 0.640633 0.096078 Br\n0.179684 0.820316 0.596078 Br\n0.640633 0.820316 0.596078 Br\n0.359367 0.179684 0.096078 Br\n0.820316 0.179684 0.096078 Br\n0.179684 0.359367 0.903922 Br\n0.179684 0.820316 0.903922 Br\n0.179684 0.359367 0.596078 Br\n0.640633 0.820316 0.903922 Br\n0.359367 0.179684 0.403922 Br\n0.820316 0.640633 0.403922 Br\n0.820316 0.179684 0.403922 Br\n0.505768 0.011536 0.250000 Br\n0.494232 0.505768 0.750000 Br\n0.011536 0.505768 0.750000 Br\n0.988464 0.494232 0.250000 Br\n0.505768 0.494232 0.250000 Br\n0.494232 0.988464 0.750000 Br\n","nsites":28,"nelements":3,"elements":["Cs","Mo","Br"],"chemical_system":"Br-Cs-Mo","density":4.205807444271583,"density_atomic":0.027073584975081017,"volume":1034.2184097810346,"volume_molar":22.243603001016965,"formula_full":"Cs6 Mo4 Br18","formula_reduced":"Cs3Mo2Br9","formula_anonymous":"A2B3C9","energy":-119.74354132,"energy_per_atom":-4.276555047142858,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-110.13154132,"band_gap":1.0076,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.0226854,"is_theoretical":false,"updated_at":"2021-11-28T01:37:48.937000Z","spacegroup":194},{"id":"mp-684964","created_at":"2022-09-04T14:41:49.174502Z","structure_string":"Cu11 S20\n1.0\n3.205981 0.000000 1.850974\n1.068660 3.022628 1.850974\n2.554195 1.806089 69.614954\nCu S\n11 20\ndirect\n0.739097 0.739097 0.089135 Cu\n0.779090 0.779090 0.483136 Cu\n0.835238 0.835238 0.574714 Cu\n0.793549 0.793549 0.630968 Cu\n0.769684 0.769684 0.684547 Cu\n0.755001 0.755001 0.736750 Cu\n0.744068 0.744068 0.788390 Cu\n0.734379 0.734379 0.839843 Cu\n0.723004 0.723004 0.891549 Cu\n0.704187 0.704187 0.944372 Cu\n0.679943 0.679943 0.998009 Cu\n0.899717 0.899717 0.015042 S\n0.999800 0.999800 0.050030 S\n0.989956 0.989956 0.101507 S\n0.870600 0.870600 0.169410 S\n0.868084 0.868084 0.269787 S\n0.113981 0.113981 0.182903 S\n0.803055 0.803055 0.379542 S\n0.109305 0.109305 0.283604 S\n0.982030 0.982030 0.402695 S\n0.035187 0.035187 0.494722 S\n0.150987 0.150987 0.427352 S\n0.092559 0.092559 0.536116 S\n0.025560 0.025560 0.696166 S\n0.069741 0.069741 0.589539 S\n0.044354 0.044354 0.643347 S\n0.013649 0.013649 0.747953 S\n0.004133 0.004133 0.799380 S\n0.992737 0.992737 0.851090 S\n0.976159 0.976159 0.903576 S\n0.951164 0.951164 0.957325 S\n","nsites":31,"nelements":2,"elements":["Cu","S"],"chemical_system":"Cu-S","density":3.407441988633388,"density_atomic":0.047461024133254086,"volume":653.167532014538,"volume_molar":12.688602637591464,"formula_full":"Cu11 S20","formula_reduced":"Cu11S20","formula_anonymous":"A11B20","energy":-132.57147923,"energy_per_atom":-4.27649933,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-122.51147923,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.2306818,"is_theoretical":true,"updated_at":"2021-11-28T01:35:26.169000Z","spacegroup":160},{"id":"mp-865730","created_at":"2022-09-04T14:41:56.265037Z","structure_string":"Ti1 Zn1 Au2\n1.0\n0.000000 3.223485 3.223485\n3.223485 0.000000 3.223485\n3.223485 3.223485 0.000000\nTi Zn Au\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Au\n0.750000 0.750000 0.750000 Au\n","nsites":4,"nelements":3,"elements":["Ti","Zn","Au"],"chemical_system":"Au-Ti-Zn","density":12.572719029623071,"density_atomic":0.05971081992492503,"volume":66.98953397439924,"volume_molar":10.085510076015861,"formula_full":"Ti1 Zn1 Au2","formula_reduced":"TiZnAu2","formula_anonymous":"ABC2","energy":-17.1056154,"energy_per_atom":-4.27640385,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.1056154,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0071903,"is_theoretical":true,"updated_at":"2021-11-28T01:35:37.377000Z","spacegroup":225}]}