{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=589","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=587","results":[{"id":"jvasp-112660","created_at":"2022-09-04T14:38:43.051610Z","updated_at":"2022-09-04T14:38:43.051635Z","structure_string":"Na2 Tm2 Ti4 O12\n1.0\n5.266078 -0.000000 0.000000\n0.000000 5.505642 0.000000\n-0.000000 -0.000000 7.562058\nNa Tm Ti O\n2 2 4 12\ndirect\n0.493964 0.712817 0.500000 Na\n0.993964 0.287182 -0.000000 Na\n0.018460 0.174672 0.500000 Tm\n0.518460 0.825328 -0.000000 Tm\n0.511443 0.265312 0.752371 Ti\n0.011443 0.734688 0.252371 Ti\n0.511443 0.265312 0.247629 Ti\n0.011443 0.734688 0.747629 Ti\n0.609625 0.278749 0.500000 O\n0.917687 0.777104 0.500000 O\n0.282665 0.961430 0.706597 O\n0.186025 0.440265 0.306013 O\n0.686025 0.559735 0.193987 O\n0.282665 0.961430 0.293404 O\n0.686025 0.559735 0.806013 O\n0.782665 0.038569 0.206597 O\n0.109625 0.721251 -0.000000 O\n0.186025 0.440265 0.693987 O\n0.782665 0.038569 0.793404 O\n0.417687 0.222895 -0.000000 O\n","nsites":20,"nelements":4,"elements":["Na","Tm","Ti","O"],"chemical_system":"Na-O-Ti-Tm","density":5.811443142896084,"density_atomic":0.09122098046431909,"volume":219.24780788585102,"volume_molar":6.601705802050165,"formula_full":"Na2 Tm2 Ti4 O12","formula_reduced":"NaTmTi2O6","formula_anonymous":"ABC2D6","energy_above_hull":2.3970560916666663,"spacegroup":31},{"id":"jvasp-42997","created_at":"2022-09-04T14:38:10.617996Z","updated_at":"2022-09-04T14:38:10.618012Z","structure_string":"Fe2 Ni2 P4 O16\n1.0\n0.000000 4.732915 -0.021332\n5.735550 0.000000 0.000000\n0.000000 0.010993 -9.692121\nFe Ni P O\n2 2 4 16\ndirect\n0.061780 0.750000 0.271287 Fe\n0.938219 0.250000 0.728713 Fe\n0.567523 0.250000 0.224003 Ni\n0.432476 0.750000 0.775996 Ni\n0.615676 0.750000 0.085208 P\n0.107827 0.250000 0.406090 P\n0.892171 0.750000 0.593909 P\n0.384322 0.250000 0.914792 P\n0.232780 0.040760 0.839452 O\n0.232780 0.459240 0.839452 O\n0.738366 0.539587 0.666841 O\n0.738366 0.960413 0.666841 O\n0.212125 0.750000 0.614389 O\n0.162615 0.250000 0.561967 O\n0.837383 0.750000 0.438032 O\n0.767218 0.540761 0.160548 O\n0.261633 0.460413 0.333158 O\n0.261633 0.039587 0.333158 O\n0.702272 0.250000 0.887607 O\n0.767218 0.959240 0.160548 O\n0.297726 0.750000 0.112393 O\n0.322004 0.250000 0.069458 O\n0.787873 0.250000 0.385610 O\n0.677995 0.750000 0.930541 O\n","nsites":24,"nelements":4,"elements":["Fe","Ni","P","O"],"chemical_system":"Fe-Ni-O-P","density":3.843430967659333,"density_atomic":0.09122016626522764,"volume":263.09971777752173,"volume_molar":6.601764726552127,"formula_full":"Fe2 Ni2 P4 O16","formula_reduced":"FeNi(PO4)2","formula_anonymous":"ABC2D8","energy_above_hull":2.876374741666667,"spacegroup":11},{"id":"jvasp-50971","created_at":"2022-09-04T14:37:02.047804Z","updated_at":"2022-09-04T14:37:02.047828Z","structure_string":"Yb4 Ti4 O12\n1.0\n5.307086 0.000000 0.000000\n0.000000 5.454641 0.000000\n0.000000 0.000000 7.573853\nYb Ti O\n4 4 12\ndirect\n0.987226 0.447073 0.750000 Yb\n0.512775 0.947073 0.750000 Yb\n0.487226 0.052927 0.250000 Yb\n0.012774 0.552927 0.250000 Yb\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n0.500000 0.500000 0.500000 Ti\n0.795881 0.705309 0.546174 O\n0.704120 0.205309 0.546174 O\n0.704120 0.205309 0.953826 O\n0.587867 0.476232 0.250000 O\n0.412134 0.523767 0.750000 O\n0.204120 0.294691 0.046174 O\n0.295880 0.794691 0.453826 O\n0.204120 0.294691 0.453826 O\n0.795881 0.705309 0.953826 O\n0.087866 0.023767 0.750000 O\n0.295880 0.794691 0.046174 O\n0.912135 0.976232 0.250000 O\n","nsites":20,"nelements":3,"elements":["Yb","Ti","O"],"chemical_system":"O-Ti-Yb","density":8.14646357061502,"density_atomic":0.09122015925205176,"volume":219.24978167093204,"volume_molar":6.601765234108104,"formula_full":"Yb4 Ti4 O12","formula_reduced":"YbTiO3","formula_anonymous":"ABC3","energy_above_hull":1.4668599066666663,"spacegroup":62},{"id":"jvasp-85675","created_at":"2022-09-04T14:35:45.521889Z","updated_at":"2022-09-04T14:35:45.521920Z","structure_string":"Na3 Mg1 P2 H1 O8\n1.0\n4.640182 0.000239 -2.395549\n-0.159184 6.833922 -0.186110\n0.022154 -0.001581 5.174204\nNa Mg P H O\n3 1 2 1 8\ndirect\n0.295007 0.785545 0.661641 Na\n0.704992 0.214455 0.338358 Na\n0.000000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Mg\n0.355243 0.242700 0.660455 P\n0.644757 0.757300 0.339543 P\n0.500000 0.500000 -0.000000 H\n0.217454 0.097851 0.784073 O\n0.782546 0.902149 0.215926 O\n0.683143 0.211565 0.787427 O\n0.316856 0.788435 0.212571 O\n0.313081 0.456541 0.758365 O\n0.686919 0.543459 0.241634 O\n0.791309 0.772090 0.674316 O\n0.208691 0.227910 0.325683 O\n","nsites":15,"nelements":5,"elements":["Na","Mg","P","H","O"],"chemical_system":"H-Mg-Na-O-P","density":2.870175864963189,"density_atomic":0.09121965757709546,"volume":164.43824059877178,"volume_molar":6.601801541417003,"formula_full":"Na3 Mg1 P2 H1 O8","formula_reduced":"Na3MgP2HO8","formula_anonymous":"ABC2D3E8","energy_above_hull":1.89819967,"spacegroup":2},{"id":"jvasp-119225","created_at":"2022-09-04T14:38:49.944826Z","updated_at":"2022-09-04T14:38:49.944853Z","structure_string":"Al4 Fe2 N6\n1.0\n5.496204 0.002916 0.000000\n-2.749039 4.757478 0.000000\n-0.000000 -0.000000 5.029572\nAl Fe N\n4 2 6\ndirect\n0.335679 0.331469 0.492186 Al\n0.664320 0.995790 0.492186 Al\n0.664320 0.668532 0.992186 Al\n0.335679 0.004211 0.992186 Al\n0.000000 0.667242 0.483959 Fe\n0.000000 0.332759 0.983959 Fe\n0.346224 0.335480 0.870016 N\n0.653776 0.989256 0.870016 N\n0.653776 0.664522 0.370017 N\n0.346224 0.010745 0.370017 N\n0.000000 0.683650 0.879633 N\n0.000000 0.316350 0.379634 N\n","nsites":12,"nelements":3,"elements":["Al","Fe","N"],"chemical_system":"Al-Fe-N","density":3.8329017597420925,"density_atomic":0.09121735247070589,"volume":131.55391682578986,"volume_molar":6.601968372118659,"formula_full":"Al4 Fe2 N6","formula_reduced":"Al2FeN3","formula_anonymous":"AB2C3","energy_above_hull":3.962258475,"spacegroup":36},{"id":"jvasp-48540","created_at":"2022-09-04T14:36:47.035900Z","updated_at":"2022-09-04T14:36:47.035917Z","structure_string":"Li2 Co4 O2 F6\n1.0\n0.000000 4.176676 4.176676\n4.256615 0.021204 4.155470\n4.374775 4.280300 -0.103625\nLi Co O F\n2 4 2 6\ndirect\n0.625001 0.125000 0.624999 Li\n0.625000 0.625001 0.125000 Li\n0.985832 0.962394 0.065942 Co\n0.264168 0.287608 0.184058 Co\n0.125000 0.625001 0.624999 Co\n0.625001 0.625001 0.624999 Co\n0.386425 0.410327 0.816825 O\n0.863576 0.839675 0.433174 O\n0.388540 0.377956 0.371916 F\n0.861590 0.377956 0.371916 F\n0.391327 0.871794 0.345554 F\n0.858674 0.378208 0.904445 F\n0.388411 0.872046 0.878083 F\n0.861461 0.872046 0.878083 F\n","nsites":14,"nelements":4,"elements":["Li","Co","O","F"],"chemical_system":"Co-F-Li-O","density":4.280112171838893,"density_atomic":0.09121650246157266,"volume":153.48099984317932,"volume_molar":6.60202989315117,"formula_full":"Li2 Co4 O2 F6","formula_reduced":"LiCo2OF3","formula_anonymous":"ABC2D3","energy_above_hull":1.2455951639285714,"spacegroup":12},{"id":"jvasp-46190","created_at":"2022-09-04T14:38:00.160334Z","updated_at":"2022-09-04T14:38:00.160350Z","structure_string":"Co4 Hg2 O8\n1.0\n-4.249543 4.249543 0.000000\n4.249543 -0.000000 4.249543\n4.249543 4.249543 -0.000000\nCo Hg O\n4 2 8\ndirect\n0.625000 0.250000 0.125000 Co\n0.625000 0.250000 0.625000 Co\n0.625000 0.749999 0.625000 Co\n0.125000 0.749999 0.625000 Co\n0.000000 0.000000 0.000000 Hg\n0.250000 0.500000 0.250000 Hg\n0.803917 0.202612 0.398694 O\n0.851305 0.297388 0.851305 O\n0.851305 0.702611 0.446082 O\n0.398694 0.202612 0.398694 O\n0.398694 0.797388 0.398694 O\n0.446082 0.297388 0.851305 O\n0.851305 0.702611 0.851305 O\n0.398694 0.797388 0.803917 O\n","nsites":14,"nelements":3,"elements":["Co","Hg","O"],"chemical_system":"Co-Hg-O","density":8.275640365178049,"density_atomic":0.09121606973645079,"volume":153.4817279504586,"volume_molar":6.602061212897771,"formula_full":"Co4 Hg2 O8","formula_reduced":"Co2HgO4","formula_anonymous":"AB2C4","energy_above_hull":2.239510057142857,"spacegroup":227},{"id":"jvasp-117078","created_at":"2022-09-04T14:38:46.479394Z","updated_at":"2022-09-04T14:38:46.479421Z","structure_string":"Li1 Mn5 O7 F1\n1.0\n5.216659 -0.005037 2.874534\n1.695799 4.933338 2.874534\n-0.007064 -0.005037 5.956210\nLi Mn O F\n1 5 7 1\ndirect\n0.763449 0.763447 0.763446 Li\n0.377223 0.377222 0.377222 Mn\n0.986494 0.986492 0.986491 Mn\n0.367361 0.876097 0.367360 Mn\n0.367362 0.367360 0.876096 Mn\n0.876098 0.367360 0.367360 Mn\n0.175208 0.617592 0.617591 O\n0.617593 0.617592 0.175207 O\n0.133938 0.133937 0.576845 O\n0.121165 0.121165 0.121165 O\n0.576845 0.133937 0.133937 O\n0.133938 0.576845 0.133937 O\n0.617593 0.175207 0.617592 O\n0.635744 0.635743 0.635742 F\n","nsites":14,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":4.464054159381768,"density_atomic":0.09121208959048592,"volume":153.48842530475588,"volume_molar":6.6023493015427555,"formula_full":"Li1 Mn5 O7 F1","formula_reduced":"LiMn5O7F","formula_anonymous":"ABC5D7","energy_above_hull":3.2740450706711823,"spacegroup":160},{"id":"jvasp-43055","created_at":"2022-09-04T14:37:38.634693Z","updated_at":"2022-09-04T14:37:38.634725Z","structure_string":"Ni3 Sn1 P4 O16\n1.0\n0.000000 4.740446 0.008803\n5.729145 0.000000 0.000000\n0.000000 -0.052339 -9.688488\nNi Sn P O\n3 1 4 16\ndirect\n0.928616 0.500000 0.730208 Ni\n0.575242 0.500000 0.223280 Ni\n0.422695 0.000000 0.769916 Ni\n0.068967 0.000000 0.276680 Sn\n0.869743 0.000000 0.596258 P\n0.627318 0.000000 0.076846 P\n0.379206 0.500000 0.908377 P\n0.123159 0.500000 0.420672 P\n0.283235 0.709261 0.345672 O\n0.190841 0.000000 0.609621 O\n0.311049 0.000000 0.106233 O\n0.221041 0.289188 0.835062 O\n0.221041 0.710811 0.835062 O\n0.324772 0.500000 0.063631 O\n0.678557 0.000000 0.923226 O\n0.810878 0.500000 0.387688 O\n0.781392 0.208527 0.155259 O\n0.699987 0.500000 0.888811 O\n0.283235 0.290739 0.345672 O\n0.717710 0.787553 0.666186 O\n0.717710 0.212447 0.666186 O\n0.801798 0.000000 0.439150 O\n0.781392 0.791472 0.155259 O\n0.180426 0.500000 0.575052 O\n","nsites":24,"nelements":4,"elements":["Ni","Sn","P","O"],"chemical_system":"Ni-O-P-Sn","density":4.257782431471133,"density_atomic":0.09121170522509277,"volume":263.1241236064238,"volume_molar":6.602377123789679,"formula_full":"Ni3 Sn1 P4 O16","formula_reduced":"Ni3Sn(PO4)4","formula_anonymous":"AB3C4D16","energy_above_hull":2.798038620833334,"spacegroup":6},{"id":"jvasp-15670","created_at":"2022-09-04T14:36:51.968402Z","updated_at":"2022-09-04T14:36:51.968428Z","structure_string":"Tb1 Ni2 B2 C1\n1.0\n3.400551 0.000000 -1.096207\n-0.353375 3.382140 -1.096207\n-0.026943 -0.029905 5.738960\nTb Ni B C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.250002 0.750001 0.500000 Ni\n0.750001 0.250001 0.500000 Ni\n0.355839 0.355839 0.711674 B\n0.644163 0.644163 0.288325 B\n0.500001 0.500000 -0.000000 C\n","nsites":6,"nelements":4,"elements":["Tb","Ni","B","C"],"chemical_system":"B-C-Ni-Tb","density":7.824001303266086,"density_atomic":0.09121087929863884,"volume":65.78162655745321,"volume_molar":6.602436909178957,"formula_full":"Tb1 Ni2 B2 C1","formula_reduced":"TbNi2B2C","formula_anonymous":"ABC2D2","energy_above_hull":3.3254263944444444,"spacegroup":139},{"id":"jvasp-55470","created_at":"2022-09-04T14:37:28.898516Z","updated_at":"2022-09-04T14:37:28.898540Z","structure_string":"Co4 Mo6 O16\n1.0\n2.898536 -5.020413 -0.000000\n2.898536 5.020413 0.000000\n-0.000000 0.000000 9.794439\nCo Mo O\n4 6 16\ndirect\n0.666668 0.333334 0.053471 Co\n0.333334 0.666668 0.553471 Co\n0.666668 0.333334 0.484138 Co\n0.333334 0.666668 0.984138 Co\n0.707887 0.853944 0.251234 Mo\n0.853944 0.707887 0.751234 Mo\n0.853944 0.146058 0.751234 Mo\n0.146058 0.853944 0.251234 Mo\n0.292114 0.146057 0.751234 Mo\n0.146057 0.292114 0.251234 Mo\n0.510884 0.021767 0.632441 O\n0.489117 0.510884 0.132441 O\n0.666668 0.333334 0.856611 O\n0.000000 0.000000 0.107176 O\n0.000000 0.000000 0.607176 O\n0.489118 0.978234 0.132441 O\n0.510884 0.489117 0.632441 O\n0.830516 0.661033 0.369527 O\n0.338968 0.169485 0.369527 O\n0.169485 0.830516 0.869527 O\n0.169485 0.338968 0.869527 O\n0.978234 0.489118 0.632441 O\n0.830516 0.169485 0.369527 O\n0.661033 0.830516 0.869527 O\n0.021767 0.510884 0.132441 O\n0.333334 0.666668 0.356611 O\n","nsites":26,"nelements":3,"elements":["Co","Mo","O"],"chemical_system":"Co-Mo-O","density":6.217755051881582,"density_atomic":0.09121066925044855,"volume":285.0543715298103,"volume_molar":6.60245211386867,"formula_full":"Co4 Mo6 O16","formula_reduced":"Co2Mo3O8","formula_anonymous":"A2B3C8","energy_above_hull":4.007048269230769,"spacegroup":186},{"id":"jvasp-45921","created_at":"2022-09-04T14:38:04.083054Z","updated_at":"2022-09-04T14:38:04.083081Z","structure_string":"V4 O4 F4\n1.0\n0.000000 5.099089 -0.105507\n4.580633 0.000000 0.000000\n0.000000 -0.117030 -5.630498\nV O F\n4 4 4\ndirect\n0.221089 0.482174 0.354983 V\n0.221089 0.017825 0.854983 V\n0.778912 0.982174 0.145018 V\n0.778912 0.517825 0.645018 V\n0.084588 0.227320 0.123613 O\n0.084588 0.272680 0.623614 O\n0.915413 0.727319 0.376387 O\n0.915413 0.772680 0.876387 O\n0.418391 0.760734 0.117495 F\n0.418391 0.739265 0.617495 F\n0.581609 0.260734 0.382506 F\n0.581609 0.239266 0.882506 F\n","nsites":12,"nelements":3,"elements":["V","O","F"],"chemical_system":"F-O-V","density":4.338596701201226,"density_atomic":0.09120730238083173,"volume":131.5684126901876,"volume_molar":6.602695839917333,"formula_full":"V4 O4 F4","formula_reduced":"VOF","formula_anonymous":"ABC","energy_above_hull":1.0541226608333334,"spacegroup":14}]}