{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3378","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3376","results":[{"id":"jvasp-88979","created_at":"2022-09-04T14:36:05.540711Z","updated_at":"2022-09-04T14:36:05.540736Z","structure_string":"Lu4 Al6 Co2\n1.0\n5.415443 0.000000 0.000000\n-2.707721 4.689911 -0.000000\n0.000000 -0.000000 8.445671\nLu Al Co\n4 6 2\ndirect\n0.666667 0.333333 0.943926 Lu\n0.333333 0.666667 0.443926 Lu\n0.333333 0.666667 0.056074 Lu\n0.666667 0.333333 0.556074 Lu\n0.836948 0.673896 0.250000 Al\n0.163052 0.836948 0.750000 Al\n0.673896 0.836948 0.750000 Al\n0.326104 0.163051 0.250000 Al\n0.836948 0.163051 0.250000 Al\n0.163051 0.326104 0.750000 Al\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n","nsites":12,"nelements":3,"elements":["Lu","Al","Co"],"chemical_system":"Al-Co-Lu","density":7.583603116072476,"density_atomic":0.05594335347792574,"volume":214.50269342067574,"volume_molar":10.76471177648696,"formula_full":"Lu4 Al6 Co2","formula_reduced":"Lu2Al3Co","formula_anonymous":"AB2C3","energy_above_hull":1.9520268000000005,"spacegroup":194},{"id":"jvasp-108045","created_at":"2022-09-04T14:36:04.934624Z","updated_at":"2022-09-04T14:36:04.934639Z","structure_string":"Zr2 Cr1 Co3\n1.0\n4.273455 0.000417 2.212283\n1.346072 4.055923 2.212283\n0.000577 0.000417 4.812133\nZr Cr Co\n2 1 3\ndirect\n0.627363 0.627363 0.627360 Zr\n0.372638 0.372638 0.372637 Zr\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.500000 -0.000000 Co\n0.500000 0.000000 -0.000001 Co\n0.000000 0.000000 0.499999 Co\n","nsites":6,"nelements":3,"elements":["Zr","Cr","Co"],"chemical_system":"Co-Cr-Zr","density":8.188360699897345,"density_atomic":0.07194487727461384,"volume":83.39718166587429,"volume_molar":8.370492782986439,"formula_full":"Zr2 Cr1 Co3","formula_reduced":"Zr2CrCo3","formula_anonymous":"AB2C3","energy_above_hull":4.251151516666667,"spacegroup":166},{"id":"jvasp-48674","created_at":"2022-09-04T14:35:59.713562Z","updated_at":"2022-09-04T14:35:59.713592Z","structure_string":"Na4 Fe2 O6\n1.0\n2.755452 5.044550 0.191249\n-2.755452 5.044550 -0.191249\n-1.782355 0.000000 4.895887\nNa Fe O\n4 2 6\ndirect\n0.587465 0.594452 0.491923 Na\n0.259221 0.251774 0.509745 Na\n0.748225 0.740780 0.009745 Na\n0.405548 0.412534 0.991923 Na\n0.951953 0.916964 0.510932 Fe\n0.083036 0.048047 0.010932 Fe\n0.286137 0.862388 0.770257 O\n0.137611 0.713863 0.270257 O\n0.955604 0.625584 0.669694 O\n0.753690 0.145303 0.745251 O\n0.374416 0.044397 0.169694 O\n0.854696 0.246311 0.245251 O\n","nsites":12,"nelements":3,"elements":["Na","Fe","O"],"chemical_system":"Fe-Na-O","density":3.5656835864664447,"density_atomic":0.08599381646789404,"volume":139.54491721483512,"volume_molar":7.002992781752369,"formula_full":"Na4 Fe2 O6","formula_reduced":"Na2FeO3","formula_anonymous":"AB2C3","energy_above_hull":1.4373056666666666,"spacegroup":9},{"id":"jvasp-88845","created_at":"2022-09-04T14:36:04.711657Z","updated_at":"2022-09-04T14:36:04.711685Z","structure_string":"Rb8 Pb4 O12\n1.0\n6.131066 0.000000 0.000000\n0.000000 7.363373 0.000000\n0.000000 0.000000 10.960471\nRb Pb O\n8 4 12\ndirect\n0.766675 0.393675 0.913721 Rb\n0.733326 0.893674 0.086279 Rb\n0.266675 0.106325 0.913721 Rb\n0.266675 0.106325 0.586279 Rb\n0.233325 0.606325 0.413721 Rb\n0.733326 0.893674 0.413721 Rb\n0.233325 0.606325 0.086279 Rb\n0.766675 0.393675 0.586279 Rb\n0.764516 0.345254 0.250000 Pb\n0.235484 0.654745 0.750000 Pb\n0.264516 0.154746 0.250000 Pb\n0.735485 0.845254 0.750000 Pb\n0.504888 0.273624 0.118494 O\n0.004888 0.226376 0.381506 O\n0.154482 0.383662 0.750000 O\n0.495112 0.726376 0.881506 O\n0.995113 0.773624 0.881506 O\n0.004888 0.226376 0.118494 O\n0.845519 0.616337 0.250000 O\n0.495112 0.726376 0.618494 O\n0.345518 0.883662 0.250000 O\n0.654482 0.116338 0.750000 O\n0.504888 0.273624 0.381506 O\n0.995113 0.773624 0.618494 O\n","nsites":24,"nelements":3,"elements":["Rb","Pb","O"],"chemical_system":"O-Pb-Rb","density":5.720224349773815,"density_atomic":0.04850307047930282,"volume":494.81403471644654,"volume_molar":12.415999029524865,"formula_full":"Rb8 Pb4 O12","formula_reduced":"Rb2PbO3","formula_anonymous":"AB2C3","energy_above_hull":0.8065468866666665,"spacegroup":62},{"id":"jvasp-42334","created_at":"2022-09-04T14:36:06.473753Z","updated_at":"2022-09-04T14:36:06.473780Z","structure_string":"Fe4 O2 F6\n1.0\n4.657597 -0.140116 0.000000\n-0.140116 4.657597 0.000000\n0.000000 0.000000 5.970992\nFe O F\n4 2 6\ndirect\n0.974873 0.974873 0.000000 Fe\n0.025127 0.025127 0.500000 Fe\n0.500000 0.500000 0.250000 Fe\n0.500000 0.500000 0.750000 Fe\n0.307997 0.307997 0.500000 O\n0.692003 0.692003 0.000000 O\n0.186221 0.813779 0.250000 F\n0.186221 0.813779 0.750000 F\n0.279512 0.279512 0.000000 F\n0.720488 0.720488 0.500000 F\n0.813779 0.186221 0.750000 F\n0.813779 0.186221 0.250000 F\n","nsites":12,"nelements":3,"elements":["Fe","O","F"],"chemical_system":"F-Fe-O","density":4.739501990933733,"density_atomic":0.09272656187232184,"volume":129.4127567947918,"volume_molar":6.494515312982355,"formula_full":"Fe4 O2 F6","formula_reduced":"Fe2OF3","formula_anonymous":"AB2C3","energy_above_hull":1.3416992245833337,"spacegroup":63},{"id":"jvasp-18554","created_at":"2022-09-04T14:36:06.593308Z","updated_at":"2022-09-04T14:36:06.593332Z","structure_string":"Ca3 Si1 Br2\n1.0\n4.126462 0.000000 -0.937391\n-0.212943 4.120963 -0.937391\n0.063891 0.067278 9.832439\nCa Si Br\n3 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.648079 0.648078 0.296157 Ca\n0.351921 0.351922 0.703843 Ca\n0.500000 0.500000 0.000000 Si\n0.815701 0.815701 0.631402 Br\n0.184299 0.184299 0.368598 Br\n","nsites":6,"nelements":3,"elements":["Ca","Si","Br"],"chemical_system":"Br-Ca-Si","density":3.0506467639004335,"density_atomic":0.03577367984538024,"volume":167.72107387143262,"volume_molar":16.833998587868756,"formula_full":"Ca3 Si1 Br2","formula_reduced":"Ca3SiBr2","formula_anonymous":"AB2C3","energy_above_hull":0.0996530116666666,"spacegroup":139},{"id":"jvasp-86279","created_at":"2022-09-04T14:36:02.346597Z","updated_at":"2022-09-04T14:36:02.346620Z","structure_string":"Ca3 Si1 Br2\n1.0\n4.363838 0.064290 10.666128\n2.149699 3.798158 10.666128\n0.108418 0.064290 11.523784\nCa Si Br\n3 1 2\ndirect\n0.124154 0.124154 0.124154 Ca\n0.000000 0.000000 0.000000 Ca\n0.875847 0.875846 0.875845 Ca\n0.500000 0.500000 0.499999 Si\n0.714702 0.714702 0.714701 Br\n0.285298 0.285298 0.285298 Br\n","nsites":6,"nelements":3,"elements":["Ca","Si","Br"],"chemical_system":"Br-Ca-Si","density":2.7872210837936993,"density_atomic":0.03268459524381166,"volume":183.57271843946148,"volume_molar":18.42501250230474,"formula_full":"Ca3 Si1 Br2","formula_reduced":"Ca3SiBr2","formula_anonymous":"AB2C3","energy_above_hull":0.1154113449999999,"spacegroup":166},{"id":"jvasp-48334","created_at":"2022-09-04T14:36:07.999882Z","updated_at":"2022-09-04T14:36:07.999899Z","structure_string":"Mn4 O2 F6\n1.0\n-6.121107 -0.000000 0.000000\n-3.060555 5.301022 0.000838\n0.000000 0.001004 -4.734932\nMn O F\n4 2 6\ndirect\n0.500000 0.499999 0.500000 Mn\n0.500000 -0.000000 0.500000 Mn\n-0.000000 0.499999 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.666660 0.666678 0.340583 O\n0.333340 0.333321 0.659416 O\n0.837617 0.837665 0.746002 F\n0.837588 0.324822 0.746101 F\n0.324717 0.837665 0.746002 F\n0.675283 0.162333 0.253997 F\n0.162412 0.675177 0.253898 F\n0.162384 0.162333 0.253997 F\n","nsites":12,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":3.9529368899461548,"density_atomic":0.07810483284730296,"volume":153.63966047351155,"volume_molar":7.710330514084124,"formula_full":"Mn4 O2 F6","formula_reduced":"Mn2OF3","formula_anonymous":"AB2C3","energy_above_hull":1.5606348050431036,"spacegroup":164},{"id":"jvasp-48412","created_at":"2022-09-04T14:36:06.408175Z","updated_at":"2022-09-04T14:36:06.408192Z","structure_string":"V6 O9 F3\n1.0\n4.654419 -0.135322 -0.000000\n-0.135322 4.654419 0.000000\n-0.000000 0.000000 8.742761\nV O F\n6 9 3\ndirect\n-0.000738 0.000738 0.998539 V\n-0.000738 0.000738 0.334794 V\n0.021838 0.978162 0.666667 V\n0.538032 0.461969 0.166667 V\n0.472417 0.527584 0.832152 V\n0.472417 0.527584 0.501182 V\n0.807174 0.192827 0.166667 O\n0.697831 0.706306 0.666667 O\n0.700439 0.697038 0.332700 O\n0.700439 0.697038 0.000634 O\n0.302963 0.299561 0.000634 O\n0.302963 0.299561 0.332700 O\n0.198176 0.801824 0.832094 O\n0.198176 0.801824 0.501239 O\n0.293694 0.302170 0.666667 O\n0.795384 0.204617 0.832228 F\n0.204154 0.795847 0.166667 F\n0.795384 0.204617 0.501105 F\n","nsites":18,"nelements":3,"elements":["V","O","F"],"chemical_system":"F-O-V","density":4.445649837311358,"density_atomic":0.09511745145743701,"volume":189.2397212519367,"volume_molar":6.331267993124034,"formula_full":"V6 O9 F3","formula_reduced":"V2O3F","formula_anonymous":"AB2C3","energy_above_hull":2.478856530416667,"spacegroup":38},{"id":"jvasp-48720","created_at":"2022-09-04T14:36:03.997878Z","updated_at":"2022-09-04T14:36:03.997907Z","structure_string":"Na2 Ni4 O6\n1.0\n5.251134 -0.113290 -0.069362\n0.934058 -4.461596 2.419840\n0.934058 0.126474 -5.073999\nNa Ni O\n2 4 6\ndirect\n0.500000 0.168403 0.831598 Na\n0.500000 0.831599 0.168402 Na\n0.000000 0.000000 0.000000 Ni\n0.000000 0.665013 0.334989 Ni\n0.000000 0.334989 0.665012 Ni\n0.500000 0.500001 0.500000 Ni\n0.258026 0.316261 0.316260 O\n0.197477 0.610452 0.914937 O\n0.197477 0.914938 0.610451 O\n0.802522 0.389550 0.085064 O\n0.802522 0.085064 0.389549 O\n0.741974 0.683741 0.683740 O\n","nsites":12,"nelements":3,"elements":["Na","Ni","O"],"chemical_system":"Na-Ni-O","density":5.384878819334773,"density_atomic":0.10328930470061479,"volume":116.1785340193947,"volume_molar":5.830362376293696,"formula_full":"Na2 Ni4 O6","formula_reduced":"NaNi2O3","formula_anonymous":"AB2C3","energy_above_hull":1.3987673833333334,"spacegroup":12},{"id":"jvasp-87919","created_at":"2022-09-04T14:36:04.470021Z","updated_at":"2022-09-04T14:36:04.470046Z","structure_string":"Li8 B4 Pt12\n1.0\n6.834770 0.000000 0.000000\n0.000000 6.834770 0.000000\n-0.000000 0.000000 6.834770\nLi B Pt\n8 4 12\ndirect\n0.302835 0.302835 0.302835 Li\n0.052835 0.447165 0.552835 Li\n0.552835 0.052835 0.447165 Li\n0.447165 0.552835 0.052835 Li\n0.197165 0.697165 0.802835 Li\n0.947165 0.947165 0.947165 Li\n0.802835 0.197165 0.697165 Li\n0.697165 0.802835 0.197165 Li\n0.625000 0.625000 0.625000 B\n0.125000 0.875000 0.375000 B\n0.875000 0.375000 0.125000 B\n0.375000 0.125000 0.875000 B\n0.125000 0.311920 0.938080 Pt\n0.188080 0.061920 0.625000 Pt\n0.438080 0.375000 0.688080 Pt\n0.061920 0.625000 0.188080 Pt\n0.938080 0.125000 0.311920 Pt\n0.311920 0.938080 0.125000 Pt\n0.688080 0.438080 0.375000 Pt\n0.561920 0.875000 0.811920 Pt\n0.625000 0.188080 0.061920 Pt\n0.375000 0.688080 0.438080 Pt\n0.875000 0.811920 0.561920 Pt\n0.811920 0.561920 0.875000 Pt\n","nsites":24,"nelements":3,"elements":["Li","B","Pt"],"chemical_system":"B-Li-Pt","density":12.689019091874341,"density_atomic":0.0751691307616281,"volume":319.2799990744523,"volume_molar":8.011454567829258,"formula_full":"Li8 B4 Pt12","formula_reduced":"Li2BPt3","formula_anonymous":"AB2C3","energy_above_hull":2.4438927972222224,"spacegroup":212},{"id":"jvasp-95420","created_at":"2022-09-04T14:36:07.061710Z","updated_at":"2022-09-04T14:36:07.061730Z","structure_string":"Na8 Te4 O12\n1.0\n4.938864 0.003702 0.000000\n-0.193363 6.864796 0.000000\n0.000000 0.000000 10.243247\nNa Te O\n8 4 12\ndirect\n0.744313 0.902732 0.253855 Na\n0.255688 0.597269 0.753856 Na\n0.255687 0.097268 0.746145 Na\n0.744312 0.402731 0.246145 Na\n0.246105 0.138373 0.413423 Na\n0.753894 0.361627 0.913423 Na\n0.753895 0.861628 0.586578 Na\n0.246105 0.638373 0.086578 Na\n0.261038 0.164196 0.082551 Te\n0.738962 0.835804 0.917449 Te\n0.738962 0.335804 0.582551 Te\n0.261038 0.664196 0.417449 Te\n0.353632 0.853490 0.906166 O\n0.231573 0.353887 0.219079 O\n0.768427 0.146113 0.719079 O\n0.768427 0.646113 0.780921 O\n0.231573 0.853887 0.280921 O\n0.752086 0.163151 0.436548 O\n0.247913 0.336849 0.936548 O\n0.247913 0.836849 0.563453 O\n0.752087 0.663151 0.063452 O\n0.646368 0.146510 0.093835 O\n0.353631 0.353490 0.593835 O\n0.646368 0.646510 0.406166 O\n","nsites":24,"nelements":3,"elements":["Na","Te","O"],"chemical_system":"Na-O-Te","density":4.237734038323906,"density_atomic":0.06910504021812247,"volume":347.2973885008479,"volume_molar":8.714473996385465,"formula_full":"Na8 Te4 O12","formula_reduced":"Na2TeO3","formula_anonymous":"AB2C3","energy_above_hull":0.968949377777778,"spacegroup":14}]}