{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_reduced&page=4338","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_reduced&page=4336","results":[{"id":"jvasp-91265","created_at":"2022-09-04T14:36:02.892981Z","updated_at":"2022-09-04T14:36:02.893003Z","structure_string":"Y4 Mn2 Ni2 O12\n1.0\n5.224258 0.000000 0.025807\n0.000000 5.581597 0.000000\n0.038348 0.000000 7.492605\nY Mn Ni O\n4 2 2 12\ndirect\n0.980177 0.074266 0.249166 Y\n0.019824 0.925735 0.750835 Y\n0.480177 0.425734 0.749166 Y\n0.519824 0.574266 0.250835 Y\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500001 Ni\n0.605728 0.033344 0.755967 O\n0.894273 0.533344 0.744034 O\n0.198991 0.187937 0.948919 O\n0.682453 0.293656 0.055088 O\n0.817548 0.793656 0.444913 O\n0.317548 0.706345 0.944913 O\n0.182453 0.206345 0.555088 O\n0.698991 0.312064 0.448919 O\n0.801010 0.812064 0.051082 O\n0.301010 0.687937 0.551082 O\n0.105728 0.466656 0.255967 O\n0.394272 0.966657 0.244034 O\n","nsites":20,"nelements":4,"elements":["Y","Mn","Ni","O"],"chemical_system":"Mn-Ni-O-Y","density":5.889495423428815,"density_atomic":0.09154297984094754,"volume":218.47661103832584,"volume_molar":6.57848452220284,"formula_full":"Y4 Mn2 Ni2 O12","formula_reduced":"Y2MnNiO6","formula_anonymous":"ABC2D6","energy_above_hull":2.789667154137931,"spacegroup":14},{"id":"jvasp-112616","created_at":"2022-09-04T14:38:42.556145Z","updated_at":"2022-09-04T14:38:42.556172Z","structure_string":"Y4 Mn2 S8\n1.0\n6.451781 0.002372 0.000000\n-5.343949 3.614926 0.000000\n-0.000000 -0.000000 12.805370\nY Mn S\n4 2 8\ndirect\n0.382049 0.617952 0.785143 Y\n0.617951 0.382049 0.285143 Y\n0.138822 0.861180 0.582074 Y\n0.861179 0.138820 0.082074 Y\n0.126309 0.873692 0.946342 Mn\n0.873691 0.126308 0.446342 Mn\n0.792217 0.207782 0.635013 S\n0.207783 0.792218 0.135013 S\n0.488453 0.511547 0.995093 S\n0.511547 0.488453 0.495093 S\n0.759256 0.240743 0.894901 S\n0.240744 0.759257 0.394901 S\n0.039941 0.960060 0.769432 S\n0.960059 0.039940 0.269432 S\n","nsites":14,"nelements":3,"elements":["Y","Mn","S"],"chemical_system":"Mn-S-Y","density":4.012276777470868,"density_atomic":0.04685121968453002,"volume":298.8182611737366,"volume_molar":12.853754503190604,"formula_full":"Y4 Mn2 S8","formula_reduced":"Y2MnS4","formula_anonymous":"AB2C4","energy_above_hull":2.621829734482758,"spacegroup":36},{"id":"jvasp-59602","created_at":"2022-09-04T14:36:48.962201Z","updated_at":"2022-09-04T14:36:48.962229Z","structure_string":"Y4 Mo4 O14\n1.0\n6.311961 -0.000000 3.644212\n2.103987 5.950973 3.644212\n-0.000000 -0.000000 7.288424\nY Mo O\n4 4 14\ndirect\n0.499999 0.000000 0.500000 Y\n0.000000 0.500000 0.500000 Y\n0.500000 0.500000 -0.000000 Y\n0.500000 0.500000 0.499999 Y\n0.000000 0.500000 -0.000000 Mo\n0.000000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n0.499999 0.000000 -0.000000 Mo\n0.662791 0.087210 0.087209 O\n0.662791 0.087210 0.662790 O\n0.087211 0.662789 0.087210 O\n0.625000 0.625000 0.624999 O\n0.912791 0.337210 0.337209 O\n0.337211 0.912789 0.337209 O\n0.337210 0.337210 0.912789 O\n0.912791 0.912789 0.337209 O\n0.912791 0.337210 0.912790 O\n0.087211 0.662789 0.662791 O\n0.337211 0.912789 0.912790 O\n0.374999 0.375000 0.375000 O\n0.662790 0.662789 0.087210 O\n0.087210 0.087210 0.662789 O\n","nsites":22,"nelements":3,"elements":["Y","Mo","O"],"chemical_system":"Mo-O-Y","density":5.843304969230655,"density_atomic":0.08035941465062435,"volume":273.77003796815325,"volume_molar":7.494007747794379,"formula_full":"Y4 Mo4 O14","formula_reduced":"Y2Mo2O7","formula_anonymous":"A2B2C7","energy_above_hull":3.553166109090909,"spacegroup":227},{"id":"jvasp-12933","created_at":"2022-09-04T14:37:10.378896Z","updated_at":"2022-09-04T14:37:10.378915Z","structure_string":"Y4 N2 Cl6\n1.0\n3.749212 0.000000 0.771663\n1.416510 7.398493 2.611548\n-0.032304 -0.027228 9.650786\nY N Cl\n4 2 6\ndirect\n0.136036 0.022703 0.705226 Y\n0.863965 0.977296 0.294774 Y\n0.410904 0.227837 0.950357 Y\n0.589097 0.772162 0.049643 Y\n0.575787 0.006014 0.842413 N\n0.424214 0.993986 0.157587 N\n0.946918 0.366481 0.739682 Cl\n0.053083 0.633518 0.260319 Cl\n0.338166 0.806321 0.517348 Cl\n0.661835 0.193679 0.482653 Cl\n0.227644 0.658769 0.885947 Cl\n0.772357 0.341231 0.114054 Cl\n","nsites":12,"nelements":3,"elements":["Y","N","Cl"],"chemical_system":"Cl-N-Y","density":3.6933883734968322,"density_atomic":0.04475611768208812,"volume":268.11977046888785,"volume_molar":13.455458319187782,"formula_full":"Y4 N2 Cl6","formula_reduced":"Y2NCl3","formula_anonymous":"AB2C3","energy_above_hull":1.7034277254166668,"spacegroup":12},{"id":"jvasp-49694","created_at":"2022-09-04T14:37:14.432210Z","updated_at":"2022-09-04T14:37:14.432229Z","structure_string":"Y4 Ni4 O14\n1.0\n6.056538 0.000000 3.496744\n2.018846 5.710159 3.496744\n-0.000000 -0.000000 6.993488\nY Ni O\n4 4 14\ndirect\n0.500000 -0.000000 0.500000 Y\n0.000000 0.500000 0.500000 Y\n0.500000 0.500000 -0.000001 Y\n0.500000 0.500000 0.499999 Y\n0.000000 0.500000 -0.000000 Ni\n0.500000 -0.000000 -0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.670086 0.079914 0.079913 O\n0.079914 0.079914 0.670086 O\n0.670087 0.670086 0.079913 O\n0.920086 0.329914 0.329913 O\n0.329915 0.920086 0.329913 O\n0.329914 0.329914 0.920086 O\n0.329915 0.920086 0.920085 O\n0.920086 0.329914 0.920085 O\n0.079914 0.670086 0.670086 O\n0.670086 0.079914 0.670086 O\n0.375000 0.375000 0.375000 O\n0.625000 0.625000 0.624999 O\n0.920087 0.920086 0.329913 O\n0.079914 0.670086 0.079913 O\n","nsites":22,"nelements":3,"elements":["Y","Ni","O"],"chemical_system":"Ni-O-Y","density":5.591319394768696,"density_atomic":0.09096120374267629,"volume":241.86135511395233,"volume_molar":6.62055965863894,"formula_full":"Y4 Ni4 O14","formula_reduced":"Y2Ni2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.519474563636363,"spacegroup":227},{"id":"jvasp-92543","created_at":"2022-09-04T14:36:30.852431Z","updated_at":"2022-09-04T14:36:30.852458Z","structure_string":"Y2 Ni2 Sn1\n1.0\n-4.259278 0.000000 0.000000\n-2.129639 -2.848399 4.121008\n-2.129639 2.848399 4.121008\nY Ni Sn\n2 2 1\ndirect\n0.795864 0.704137 0.704137 Y\n0.204137 0.295863 0.295863 Y\n0.500000 0.291553 0.708447 Ni\n0.500000 0.708447 0.291553 Ni\n0.000000 0.000000 0.000000 Sn\n","nsites":5,"nelements":3,"elements":["Y","Ni","Sn"],"chemical_system":"Ni-Sn-Y","density":6.873582942694388,"density_atomic":0.050003423487009084,"volume":99.99315349476026,"volume_molar":12.043456907634644,"formula_full":"Y2 Ni2 Sn1","formula_reduced":"Y2Ni2Sn","formula_anonymous":"AB2C2","energy_above_hull":1.64062348,"spacegroup":71},{"id":"jvasp-63283","created_at":"2022-09-04T14:36:14.732874Z","updated_at":"2022-09-04T14:36:14.732903Z","structure_string":"Y2 Ni3 B6\n1.0\n3.861492 -4.331782 0.000000\n3.861492 4.331782 0.000000\n0.000000 0.000000 3.498050\nY Ni B\n2 3 6\ndirect\n0.724665 0.275334 0.000000 Y\n0.275334 0.724665 0.000000 Y\n0.000000 0.000000 0.500000 Ni\n0.226895 0.226895 0.000000 Ni\n0.773104 0.773104 0.000000 Ni\n0.086766 0.388298 0.500000 B\n0.913234 0.611702 0.500000 B\n0.611702 0.913234 0.500000 B\n0.388298 0.086766 0.500000 B\n0.386590 0.386590 0.500000 B\n0.613409 0.613409 0.500000 B\n","nsites":11,"nelements":3,"elements":["Y","Ni","B"],"chemical_system":"B-Ni-Y","density":5.942023573366597,"density_atomic":0.09399720604067341,"volume":117.0247549192069,"volume_molar":6.40672315025424,"formula_full":"Y2 Ni3 B6","formula_reduced":"Y2(NiB2)3","formula_anonymous":"A2B3C6","energy_above_hull":3.883648509090909,"spacegroup":65},{"id":"jvasp-41554","created_at":"2022-09-04T14:37:42.273267Z","updated_at":"2022-09-04T14:37:42.273296Z","structure_string":"Y2 Ni1 Ir1\n1.0\n0.000000 3.403463 3.403463\n3.403463 0.000000 3.403463\n3.403463 3.403463 0.000000\nY Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.499999 0.499999 0.499999 Y\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n","nsites":4,"nelements":3,"elements":["Y","Ni","Ir"],"chemical_system":"Ir-Ni-Y","density":9.028838238831858,"density_atomic":0.050730237412352726,"volume":78.84843840738674,"volume_molar":11.870909869886829,"formula_full":"Y2 Ni1 Ir1","formula_reduced":"Y2NiIr","formula_anonymous":"ABC2","energy_above_hull":2.6782011,"spacegroup":225},{"id":"jvasp-57843","created_at":"2022-09-04T14:37:13.173970Z","updated_at":"2022-09-04T14:37:13.173991Z","structure_string":"Y6 O9\n1.0\n3.499220 0.000000 0.000000\n-1.749610 6.886817 -1.245640\n0.000000 0.008076 8.643048\nY O\n6 9\ndirect\n0.635262 0.270525 0.487390 Y\n0.364738 0.729476 0.512611 Y\n0.032920 0.065841 0.813491 Y\n0.690471 0.380943 0.137118 Y\n0.309530 0.619058 0.862882 Y\n0.967081 0.934160 0.186509 Y\n0.127782 0.255564 0.282426 O\n0.825422 0.650845 0.030483 O\n0.793422 0.586844 0.376358 O\n0.471034 0.942067 0.343281 O\n0.528967 0.057934 0.656719 O\n0.500000 0.000000 0.000000 O\n0.174578 0.349156 0.969518 O\n0.206578 0.413157 0.623642 O\n0.872218 0.744437 0.717575 O\n","nsites":15,"nelements":2,"elements":["Y","O"],"chemical_system":"O-Y","density":5.399868981451839,"density_atomic":0.07200475068431143,"volume":208.31958804724027,"volume_molar":8.363532548571296,"formula_full":"Y6 O9","formula_reduced":"Y2O3","formula_anonymous":"A2B3","energy_above_hull":2.01278228,"spacegroup":12},{"id":"jvasp-49913","created_at":"2022-09-04T14:36:49.585889Z","updated_at":"2022-09-04T14:36:49.585923Z","structure_string":"Y4 O6\n1.0\n5.805311 -0.000000 -0.000000\n-2.902654 1.675849 5.036274\n2.902654 -5.027547 -0.000000\nY O\n4 6\ndirect\n0.141501 0.424501 0.141500 Y\n0.358499 0.075499 0.358500 Y\n0.641499 0.924500 0.641499 Y\n0.858500 0.575499 0.858501 Y\n0.250000 0.749999 0.542791 O\n0.042791 0.250000 0.750000 O\n0.457209 0.250000 0.042791 O\n0.542791 0.749999 0.957209 O\n0.957209 0.749999 0.250000 O\n0.750000 0.250000 0.457209 O\n","nsites":10,"nelements":2,"elements":["Y","O"],"chemical_system":"O-Y","density":5.1018900116909744,"density_atomic":0.06803133919960717,"volume":146.9910796649104,"volume_molar":8.85200972206464,"formula_full":"Y4 O6","formula_reduced":"Y2O3","formula_anonymous":"A2B3","energy_above_hull":2.01605828,"spacegroup":167},{"id":"jvasp-20793","created_at":"2022-09-04T14:38:32.825497Z","updated_at":"2022-09-04T14:38:32.825532Z","structure_string":"Y16 O24\n1.0\n8.691290 -0.000000 -3.072835\n-4.345645 7.526878 -3.072835\n0.000000 -0.000000 9.218505\nY O\n16 24\ndirect\n0.500000 0.500000 0.500000 Y\n0.250000 0.717595 0.467595 Y\n0.032406 0.750000 0.782406 Y\n0.782405 0.032405 0.750000 Y\n0.467595 0.250000 0.717595 Y\n0.717595 0.467595 0.250000 Y\n0.750000 0.282405 0.532405 Y\n0.750001 0.782406 0.032405 Y\n0.217595 0.967595 0.250000 Y\n0.532406 0.750000 0.282405 Y\n0.282406 0.532406 0.750000 Y\n0.250000 0.217595 0.967595 Y\n0.000000 0.500000 -0.000000 Y\n0.500000 0.000000 -0.000000 Y\n0.967595 0.250000 0.217594 Y\n0.000000 0.000000 0.500000 Y\n0.957170 0.727971 0.988763 O\n0.542830 0.531594 0.770801 O\n0.239208 0.968407 0.511237 O\n0.729199 0.260793 0.772029 O\n0.031594 0.488763 0.760793 O\n0.988764 0.957170 0.727970 O\n0.227971 0.270801 0.739208 O\n0.272029 0.011237 0.042830 O\n0.229199 0.457170 0.468407 O\n0.457170 0.468407 0.229199 O\n0.760793 0.031593 0.488763 O\n0.270801 0.739208 0.227971 O\n0.042830 0.272029 0.011237 O\n0.260793 0.772029 0.729199 O\n0.488764 0.760793 0.031593 O\n0.011237 0.042830 0.272029 O\n0.468407 0.229199 0.457170 O\n0.968407 0.511237 0.239207 O\n0.772030 0.729199 0.260792 O\n0.727972 0.988764 0.957170 O\n0.770801 0.542830 0.531593 O\n0.531594 0.770801 0.542830 O\n0.739208 0.227971 0.270801 O\n0.511237 0.239208 0.968407 O\n","nsites":40,"nelements":2,"elements":["Y","O"],"chemical_system":"O-Y","density":4.9741909080727975,"density_atomic":0.06632853082588165,"volume":603.058736594115,"volume_molar":9.079261495793808,"formula_full":"Y16 O24","formula_reduced":"Y2O3","formula_anonymous":"A2B3","energy_above_hull":2.00725628,"spacegroup":206},{"id":"jvasp-43789","created_at":"2022-09-04T14:36:00.847487Z","updated_at":"2022-09-04T14:36:00.847514Z","structure_string":"Y8 O12\n1.0\n0.000000 9.127770 -0.002541\n3.391807 0.000000 0.000000\n0.000000 -2.647333 -8.931017\nY O\n8 12\ndirect\n0.818847 0.250000 0.986452 Y\n0.450877 0.250000 0.814840 Y\n0.061604 0.250000 0.671703 Y\n0.666850 0.750001 0.585599 Y\n0.333151 0.250000 0.414402 Y\n0.938397 0.750001 0.328298 Y\n0.549123 0.750001 0.185160 Y\n0.181153 0.750001 0.013548 Y\n0.762335 0.250000 0.220730 O\n0.308613 0.750001 0.256713 O\n0.578700 0.250000 0.402664 O\n0.906270 0.750001 0.566753 O\n0.093730 0.250000 0.433247 O\n0.607001 0.750001 0.953641 O\n0.691387 0.250000 0.743287 O\n0.237666 0.750001 0.779270 O\n0.393000 0.250000 0.046359 O\n0.035846 0.250000 0.899040 O\n0.421300 0.750001 0.597337 O\n0.964154 0.750001 0.100961 O\n","nsites":20,"nelements":2,"elements":["Y","O"],"chemical_system":"O-Y","density":5.42399768159065,"density_atomic":0.07232649571994088,"volume":276.5238354342926,"volume_molar":8.32632730240193,"formula_full":"Y8 O12","formula_reduced":"Y2O3","formula_anonymous":"A2B3","energy_above_hull":2.02071228,"spacegroup":11}]}