{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-created_at&page=4597","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-created_at&page=4595","results":[{"id":"jvasp-93324","created_at":"2022-09-04T14:35:42.275315Z","updated_at":"2022-09-04T14:35:42.275339Z","structure_string":"Mg4 Cd2\n1.0\n3.250074 0.000000 -0.000000\n-1.625037 2.814647 -0.000000\n-0.000000 -0.000000 14.606751\nMg Cd\n4 2\ndirect\n0.333332 0.666668 0.913650 Mg\n0.333332 0.666668 0.586350 Mg\n0.666666 0.333333 0.413650 Mg\n0.666666 0.333333 0.086350 Mg\n0.666666 0.333333 0.750000 Cd\n0.333332 0.666668 0.250000 Cd\n","nsites":6,"nelements":2,"elements":["Mg","Cd"],"chemical_system":"Cd-Mg","density":4.002126408082383,"density_atomic":0.04490352546024598,"volume":133.6197979669085,"volume_molar":13.41128719465808,"formula_full":"Mg4 Cd2","formula_reduced":"Mg2Cd","formula_anonymous":"AB2","energy_above_hull":0.2922841176470587,"spacegroup":194},{"id":"jvasp-70918","created_at":"2022-09-04T14:35:42.271945Z","updated_at":"2022-09-04T14:35:42.271972Z","structure_string":"Be1 Fe1 Pd2\n1.0\n2.734339 -0.000000 -0.000000\n0.000000 2.734339 -0.000000\n-0.000000 -0.000000 6.671697\nBe Fe Pd\n1 1 2\ndirect\n0.000000 0.000000 0.503870 Be\n0.500000 0.500000 0.714290 Fe\n0.000000 0.000000 0.982205 Pd\n0.500000 0.500000 0.299636 Pd\n","nsites":4,"nelements":3,"elements":["Be","Fe","Pd"],"chemical_system":"Be-Fe-Pd","density":9.24441731032871,"density_atomic":0.08018976916549174,"volume":49.88167495213753,"volume_molar":7.509861697658462,"formula_full":"Be1 Fe1 Pd2","formula_reduced":"BeFePd2","formula_anonymous":"ABC2","energy_above_hull":2.09411825,"spacegroup":99},{"id":"jvasp-66027","created_at":"2022-09-04T14:35:42.269808Z","updated_at":"2022-09-04T14:35:42.269839Z","structure_string":"Ba1 Ge1 Br1\n1.0\n-0.000000 3.958839 3.958839\n3.958839 0.000000 3.958839\n3.958839 3.958839 -0.000000\nBa Ge Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Br\n","nsites":3,"nelements":3,"elements":["Ba","Ge","Br"],"chemical_system":"Ba-Br-Ge","density":3.8790050993103513,"density_atomic":0.024176183258978034,"volume":124.0890659978731,"volume_molar":24.909394073870722,"formula_full":"Ba1 Ge1 Br1","formula_reduced":"BaGeBr","formula_anonymous":"ABC","energy_above_hull":0.0385286533333332,"spacegroup":216},{"id":"jvasp-21206","created_at":"2022-09-04T14:35:42.266172Z","updated_at":"2022-09-04T14:35:42.266194Z","structure_string":"H1\n1.0\n-2.223347 2.223347 2.223347\n2.223347 -2.223347 2.223347\n2.223347 2.223347 -2.223347\nH\n1\ndirect\n0.000000 0.000000 0.000000 H\n","nsites":1,"nelements":1,"elements":["H"],"chemical_system":"H","density":0.03807167989875114,"density_atomic":0.02274669279909258,"volume":43.962434839753605,"volume_molar":26.474797075732425,"formula_full":"H1","formula_reduced":"H","formula_anonymous":"A","energy_above_hull":2.50383,"spacegroup":229},{"id":"jvasp-99278","created_at":"2022-09-04T14:35:42.265371Z","updated_at":"2022-09-04T14:35:42.265398Z","structure_string":"Li8 Cu16 O16\n1.0\n5.738455 0.000000 0.000000\n-0.000000 5.738455 0.000000\n-0.000000 -0.000000 12.533072\nLi Cu O\n8 16 16\ndirect\n0.506054 0.750001 0.679125 Li\n0.493947 0.250000 0.320874 Li\n0.750001 0.993948 0.179125 Li\n0.750001 0.506054 0.179125 Li\n0.006053 0.250000 0.320874 Li\n0.250000 0.493947 0.820874 Li\n0.250000 0.006053 0.820874 Li\n0.993948 0.750001 0.679125 Li\n0.750001 0.002294 0.847389 Cu\n0.750001 0.497706 0.847389 Cu\n0.750001 0.001708 0.492566 Cu\n0.998293 0.250000 0.007434 Cu\n0.497706 0.750001 0.347389 Cu\n0.001708 0.750001 0.992565 Cu\n0.501708 0.250000 0.007434 Cu\n0.250000 0.502295 0.152611 Cu\n0.250000 0.998293 0.507434 Cu\n0.250000 0.997707 0.152611 Cu\n0.750001 0.498293 0.492566 Cu\n0.002294 0.750001 0.347389 Cu\n0.250000 0.501708 0.507434 Cu\n0.502295 0.250000 0.652611 Cu\n0.498293 0.750001 0.992565 Cu\n0.997707 0.250000 0.652611 Cu\n0.250000 0.007979 0.657539 O\n0.250000 0.492022 0.657539 O\n0.492022 0.250000 0.157539 O\n0.992381 0.250000 0.858846 O\n0.507979 0.750001 0.842461 O\n0.750001 0.992022 0.342461 O\n0.492380 0.750001 0.141154 O\n0.507621 0.250000 0.858846 O\n0.250000 0.507621 0.358846 O\n0.750001 0.507979 0.342461 O\n0.007979 0.250000 0.157539 O\n0.250000 0.992381 0.358846 O\n0.750001 0.007620 0.641154 O\n0.992022 0.750001 0.842461 O\n0.007620 0.750001 0.141154 O\n0.750001 0.492380 0.641154 O\n","nsites":40,"nelements":3,"elements":["Li","Cu","O"],"chemical_system":"Cu-Li-O","density":5.344202002567576,"density_atomic":0.09691979705230494,"volume":412.71237885912103,"volume_molar":6.213530097210187,"formula_full":"Li8 Cu16 O16","formula_reduced":"Li(CuO)2","formula_anonymous":"AB2C2","energy_above_hull":0.7759155799999997,"spacegroup":137},{"id":"jvasp-86657","created_at":"2022-09-04T14:35:42.261573Z","updated_at":"2022-09-04T14:35:42.261602Z","structure_string":"Eu2 Sn2\n1.0\n4.340119 0.000000 -0.000000\n-0.000000 4.194883 -1.754096\n0.000000 0.127644 6.198294\nEu Sn\n2 2\ndirect\n0.750000 0.134370 0.268741 Eu\n0.250000 0.865628 0.731258 Eu\n0.250000 0.593332 0.186666 Sn\n0.750000 0.406666 0.813332 Sn\n","nsites":4,"nelements":2,"elements":["Eu","Sn"],"chemical_system":"Eu-Sn","density":7.897837656633674,"density_atomic":0.035143301598463766,"volume":113.819698721046,"volume_molar":17.135956173973273,"formula_full":"Eu2 Sn2","formula_reduced":"EuSn","formula_anonymous":"AB","energy_above_hull":0.2472458499999998,"spacegroup":63},{"id":"jvasp-42435","created_at":"2022-09-04T14:35:42.261528Z","updated_at":"2022-09-04T14:35:42.261541Z","structure_string":"Li2 Ti1 Mn1 O4\n1.0\n5.211448 -0.115085 0.000000\n2.177309 4.736218 0.000000\n-3.694379 -2.310567 2.860994\nLi Ti Mn O\n2 1 1 4\ndirect\n0.250000 0.750000 0.499999 Li\n0.500000 0.500001 -0.000000 Li\n0.750000 0.250000 0.499999 Ti\n0.000000 0.000000 0.000000 Mn\n0.514944 0.014944 0.499999 O\n0.250211 0.250211 -0.000000 O\n0.985055 0.485056 0.499999 O\n0.749789 0.749790 -0.000000 O\n","nsites":8,"nelements":4,"elements":["Li","Ti","Mn","O"],"chemical_system":"Li-Mn-O-Ti","density":4.206071060744319,"density_atomic":0.11214921769635999,"volume":71.33353370025027,"volume_molar":5.369757260638885,"formula_full":"Li2 Ti1 Mn1 O4","formula_reduced":"Li2TiMnO4","formula_anonymous":"ABC2D4","energy_above_hull":2.4721474468390805,"spacegroup":119},{"id":"jvasp-85826","created_at":"2022-09-04T14:35:42.261209Z","updated_at":"2022-09-04T14:35:42.261255Z","structure_string":"Ni6 S4\n1.0\n-3.250068 0.000000 0.000000\n0.000000 -0.000019 6.861238\n-1.625034 5.577546 -0.000018\nNi S\n6 4\ndirect\n0.461964 0.250002 0.076072 Ni\n0.538035 0.749998 0.923929 Ni\n0.665005 0.432958 0.669990 Ni\n0.334998 0.567043 0.330004 Ni\n0.665000 0.067034 0.670000 Ni\n0.334996 0.932966 0.330006 Ni\n0.000000 0.000001 0.000000 S\n0.259891 0.250000 0.480217 S\n0.740108 0.750000 0.519785 S\n0.000000 0.500001 -0.000000 S\n","nsites":10,"nelements":2,"elements":["Ni","S"],"chemical_system":"Ni-S","density":6.414051539147123,"density_atomic":0.08040108460004418,"volume":124.3764316084177,"volume_molar":7.490123783724046,"formula_full":"Ni6 S4","formula_reduced":"Ni3S2","formula_anonymous":"A2B3","energy_above_hull":1.41387544,"spacegroup":63},{"id":"jvasp-98798","created_at":"2022-09-04T14:35:42.257554Z","updated_at":"2022-09-04T14:35:42.257579Z","structure_string":"K4 Mo4 P8 O32\n1.0\n5.084428 0.040887 0.000000\n-0.126360 11.402292 0.000000\n0.000000 0.000000 11.761724\nK Mo P O\n4 4 8 32\ndirect\n0.717665 0.061209 0.633383 K\n0.782336 0.438792 0.133383 K\n0.282335 0.938791 0.366617 K\n0.217665 0.561208 0.866616 K\n0.741459 0.832907 0.878401 Mo\n0.758541 0.667093 0.378401 Mo\n0.258541 0.167093 0.121599 Mo\n0.241459 0.332907 0.621599 Mo\n0.254437 0.860638 0.061036 P\n0.754437 0.360638 0.438964 P\n0.745564 0.139362 0.938963 P\n0.245563 0.639362 0.561036 P\n0.264227 0.641778 0.192807 P\n0.764227 0.141779 0.307193 P\n0.735773 0.358222 0.807192 P\n0.235773 0.858221 0.692807 P\n0.954236 0.654431 0.528625 O\n0.454236 0.154431 0.971374 O\n0.045764 0.345569 0.471374 O\n0.778257 0.425523 0.914080 O\n0.721744 0.074477 0.414080 O\n0.221744 0.574477 0.085919 O\n0.688845 0.688778 0.856039 O\n0.811156 0.811222 0.356039 O\n0.311156 0.311222 0.143961 O\n0.188844 0.188778 0.643960 O\n0.424179 0.891079 0.790598 O\n0.075821 0.608920 0.290598 O\n0.545765 0.845569 0.028626 O\n0.278257 0.925523 0.585919 O\n0.287778 0.717710 0.674412 O\n0.578117 0.308776 0.532145 O\n0.712223 0.282290 0.325588 O\n0.787778 0.217710 0.825588 O\n0.447198 0.364903 0.765840 O\n0.052803 0.135097 0.265840 O\n0.552803 0.635097 0.234160 O\n0.947198 0.864903 0.734160 O\n0.575821 0.108921 0.209402 O\n0.921883 0.191224 0.032146 O\n0.421883 0.691224 0.467854 O\n0.078117 0.808776 0.967854 O\n0.315568 0.517183 0.598793 O\n0.184432 0.982817 0.098793 O\n0.684432 0.482817 0.401206 O\n0.815568 0.017183 0.901206 O\n0.212222 0.782290 0.174412 O\n0.924179 0.391080 0.709402 O\n","nsites":48,"nelements":4,"elements":["K","Mo","P","O"],"chemical_system":"K-Mo-O-P","density":3.165360261854304,"density_atomic":0.0703877838464239,"volume":681.9365147896849,"volume_molar":8.55566183634855,"formula_full":"K4 Mo4 P8 O32","formula_reduced":"KMo(PO4)2","formula_anonymous":"ABC2D8","energy_above_hull":2.8909177416666663,"spacegroup":14},{"id":"jvasp-64512","created_at":"2022-09-04T14:35:42.256788Z","updated_at":"2022-09-04T14:35:42.256815Z","structure_string":"Ba4 Hg1 Sb1\n1.0\n-0.000000 4.998321 4.998321\n4.998321 0.000000 4.998321\n4.998321 4.998321 -0.000000\nBa Hg Sb\n4 1 1\ndirect\n0.120928 0.626357 0.626357 Ba\n0.626357 0.626357 0.626357 Ba\n0.626357 0.120928 0.626357 Ba\n0.626357 0.626357 0.120928 Ba\n0.250000 0.250000 0.250000 Hg\n0.000000 0.000000 0.000000 Sb\n","nsites":6,"nelements":3,"elements":["Ba","Hg","Sb"],"chemical_system":"Ba-Hg-Sb","density":5.795525098522649,"density_atomic":0.02402419384676843,"volume":249.7482345617636,"volume_molar":25.06698371820729,"formula_full":"Ba4 Hg1 Sb1","formula_reduced":"Ba4HgSb","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-65769","created_at":"2022-09-04T14:35:42.255119Z","updated_at":"2022-09-04T14:35:42.255150Z","structure_string":"Ba2 Sb1 Br1\n1.0\n0.000000 4.176257 4.176257\n4.176257 -0.000000 4.176257\n4.176257 4.176257 -0.000000\nBa Sb Br\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Br\n","nsites":4,"nelements":3,"elements":["Ba","Sb","Br"],"chemical_system":"Ba-Br-Sb","density":5.4294325944624235,"density_atomic":0.027457964924343846,"volume":145.67722010794967,"volume_molar":21.932218125389383,"formula_full":"Ba2 Sb1 Br1","formula_reduced":"Ba2SbBr","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-75867","created_at":"2022-09-04T14:35:42.254369Z","updated_at":"2022-09-04T14:35:42.254405Z","structure_string":"Na1 As1 Ru2\n1.0\n0.000000 3.122426 3.122426\n3.122426 -0.000000 3.122426\n3.122426 3.122426 0.000000\nNa As Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Na\n0.500001 0.500001 0.500001 As\n0.000000 0.000000 0.000000 Ru\n0.750001 0.750001 0.750001 Ru\n","nsites":4,"nelements":3,"elements":["Na","As","Ru"],"chemical_system":"As-Na-Ru","density":8.18348425203538,"density_atomic":0.06569820922102504,"volume":60.884460131067044,"volume_molar":9.166369725147346,"formula_full":"Na1 As1 Ru2","formula_reduced":"NaAsRu2","formula_anonymous":"ABC2","energy_above_hull":2.7509379375000003,"spacegroup":216}]}