{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=487","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=485","results":[{"id":"jvasp-16489","created_at":"2022-09-04T14:37:56.251302Z","updated_at":"2022-09-04T14:37:56.251327Z","structure_string":"P4 W2\n1.0\n3.133049 -0.000000 0.759624\n1.473436 4.277349 0.763754\n0.015966 0.014340 6.775046\nP W\n4 2\ndirect\n0.138025 0.750010 0.973944 P\n0.861978 0.249990 0.026055 P\n0.401641 0.799054 0.397666 P\n0.598362 0.200946 0.602333 P\n0.842047 0.609398 0.706512 W\n0.157956 0.390602 0.293487 W\n","nsites":6,"nelements":2,"elements":["P","W"],"chemical_system":"P-W","density":8.997470639677214,"density_atomic":0.06613521363455567,"volume":90.7232270111697,"volume_molar":9.105800721044968,"formula_full":"P4 W2","formula_reduced":"P2W","formula_anonymous":"AB2","energy_above_hull":4.040943666666667,"spacegroup":12},{"id":"jvasp-36836","created_at":"2022-09-04T14:37:56.413231Z","updated_at":"2022-09-04T14:37:56.413262Z","structure_string":"Pd2 Au2 O4\n1.0\n1.157758 2.742943 0.731745\n5.248566 -2.713752 1.868276\n0.052644 -0.020404 -6.429530\nPd Au O\n2 2 4\ndirect\n0.000001 0.500000 -0.000000 Pd\n0.500000 0.000000 0.000000 Pd\n0.264108 0.216934 0.528214 Au\n0.735894 0.783066 0.471786 Au\n0.564087 0.721444 0.128172 O\n0.902406 0.830384 0.804810 O\n0.097595 0.169616 0.195190 O\n0.435915 0.278556 0.871828 O\n","nsites":8,"nelements":3,"elements":["Pd","Au","O"],"chemical_system":"Au-O-Pd","density":9.847965897392436,"density_atomic":0.07073157309288801,"volume":113.10366290728507,"volume_molar":8.514077231240769,"formula_full":"Pd2 Au2 O4","formula_reduced":"PdAuO2","formula_anonymous":"ABC2","energy_above_hull":1.6338825675,"spacegroup":12},{"id":"jvasp-9283","created_at":"2022-09-04T14:37:56.498193Z","updated_at":"2022-09-04T14:37:56.498219Z","structure_string":"Mg4 Co4 O8\n1.0\n2.906852 0.008778 -0.036488\n1.435095 7.494049 0.177252\n0.099443 0.793637 8.113562\nMg Co O\n4 4 8\ndirect\n0.643451 0.682577 0.976320 Mg\n0.340437 0.289220 0.043764 Mg\n0.550032 0.869193 0.262980 Mg\n0.433851 0.102607 0.757106 Mg\n0.771787 0.426288 0.715732 Co\n0.127271 0.714842 0.652184 Co\n0.856603 0.256958 0.367896 Co\n0.212091 0.545511 0.304349 Co\n0.764271 0.441309 0.165106 O\n0.872196 0.225636 0.593870 O\n0.111688 0.746162 0.426213 O\n0.219612 0.530489 0.854974 O\n0.887434 0.195315 0.906153 O\n0.562981 0.843299 0.755355 O\n0.096451 0.776483 0.113929 O\n0.420894 0.128500 0.264727 O\n","nsites":16,"nelements":3,"elements":["Mg","Co","O"],"chemical_system":"Co-Mg-O","density":4.343529401090392,"density_atomic":0.09079495853776563,"volume":176.221238025511,"volume_molar":6.6326818768193245,"formula_full":"Mg4 Co4 O8","formula_reduced":"MgCoO2","formula_anonymous":"ABC2","energy_above_hull":1.3721992375000005,"spacegroup":12},{"id":"jvasp-17311","created_at":"2022-09-04T14:37:56.697533Z","updated_at":"2022-09-04T14:37:56.697543Z","structure_string":"Ti3 Te4\n1.0\n3.708767 -0.000000 -0.991002\n-0.861028 6.186465 -3.222345\n0.012356 -0.049652 7.481664\nTi Te\n3 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.752149 0.706673 0.504296 Ti\n0.247853 0.293328 0.495704 Ti\n0.633717 0.960245 0.267433 Te\n0.366285 0.039757 0.732567 Te\n0.108681 0.450623 0.217361 Te\n0.891321 0.549378 0.782639 Te\n","nsites":7,"nelements":2,"elements":["Ti","Te"],"chemical_system":"Te-Ti","density":6.347114019189472,"density_atomic":0.04091163444639415,"volume":171.10047287824653,"volume_molar":14.719873311076613,"formula_full":"Ti3 Te4","formula_reduced":"Ti3Te4","formula_anonymous":"A3B4","energy_above_hull":2.361876580952381,"spacegroup":12},{"id":"jvasp-12048","created_at":"2022-09-04T14:37:56.728059Z","updated_at":"2022-09-04T14:37:56.728075Z","structure_string":"Bi4 Br12\n1.0\n7.164619 0.000000 -0.197611\n0.000000 12.416967 0.000000\n-2.188132 0.000000 6.479051\nBi Br\n4 12\ndirect\n0.500341 0.333647 0.000276 Bi\n-0.000341 0.833647 -0.000276 Bi\n0.000341 0.166353 0.000276 Bi\n0.499659 0.666354 -0.000276 Bi\n0.247590 0.168439 0.742949 Br\n0.254405 0.499822 0.736420 Br\n0.253406 0.331328 0.257909 Br\n0.246594 0.831328 0.742091 Br\n0.245595 -0.000178 0.263580 Br\n0.747590 0.331561 0.742949 Br\n0.252410 0.668439 0.257051 Br\n0.754405 0.000178 0.736420 Br\n0.753406 0.168672 0.257909 Br\n0.746594 0.668672 0.742092 Br\n0.745595 0.500178 0.263580 Br\n0.752410 0.831561 0.257051 Br\n","nsites":16,"nelements":2,"elements":["Bi","Br"],"chemical_system":"Bi-Br","density":5.219178657062037,"density_atomic":0.02801975565913495,"volume":571.0256789760302,"volume_molar":21.492481352301418,"formula_full":"Bi4 Br12","formula_reduced":"BiBr3","formula_anonymous":"AB3","energy_above_hull":2.749999999998587e-05,"spacegroup":12},{"id":"jvasp-108769","created_at":"2022-09-04T14:37:56.679455Z","updated_at":"2022-09-04T14:37:56.679476Z","structure_string":"K5 As4\n1.0\n5.928222 -0.038639 2.245253\n3.693002 4.637569 2.245253\n-0.016019 -0.007657 10.421326\nK As\n5 4\ndirect\n0.396194 0.396194 0.896022 K\n0.609076 0.609076 0.099994 K\n0.749744 0.749744 0.666140 K\n0.255519 0.255519 0.329868 K\n0.502642 0.502642 0.497987 K\n0.102053 0.102052 0.889995 As\n0.903194 0.903194 0.106014 As\n0.047658 0.047657 0.683497 As\n0.957619 0.957620 0.312485 As\n","nsites":9,"nelements":2,"elements":["K","As"],"chemical_system":"As-K","density":2.853072349880661,"density_atomic":0.031228055544976086,"volume":288.20238221485755,"volume_molar":19.28439236739103,"formula_full":"K5 As4","formula_reduced":"K5As4","formula_anonymous":"A4B5","energy_above_hull":0.7155837870370372,"spacegroup":12},{"id":"jvasp-79557","created_at":"2022-09-04T14:37:56.781247Z","updated_at":"2022-09-04T14:37:56.781272Z","structure_string":"Na1 N3\n1.0\n2.344451 2.900769 -1.945962\n2.344451 -2.900769 -1.945962\n0.538770 0.000000 -6.174097\nNa N\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 N\n0.933005 0.933005 0.623148 N\n0.066994 0.066994 0.376852 N\n","nsites":4,"nelements":2,"elements":["Na","N"],"chemical_system":"N-Na","density":1.3858757989023966,"density_atomic":0.05135182846657072,"volume":77.89401311394278,"volume_molar":11.727217783336235,"formula_full":"Na1 N3","formula_reduced":"NaN3","formula_anonymous":"AB3","energy_above_hull":3.876999687500001,"spacegroup":12},{"id":"jvasp-48202","created_at":"2022-09-04T14:37:56.995457Z","updated_at":"2022-09-04T14:37:56.995488Z","structure_string":"Li2 V2 P2 O10\n1.0\n0.000000 5.842740 0.000000\n-7.313700 2.921371 0.117111\n-0.810019 0.000000 4.903661\nLi V P O\n2 2 2 10\ndirect\n0.135994 0.728012 0.052249 Li\n0.864006 0.271988 0.947751 Li\n0.221100 0.000000 0.500000 V\n0.778899 0.000000 0.500000 V\n0.642037 0.715924 0.719522 P\n0.357963 0.284076 0.280478 P\n0.376115 0.805691 0.823898 O\n0.818193 0.805691 0.823898 O\n0.051764 0.896473 0.315779 O\n0.581795 0.836410 0.415294 O\n0.744389 0.511221 0.755517 O\n0.255611 0.488779 0.244483 O\n0.418205 0.163590 0.584705 O\n0.948236 0.103527 0.684221 O\n0.181807 0.194309 0.176102 O\n0.623884 0.194309 0.176102 O\n","nsites":16,"nelements":4,"elements":["Li","V","P","O"],"chemical_system":"Li-O-P-V","density":2.6832717768360763,"density_atomic":0.07655897269204726,"volume":208.98922017094984,"volume_molar":7.86601563245057,"formula_full":"Li2 V2 P2 O10","formula_reduced":"LiVPO5","formula_anonymous":"ABCD5","energy_above_hull":2.6263109,"spacegroup":12},{"id":"jvasp-29973","created_at":"2022-09-04T14:37:57.050588Z","updated_at":"2022-09-04T14:37:57.050615Z","structure_string":"Ni2 P2 S6\n1.0\n5.535548 0.000425 1.821202\n2.767435 5.045386 0.910514\n-0.091852 0.000137 6.539265\nNi P S\n2 2 6\ndirect\n0.332914 0.334172 -0.000000 Ni\n0.667086 0.665828 -0.000001 Ni\n0.060033 0.000002 0.824480 P\n0.939966 0.999999 0.175518 P\n0.082071 0.345950 0.756885 S\n0.571981 0.345946 0.243115 S\n0.263521 0.999999 0.243187 S\n0.736478 0.000002 0.756812 S\n0.428019 0.654054 0.756884 S\n0.917929 0.654051 0.243113 S\n","nsites":10,"nelements":3,"elements":["Ni","P","S"],"chemical_system":"Ni-P-S","density":3.3643569081444338,"density_atomic":0.05450445280714483,"volume":183.47124840209622,"volume_molar":11.048896832903488,"formula_full":"Ni2 P2 S6","formula_reduced":"NiPS3","formula_anonymous":"ABC3","energy_above_hull":2.01602358,"spacegroup":12},{"id":"jvasp-12744","created_at":"2022-09-04T14:37:57.062779Z","updated_at":"2022-09-04T14:37:57.062799Z","structure_string":"Li2 H6 O4\n1.0\n3.061019 -0.000558 -0.727157\n-1.445877 5.311982 -0.635798\n0.020664 -0.001311 5.541798\nLi H O\n2 6 4\ndirect\n0.499999 0.347682 0.652318 Li\n0.499999 0.652318 0.347681 Li\n0.856293 0.018085 0.753711 H\n0.143705 0.246289 0.981915 H\n0.143705 0.981914 0.246288 H\n0.312632 0.735815 0.735814 H\n0.687366 0.264185 0.264185 H\n0.856293 0.753710 0.018085 H\n0.604505 0.715255 0.715255 O\n0.395493 0.284745 0.284744 O\n-0.000001 0.792499 0.207500 O\n-0.000001 0.207501 0.792499 O\n","nsites":12,"nelements":3,"elements":["Li","H","O"],"chemical_system":"H-Li-O","density":1.545377653420933,"density_atomic":0.13306499905597477,"volume":90.18149088891596,"volume_molar":4.525713600664246,"formula_full":"Li2 H6 O4","formula_reduced":"LiH3O2","formula_anonymous":"AB2C3","energy_above_hull":2.2221645000000003,"spacegroup":12},{"id":"jvasp-56861","created_at":"2022-09-04T14:37:57.282680Z","updated_at":"2022-09-04T14:37:57.282695Z","structure_string":"Sr2 C1 N2 Cl2\n1.0\n4.242814 0.000000 0.000000\n-2.121407 4.804322 -0.674457\n0.000000 -0.025833 7.264811\nSr C N Cl\n2 1 2 2\ndirect\n0.682537 0.365077 0.270076 Sr\n0.317462 0.634924 0.729923 Sr\n0.000000 0.000000 0.500000 C\n0.114917 0.229833 0.445517 N\n0.885082 0.770167 0.554483 N\n0.371304 0.742608 0.148939 Cl\n0.628695 0.257392 0.851061 Cl\n","nsites":7,"nelements":4,"elements":["Sr","C","N","Cl"],"chemical_system":"C-Cl-N-Sr","density":3.2105525649983444,"density_atomic":0.04729382849339063,"volume":148.01085517909084,"volume_molar":12.733460055663713,"formula_full":"Sr2 C1 N2 Cl2","formula_reduced":"Sr2C(NCl)2","formula_anonymous":"AB2C2D2","energy_above_hull":2.266523893571428,"spacegroup":12},{"id":"jvasp-35234","created_at":"2022-09-04T14:37:57.548665Z","updated_at":"2022-09-04T14:37:57.548694Z","structure_string":"K2 Cu1 O2\n1.0\n3.207763 -0.630470 -2.386514\n-0.016013 3.946774 -1.064379\n-1.710766 -0.044564 7.708853\nK Cu O\n2 1 2\ndirect\n-0.023110 0.661916 0.323842 K\n0.023109 0.338084 0.676158 K\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 O\n0.500000 -0.000000 0.000000 O\n","nsites":5,"nelements":3,"elements":["K","Cu","O"],"chemical_system":"Cu-K-O","density":3.601665602384757,"density_atomic":0.0624195995758832,"volume":80.1030451007864,"volume_molar":9.647836258031282,"formula_full":"K2 Cu1 O2","formula_reduced":"K2CuO2","formula_anonymous":"AB2C2","energy_above_hull":0.3760302999999998,"spacegroup":12}]}