{"count":1013513,"next":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=nelements&page=17","previous":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=nelements&page=15","results":[{"id":"oqmd-117514","created_at":"2022-09-04T15:15:51.265783Z","updated_at":"2022-09-04T15:15:51.265809Z","structure_string":"Ti2\n1.0\n2.917196 0.000000 0.000000\n-1.458598 2.526199 0.000000\n0.000000 0.000000 4.619768\nTi\n2\ndirect\n0.333307 0.666614 0.250000 Ti\n0.666692 0.333382 0.750001 Ti\n","nsites":2,"nelements":1,"elements":["Ti"],"chemical_system":"Ti","density":4.669409559349157,"density_atomic":0.0587457781816446,"volume":34.0449996902911,"volume_molar":10.251189015454472,"formula_full":"Ti2","formula_reduced":"Ti","formula_anonymous":"A","formation_energy":0.0137846116666704,"spacegroup":194},{"id":"oqmd-117243","created_at":"2022-09-04T15:15:51.277919Z","updated_at":"2022-09-04T15:15:51.277938Z","structure_string":"Ti2\n1.0\n2.914364 0.000000 0.000000\n-1.457182 2.523890 0.000000\n0.000000 0.000000 4.624789\nTi\n2\ndirect\n0.333303 0.666606 0.250001 Ti\n0.666696 0.333394 0.750000 Ti\n","nsites":2,"nelements":1,"elements":["Ti"],"chemical_system":"Ti","density":4.6731439891502795,"density_atomic":0.058792760992199815,"volume":34.01779345360809,"volume_molar":10.242997026111723,"formula_full":"Ti2","formula_reduced":"Ti","formula_anonymous":"A","formation_energy":0.0138500216666699,"spacegroup":194},{"id":"oqmd-67408","created_at":"2022-09-04T15:15:51.306190Z","updated_at":"2022-09-04T15:15:51.306218Z","structure_string":"Zr2\n1.0\n3.235323 0.000000 0.000000\n-1.617662 2.801816 0.000000\n0.000000 0.000000 5.173023\nZr\n2\ndirect\n0.333302 0.666603 0.250001 Zr\n0.666697 0.333394 0.750001 Zr\n","nsites":2,"nelements":1,"elements":["Zr"],"chemical_system":"Zr","density":6.460803594692525,"density_atomic":0.04265091278983393,"volume":46.89231411893043,"volume_molar":14.119605809316722,"formula_full":"Zr2","formula_reduced":"Zr","formula_anonymous":"A","formation_energy":0.0,"spacegroup":194},{"id":"oqmd-632558","created_at":"2022-09-04T15:15:51.307379Z","updated_at":"2022-09-04T15:15:51.307406Z","structure_string":"Br1\n1.0\n-2.848957 0.000000 0.000000\n0.000000 -2.848957 0.000000\n1.424478 1.424478 3.554000\nBr\n1\ndirect\n0.000000 0.000000 0.000000 Br\n","nsites":1,"nelements":1,"elements":["Br"],"chemical_system":"Br","density":4.59968833601363,"density_atomic":0.03466656315225368,"volume":28.84623998081534,"volume_molar":17.37161175612097,"formula_full":"Br1","formula_reduced":"Br","formula_anonymous":"A","formation_energy":0.1720923325,"spacegroup":139},{"id":"oqmd-636458","created_at":"2022-09-04T15:15:51.350650Z","updated_at":"2022-09-04T15:15:51.350674Z","structure_string":"C1\n1.0\n1.767297 0.000000 0.000000\n0.000000 1.767297 0.000000\n0.000000 0.000000 1.767297\nC\n1\ndirect\n0.000000 0.000000 0.000000 C\n","nsites":1,"nelements":1,"elements":["C"],"chemical_system":"C","density":3.613173332181634,"density_atomic":0.1811637823290524,"volume":5.519867090121107,"volume_molar":3.3241416593200914,"formula_full":"C1","formula_reduced":"C","formula_anonymous":"A","formation_energy":2.7510504125,"spacegroup":221},{"id":"oqmd-89802","created_at":"2022-09-04T15:15:51.350977Z","updated_at":"2022-09-04T15:15:51.351014Z","structure_string":"Yb2\n1.0\n3.701403 0.000000 0.000000\n-1.850701 3.205350 0.000000\n0.000000 0.000000 6.089104\nYb\n2\ndirect\n0.333304 0.666607 0.249999 Yb\n0.666697 0.333396 0.750000 Yb\n","nsites":2,"nelements":1,"elements":["Yb"],"chemical_system":"Yb","density":7.954820368408852,"density_atomic":0.027684378175929336,"volume":72.24290852011748,"volume_molar":21.75284820099754,"formula_full":"Yb2","formula_reduced":"Yb","formula_anonymous":"A","formation_energy":0.0198119099999998,"spacegroup":194},{"id":"oqmd-620426","created_at":"2022-09-04T15:15:51.394595Z","updated_at":"2022-09-04T15:15:51.394628Z","structure_string":"Ba1\n1.0\n2.514000 2.514000 2.514000\n2.514000 -2.514000 -2.514000\n-2.514000 2.514000 -2.514000\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n","nsites":1,"nelements":1,"elements":["Ba"],"chemical_system":"Ba","density":3.58797343404547,"density_atomic":0.015734182695631167,"volume":63.555890975999986,"volume_molar":38.27425215846857,"formula_full":"Ba1","formula_reduced":"Ba","formula_anonymous":"A","formation_energy":9.89999999978508e-07,"spacegroup":229},{"id":"oqmd-638134","created_at":"2022-09-04T15:15:51.399281Z","updated_at":"2022-09-04T15:15:51.399308Z","structure_string":"Cl4\n1.0\n-3.144966 -2.204533 0.000000\n-3.144966 2.204533 0.000000\n0.000000 0.000000 -8.034286\nCl\n4\ndirect\n0.123658 0.876343 0.105482 Cl\n0.623659 0.376342 0.394518 Cl\n0.376342 0.623659 0.605481 Cl\n0.876343 0.123658 0.894519 Cl\n","nsites":4,"nelements":1,"elements":["Cl"],"chemical_system":"Cl","density":2.1137432680383714,"density_atomic":0.03590460467387369,"volume":111.40632340426897,"volume_molar":16.772614027364753,"formula_full":"Cl4","formula_reduced":"Cl","formula_anonymous":"A","formation_energy":0.0028843025,"spacegroup":64},{"id":"oqmd-620950","created_at":"2022-09-04T15:15:51.407299Z","updated_at":"2022-09-04T15:15:51.407323Z","structure_string":"Ba1\n1.0\n0.000000 0.000000 -3.946530\n-2.791771 -2.791771 0.000000\n-2.791771 2.791771 0.000000\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n","nsites":1,"nelements":1,"elements":["Ba"],"chemical_system":"Ba","density":3.7068075827226754,"density_atomic":0.016255300881185503,"volume":61.5183937417878,"volume_molar":37.047242644214926,"formula_full":"Ba1","formula_reduced":"Ba","formula_anonymous":"A","formation_energy":0.30716138,"spacegroup":221},{"id":"oqmd-637444","created_at":"2022-09-04T15:15:51.411974Z","updated_at":"2022-09-04T15:15:51.412000Z","structure_string":"C4\n1.0\n-2.056022 -2.056022 -2.056022\n-2.056022 2.056022 2.056022\n2.056022 2.056022 -2.056022\nC\n4\ndirect\n0.750002 0.000000 0.000000 C\n0.000000 0.500002 0.250000 C\n0.750002 0.750002 0.250002 C\n0.500002 0.750002 0.500002 C\n","nsites":4,"nelements":1,"elements":["C"],"chemical_system":"C","density":2.29474348024027,"density_atomic":0.11505797539589556,"volume":34.76508243984529,"volume_molar":5.234005499643814,"formula_full":"C4","formula_reduced":"C","formula_anonymous":"A","formation_energy":1.2978910875,"spacegroup":214},{"id":"oqmd-117515","created_at":"2022-09-04T15:15:51.425800Z","updated_at":"2022-09-04T15:15:51.425814Z","structure_string":"Zr2\n1.0\n3.228109 0.000000 0.000000\n-1.614055 2.795588 0.000000\n0.000000 0.000000 5.174442\nZr\n2\ndirect\n0.333302 0.666604 0.250000 Zr\n0.666697 0.333397 0.750000 Zr\n","nsites":2,"nelements":1,"elements":["Zr"],"chemical_system":"Zr","density":6.487887683251981,"density_atomic":0.042829708056121,"volume":46.69655925226813,"volume_molar":14.06066264124195,"formula_full":"Zr2","formula_reduced":"Zr","formula_anonymous":"A","formation_energy":0.0003319400000005,"spacegroup":194},{"id":"oqmd-752522","created_at":"2022-09-04T15:21:48.851053Z","updated_at":"2022-09-04T15:21:48.851084Z","structure_string":"Mg2\n1.0\n0.000000 -3.196262 0.000000\n-2.768044 -1.598131 0.000000\n0.000000 0.000000 -5.183292\nMg\n2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.333333 0.333333 0.500001 Mg\n","nsites":2,"nelements":1,"elements":["Mg"],"chemical_system":"Mg","density":1.7601662210653513,"density_atomic":0.04361229684392489,"volume":45.85862577147427,"volume_molar":13.808354972799085,"formula_full":"Mg2","formula_reduced":"Mg","formula_anonymous":"A","formation_energy":0.0002660408333299,"spacegroup":194}]}