{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=525","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=523","results":[{"id":"jvasp-14887","created_at":"2022-09-04T14:36:04.058274Z","updated_at":"2022-09-04T14:36:04.058296Z","structure_string":"Sb4 Ru4\n1.0\n3.892083 0.000000 0.000000\n0.000000 5.902137 0.000000\n0.000000 0.000000 6.625222\nSb Ru\n4 4\ndirect\n0.750000 0.797604 0.585581 Sb\n0.250000 0.202396 0.414419 Sb\n0.750000 0.297604 0.914419 Sb\n0.250000 0.702396 0.085581 Sb\n0.750000 0.994985 0.207652 Ru\n0.250000 0.005016 0.792348 Ru\n0.750000 0.494985 0.292348 Ru\n0.250000 0.505016 0.707652 Ru\n","nsites":8,"nelements":2,"elements":["Sb","Ru"],"chemical_system":"Ru-Sb","density":9.725029658598666,"density_atomic":0.05256518199478966,"volume":152.19199661085491,"volume_molar":11.45652032670014,"formula_full":"Sb4 Ru4","formula_reduced":"SbRu","formula_anonymous":"AB","energy_above_hull":2.0035983000000006,"spacegroup":62},{"id":"jvasp-93523","created_at":"2022-09-04T14:35:59.108931Z","updated_at":"2022-09-04T14:35:59.108970Z","structure_string":"Ca3 Mg3\n1.0\n3.693247 0.000000 0.000000\n-1.846624 3.198446 0.000000\n0.000000 0.000000 16.533238\nCa Mg\n3 3\ndirect\n0.333334 0.666668 0.842938 Ca\n0.000000 0.000000 0.648773 Ca\n0.333334 0.666668 0.175137 Ca\n0.000000 0.000000 0.008810 Mg\n0.333334 0.666668 0.484546 Mg\n0.000000 0.000000 0.339797 Mg\n","nsites":6,"nelements":2,"elements":["Ca","Mg"],"chemical_system":"Ca-Mg","density":1.6422386436466958,"density_atomic":0.03072175039053658,"volume":195.30137195074076,"volume_molar":19.60220587514128,"formula_full":"Ca3 Mg3","formula_reduced":"CaMg","formula_anonymous":"AB","energy_above_hull":0.2931865,"spacegroup":156},{"id":"jvasp-62681","created_at":"2022-09-04T14:36:08.068002Z","updated_at":"2022-09-04T14:36:08.068031Z","structure_string":"B2 N2\n1.0\n1.256145 -2.175706 0.000000\n1.256143 2.175706 -0.000000\n-0.000000 -0.000000 6.580961\nB N\n2 2\ndirect\n0.666618 0.333235 0.250000 B\n0.333383 0.666766 0.750000 B\n0.666723 0.333444 0.750000 N\n0.333277 0.666557 0.250000 N\n","nsites":4,"nelements":2,"elements":["B","N"],"chemical_system":"B-N","density":2.291298512330201,"density_atomic":0.11119904075880956,"volume":35.971533321730625,"volume_molar":5.415640925412304,"formula_full":"B2 N2","formula_reduced":"BN","formula_anonymous":"AB","energy_above_hull":2.5131379166666665,"spacegroup":194},{"id":"jvasp-86255","created_at":"2022-09-04T14:35:59.124072Z","updated_at":"2022-09-04T14:35:59.124100Z","structure_string":"Bi8 Pd8\n1.0\n5.746225 0.027192 -0.000000\n-1.050068 5.649532 -0.000000\n0.000000 0.000000 10.837616\nBi Pd\n8 8\ndirect\n0.849385 0.394490 0.279321 Bi\n0.122406 0.122406 0.993467 Bi\n0.394490 0.849385 0.279321 Bi\n0.605510 0.150615 0.779321 Bi\n0.365424 0.365423 0.497509 Bi\n0.634577 0.634576 0.997509 Bi\n0.150615 0.605510 0.779321 Bi\n0.877594 0.877594 0.493467 Bi\n0.087414 0.087414 0.722306 Pd\n0.327573 0.327573 0.228787 Pd\n0.623726 0.132769 0.055645 Pd\n0.672427 0.672426 0.728787 Pd\n0.867231 0.376274 0.555645 Pd\n0.376274 0.867230 0.555645 Pd\n0.132769 0.623726 0.055645 Pd\n0.912586 0.912585 0.222306 Pd\n","nsites":16,"nelements":2,"elements":["Bi","Pd"],"chemical_system":"Bi-Pd","density":11.898457033625409,"density_atomic":0.04543696400389246,"volume":352.13620343624467,"volume_molar":13.253836148656632,"formula_full":"Bi8 Pd8","formula_reduced":"BiPd","formula_anonymous":"AB","energy_above_hull":0.7130650000000002,"spacegroup":36},{"id":"jvasp-90775","created_at":"2022-09-04T14:36:08.566659Z","updated_at":"2022-09-04T14:36:08.566692Z","structure_string":"Zr4 Sn4\n1.0\n6.381750 0.000000 0.000000\n-3.190875 5.526757 0.000000\n-0.000000 0.000000 5.267699\nZr Sn\n4 4\ndirect\n0.999989 0.499995 0.000000 Zr\n0.500005 0.499995 0.000000 Zr\n0.500005 0.000011 0.000000 Zr\n0.333333 0.666667 0.500000 Zr\n0.000000 0.000000 0.000000 Sn\n0.340421 0.170211 0.500000 Sn\n0.829789 0.170211 0.500000 Sn\n0.829789 0.659579 0.500000 Sn\n","nsites":8,"nelements":2,"elements":["Zr","Sn"],"chemical_system":"Sn-Zr","density":7.505173930970187,"density_atomic":0.04305849824821533,"volume":185.79375327683613,"volume_molar":13.985951682022732,"formula_full":"Zr4 Sn4","formula_reduced":"ZrSn","formula_anonymous":"AB","energy_above_hull":1.4833731,"spacegroup":187},{"id":"jvasp-91808","created_at":"2022-09-04T14:36:08.087977Z","updated_at":"2022-09-04T14:36:08.088015Z","structure_string":"K4 As4\n1.0\n0.000000 -5.979957 0.000000\n-9.882639 0.000000 0.000000\n0.000000 0.000000 -4.208914\nK As\n4 4\ndirect\n0.262171 0.500000 0.749999 K\n0.737829 0.000000 0.250000 K\n0.737829 0.500000 0.250000 K\n0.262171 0.000000 0.749999 K\n0.127587 0.750000 0.250014 As\n0.872413 0.750000 0.750014 As\n0.872413 0.250000 0.749985 As\n0.127587 0.250000 0.249985 As\n","nsites":8,"nelements":2,"elements":["K","As"],"chemical_system":"As-K","density":3.044729394528432,"density_atomic":0.032162436550630634,"volume":248.73737371875634,"volume_molar":18.72414346008844,"formula_full":"K4 As4","formula_reduced":"KAs","formula_anonymous":"AB","energy_above_hull":0.4069805833333333,"spacegroup":51},{"id":"jvasp-19889","created_at":"2022-09-04T14:36:08.056660Z","updated_at":"2022-09-04T14:36:08.056676Z","structure_string":"Nb1 C1\n1.0\n2.766375 -0.000000 1.597167\n0.922125 2.608163 1.597167\n-0.000000 -0.000000 3.194335\nNb C\n1 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.499999 0.500000 C\n","nsites":2,"nelements":2,"elements":["Nb","C"],"chemical_system":"C-Nb","density":7.55908191497269,"density_atomic":0.08677682475354302,"volume":23.047628277253157,"volume_molar":6.939803083488742,"formula_full":"Nb1 C1","formula_reduced":"NbC","formula_anonymous":"AB","energy_above_hull":3.5720696999999992,"spacegroup":225},{"id":"jvasp-12037","created_at":"2022-09-04T14:36:08.169317Z","updated_at":"2022-09-04T14:36:08.169337Z","structure_string":"Mn2 Se2\n1.0\n3.590384 0.000000 -0.000000\n-0.000000 3.590384 -0.000000\n0.000000 0.000000 5.882410\nMn Se\n2 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.499999 0.499999 0.000000 Mn\n0.499999 0.000000 0.733601 Se\n0.000000 0.499999 0.266399 Se\n","nsites":4,"nelements":2,"elements":["Mn","Se"],"chemical_system":"Mn-Se","density":5.864300793763044,"density_atomic":0.05275005299924299,"volume":75.82930769865584,"volume_molar":11.416369117366429,"formula_full":"Mn2 Se2","formula_reduced":"MnSe","formula_anonymous":"AB","energy_above_hull":1.7234853040229885,"spacegroup":129},{"id":"jvasp-63690","created_at":"2022-09-04T14:36:04.013237Z","updated_at":"2022-09-04T14:36:04.013262Z","structure_string":"B3 N3\n1.0\n1.255989 -2.175437 -0.000000\n1.255989 2.175437 0.000000\n0.000000 -0.000000 9.833182\nB N\n3 3\ndirect\n0.000000 0.000000 0.000095 B\n0.333333 0.666667 0.666809 B\n0.666667 0.333333 0.333483 B\n0.666667 0.333333 0.000435 N\n0.000000 0.000000 0.667152 N\n0.333333 0.666667 0.333826 N\n","nsites":6,"nelements":2,"elements":["B","N"],"chemical_system":"B-N","density":2.300781956590403,"density_atomic":0.11165928192736495,"volume":53.7348968794465,"volume_molar":5.393318545535194,"formula_full":"B3 N3","formula_reduced":"BN","formula_anonymous":"AB","energy_above_hull":2.5129229166666667,"spacegroup":160},{"id":"jvasp-19817","created_at":"2022-09-04T14:36:07.963533Z","updated_at":"2022-09-04T14:36:07.963551Z","structure_string":"Sm1 N1\n1.0\n3.098858 -0.000000 1.789127\n1.032953 2.921631 1.789127\n0.000000 0.000000 3.578254\nSm N\n1 1\ndirect\n0.500000 0.500000 0.500001 Sm\n0.000000 0.000000 0.000000 N\n","nsites":2,"nelements":2,"elements":["Sm","N"],"chemical_system":"N-Sm","density":8.424899483895077,"density_atomic":0.06173504803393968,"volume":32.39650836426778,"volume_molar":9.754816675106897,"formula_full":"Sm1 N1","formula_reduced":"SmN","formula_anonymous":"AB","energy_above_hull":1.3745310624999996,"spacegroup":225},{"id":"jvasp-86309","created_at":"2022-09-04T14:36:03.984163Z","updated_at":"2022-09-04T14:36:03.984185Z","structure_string":"Ni6 As6\n1.0\n5.075418 0.000000 0.000000\n0.000000 5.485808 -3.166912\n0.000000 0.000257 6.334304\nNi As\n6 6\ndirect\n0.000019 0.666177 0.332864 Ni\n0.500019 0.333823 0.667136 Ni\n0.500019 0.667137 0.333823 Ni\n0.000019 0.332864 0.666177 Ni\n0.500039 0.999116 0.999115 Ni\n0.000039 0.000885 0.000885 Ni\n0.750600 -0.000009 0.666646 As\n0.250599 0.000009 0.333354 As\n0.250599 0.333354 0.000009 As\n0.750600 0.666646 -0.000009 As\n0.248925 0.666702 0.666701 As\n0.748925 0.333299 0.333299 As\n","nsites":12,"nelements":2,"elements":["Ni","As"],"chemical_system":"As-Ni","density":7.548037866921288,"density_atomic":0.06803928677486591,"volume":176.36869180752296,"volume_molar":8.850975731016351,"formula_full":"Ni6 As6","formula_reduced":"NiAs","formula_anonymous":"AB","energy_above_hull":0.987317075,"spacegroup":194},{"id":"jvasp-90798","created_at":"2022-09-04T14:36:05.026653Z","updated_at":"2022-09-04T14:36:05.026679Z","structure_string":"Pb4 S4\n1.0\n0.000000 4.233305 -0.000000\n0.000000 -0.000000 4.233195\n11.975915 0.000000 0.000000\nPb S\n4 4\ndirect\n0.250000 0.250047 0.624985 Pb\n0.250000 0.249953 0.124985 Pb\n0.750001 0.749952 0.375015 Pb\n0.750001 0.750046 0.875015 Pb\n0.250000 0.250047 0.875021 S\n0.250000 0.249953 0.375022 S\n0.750001 0.749952 0.124979 S\n0.750001 0.750046 0.624980 S\n","nsites":8,"nelements":2,"elements":["Pb","S"],"chemical_system":"Pb-S","density":7.405113576827716,"density_atomic":0.03727635577193032,"volume":214.61325374580005,"volume_molar":16.155390287735063,"formula_full":"Pb4 S4","formula_reduced":"PbS","formula_anonymous":"AB","energy_above_hull":0.3970554099999999,"spacegroup":225}]}