Mixed tutton salts K2Mn0.15Co0.85(SO4)2(H2O)6 and K2Mn0.16Zn0.84(SO4)2(H2O)6 for applications in thermochemical devices: experimental physicochemical properties combined with first-principles calculations
João G. de Oliveira Neto, Luiz Fernando Lobato da Silva, Tiago Kalil Cortinhas Alves, A. Neumann, Francisco F. de Sousa, Alejandro Pedro Ayala, Adenílson O. dos Santos
Topics & Concepts
CrystallographyDensity functional theoryMaterials scienceValence (chemistry)Lattice energyEndothermic processEnthalpyBand gapThermal stabilityCrystal structureChemistryThermodynamicsPhysical chemistryComputational chemistryAdsorptionOrganic chemistryOptoelectronicsPhysicsCrystal Structures and PropertiesChemical and Physical Properties in Aqueous SolutionsThermal Expansion and Ionic Conductivity