Repositorios 8

Electronic structure Density functional theory 22 Approximation theory 18 Molecular dynamics 18 Mathematical models 14 Cobalt 12 Probability density function 12 Solvents 12 Transition metals 12 Band structure 10 Computer simulation 10 Copper 10 Electronic structure calculations 10 Fermi level 10 Granular alloys 10 Granular materials 10 Ground state 10 Multilayers 10 Positive ions 10 Quantum theory 10 Self assembled monolayers 10 Oxidation 9 Band structure calculations 8 Catalysts 8 Charge transfer 8 Chlorine compounds 8 Electron transfer 8 Hamiltonians 8 Interfaces (materials) 8 Ions 8