A theory that is used to describe the electronic ground state properties of matter. It forms the basis of methods in obtaining a solution to the Schrodinger equation for a many-body system, and to investigate the structural, magnetic, and electronic properties of molecules and materials.
Densitetsfunktionsteori — DFT-beräkningar
Density Functional Theories — Kohn-Sham Density Functional Theory — Kohn Sham Density Functional Theory — KS-DFT — DFT Calculations — DFT Calculation — Density Functional Theory Calculations — Density Functional Theory Computations — Density Functional Calculations — Calculation, Density Functional — Density Functional Calculation — Functional Calculation, Density — Functional Calculations, Density — Density Functional Computations — Computation, Density Functional — Density Functional Computation — Functional Computation, Density — Time-Dependent Density Functional Theory — Time Dependent Density Functional Theory — Td-DFT — Time-Dependent Density Functional Theory Computations — Time Dependent Density Functional Theory Computations — Td-DFT Computations — Computation, Td-DFT — Td-DFT Computation — Td DFT Computations — Td-DFT Calculations — Calculation, Td-DFT — Td-DFT Calculation — Td DFT Calculations — Time-Dependent Density Functional Theory Calculations — Time Dependent Density Functional Theory Calculations