Density Functional Theory (DFT) first established it's theoretical footing in the 1960s from the framework of Hohenberg-Kohn theorems. DFT has since seen much d

Density Functional Theory (DFT) first established it's theoretical footing in the 1960s from the framework of Hohenberg-Kohn theorems. DFT has since seen much d

Density Functional Theory (DFT) has firmly established itself as the workhorse for atomic-level simulations of condensed phases, pure or composite materials and

Density Functional Theory is a rapidly developing branch of many-particle physics that has found applications in atomic, molecular, solid-state and nuclear phys

This volume results from two programs that took place at the Institute for Mathematical Sciences at the National University of Singapore: Aspects of Computation