Lu Jeu Sham Created 2026-10-20 Updated 2026-11-05
Lu Jeu Sham and Walter Kohn developed self-consistent equations that make density functional theory computationally useful. The Kohn-Sham equations introduce an auxiliary system of noninteracting electrons with the same ground-state electron density as the interacting system. An effective potential includes the external potential, electrostatic repulsion and an exchange-correlation functional. Solving the equations and updating the electron density iteratively gives a self-consistent state. The difficult many-electron effects remain in the exchange-correlation functional, so practical calculations still need an approximation to it.[ref]
Self-Consistent Equations Including Exchange and Correlation Effects by Walter Kohn and Lu Jeu Sham. Physical Review 140, A1133–A1138 (1965), effective one-electron equations
Portrait of Lu Jeu Sham
. External portrait hosted by University of California San Diego, Center for Memory and Recording Research. Source.