956 citations · 978 across the 3 of their papers we have counts for
5 papers
Density functional theory of dissipative systems
Kieron Burke, Roberto Car, Ralph Gebauer
Time-dependent density functional theory is extended to include dissipative systems evolving under a master equation, providing a Hamiltonian treatment for molecular electronics. F…
Time-dependent density functional theory: Past, present, and future
Kieron Burke, Jan Werschnik, E. K. U. Gross
Time-dependent density functional theory (TDDFT) is presently enjoying enormous popularity in quantum chemistry, as a useful tool for extracting electronic excited state energies.…
Accurate Adiabatic Connection Curve Beyond the Physical Interaction Strength
R. J. Magyar, W. Terilla, K. Burke
The adiabatic connection curve of density functional theory (DFT) is accurately calculated beyond the physical interaction strength for Hooke's atom, two interacting electrons in a…
Excitation energies from time-dependent density functional theory using exact and approximate functionals
Martin Petersilka, E. K. U. Gross, Kieron Burke
The role of the exchange-correlation potential and the exchange-correlation kernel in the calculation of excitation energues from time-dependent density functional theory is studie…
A hybrid functional for the exchange-correlation kernel in time-dependent density functional theory
Kieron Burke, Martin Petersilka, E. K. U. Gross
A review of the approximations in any time-dependent density functional calculation of excitation energies is given. The single-pole approximation for the susceptibility is used to…