The use of functionals from static density-functional theory in an adiabatic way in a time-dependent frame-work is known to cause various problems due to the resulting exchange-correlation kernel being frequencyindependent. Using a simple one-dimensional two-electron system, which can be solved exactly, we investigatethe behavior of the adiabatic local density approximation and the adiabatic exact-exchange approximationfor the description of Rabi oscillations. We find that the quality of the results depends on the ground andexcited states that are involved in the Rabi oscillations and the number of electrons that participate in theexcitation. From these results we conclude that apart from the frequency dependence one also needs to in-clude ...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We show that as an electron transfers between closed-shell molecular fragments at large separation, ...
We consider an analytically solvable model of two interacting electrons that allows for the calculat...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
The asymmetric Hubbard dimer is used to study the density-dependence of the exact frequency-dependen...
We address and quantify the role of nonadiabaticity (“memory effects”) in the exchange-correlation (...
In time-dependent density-functional theory, an important quantity is the exchange-correlation kern...
The asymmetric Hubbard dimer is used to study the density-dependence of the exact frequency-dependen...
The adiabatic approximation is problematic in time-dependent density matrix functional theory. With ...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We show that as an electron transfers between closed-shell molecular fragments at large separation, ...
We consider an analytically solvable model of two interacting electrons that allows for the calculat...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
The asymmetric Hubbard dimer is used to study the density-dependence of the exact frequency-dependen...
We address and quantify the role of nonadiabaticity (“memory effects”) in the exchange-correlation (...
In time-dependent density-functional theory, an important quantity is the exchange-correlation kern...
The asymmetric Hubbard dimer is used to study the density-dependence of the exact frequency-dependen...
The adiabatic approximation is problematic in time-dependent density matrix functional theory. With ...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
International audienceWe investigate the adiabatic approximation to the exact-exchange kernel for ca...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We investigate a number of formal properties of the adiabatic strictly-correlated electrons (SCE) fu...
We show that as an electron transfers between closed-shell molecular fragments at large separation, ...