We discuss the finite-temperature generalization of time-dependent density functional theory (TDDFT). The theory is directly analogous to that at temperature T = 0. For example, the finite-T TDDFT exchange-correlation kernel fxc(T, n) in the local density approximation can again be expressed as a density derivative of the exchange correlation potential fxc(T, n) = [∂vxc(T, n)∕∂n]δ(r − r′), where n = N∕V is the electron number density. An approximation for the kernel fxc(T, n) is obtained from the finite-T generalization of the retarded cumulant expansion applied to the homogeneous electron gas. Results for fxc and the loss function are presented for a wide range of temperatures and densities including the warm dense matter regime, where T ≈...
We illustrate the scope of time-dependent density-functional theory for strongly correlated (lattice...
This dissertation is an accumulation of my contribution to the fundamental understanding of ensemble...
Warm dense matter (WDM) is a high energy phase between solids and plasmas, with characteristics of b...
We derive an intrinsically temperature-dependent approximation to the correlation grand potential fo...
Finite-temperature density functional theory (DFT) has become of topical interest, partly due to the...
One of the most used methods in condensed matter theory and quantum chemistry for the description of...
Abstract. Time-dependent density functional theory (TDDFT) is a general and robust method allowing t...
We illustrate the potential of Time Dependent Density Functional Theory (TDDFT) for describing the n...
International audienceFor the calculation of neutral excitations, time-dependent density functional ...
We present some details of our recently-proposed Time-Dependent Density-Functional Theory (TDDFT) fo...
We present some details of our recently-proposed Time-Dependent Density-Functional Theory (TDDFT) fo...
The strictly correlated electron approach to density functional theory, first proposed by Seidl and ...
We study the role of finite-temperature exchange-correlation functional in an ab initio molecular dy...
In time-dependent density-functional theory, an important quantity is the exchange-correlation kern...
The generalization of the zero temperature local density functional theory of inhomogeneous electron...
We illustrate the scope of time-dependent density-functional theory for strongly correlated (lattice...
This dissertation is an accumulation of my contribution to the fundamental understanding of ensemble...
Warm dense matter (WDM) is a high energy phase between solids and plasmas, with characteristics of b...
We derive an intrinsically temperature-dependent approximation to the correlation grand potential fo...
Finite-temperature density functional theory (DFT) has become of topical interest, partly due to the...
One of the most used methods in condensed matter theory and quantum chemistry for the description of...
Abstract. Time-dependent density functional theory (TDDFT) is a general and robust method allowing t...
We illustrate the potential of Time Dependent Density Functional Theory (TDDFT) for describing the n...
International audienceFor the calculation of neutral excitations, time-dependent density functional ...
We present some details of our recently-proposed Time-Dependent Density-Functional Theory (TDDFT) fo...
We present some details of our recently-proposed Time-Dependent Density-Functional Theory (TDDFT) fo...
The strictly correlated electron approach to density functional theory, first proposed by Seidl and ...
We study the role of finite-temperature exchange-correlation functional in an ab initio molecular dy...
In time-dependent density-functional theory, an important quantity is the exchange-correlation kern...
The generalization of the zero temperature local density functional theory of inhomogeneous electron...
We illustrate the scope of time-dependent density-functional theory for strongly correlated (lattice...
This dissertation is an accumulation of my contribution to the fundamental understanding of ensemble...
Warm dense matter (WDM) is a high energy phase between solids and plasmas, with characteristics of b...