Abstract. Time-dependent density functional theory (TDDFT) is rapidly emerging as a premier method for solving dynamical many-body problems in physics and chemistry. The mathematical foundations of TDDFT are established through the formal existence of a fictitious non-interacting system (known as the Kohn-Sham system), which can reproduce the one-electron reduced probability density of the actual system. We build upon these works and show that on the interior of the domain of existence, the Kohn-Sham system can be efficiently obtained given the time-dependent density. We introduce a V-representability parameter which diverges at the boundary of the existence domain and serves to quantify the numerical difficulty of constructing the Kohn-Sha...
We demonstrate how a recently developed method Nielsen et al. [Nielsen et al., EPL 101, 33001 (2013)...
In this work, the existence, uniqueness, and regularity of solutions to the timedependent Kohn-Sham ...
Time-dependent density-functional theory (TDDFT) describes the quantum dynamics of interacting elect...
Time-dependent density functional theory (TDDFT) is rapidly emerging as a premier method for solving...
A viable way to develop optimal control strategies for multi-particle quantum systems is to consider...
Time-dependent density functional theory for lattice Hamiltonians In all practical implementations, ...
For the calculation of neutral excitations, time-dependent density functional theory (TDDFT) is an e...
In this article, we prove the one-to-one correspondence between vector potentials and particle and c...
In this work we review the mapping from densities to potentials in quantum mechanics, which is the ...
Ground-state density-functional theory (DFT) and time-dependent density-functional theory (TDDFT) ar...
Time-dependent density functional theory (TDDFT) for quantum many-body systems on a lattice is formu...
The time-periodic density of a Floquet state of a time-periodic potential does not uniquely determin...
We present a local control scheme to construct the external potential v that, for a given initial st...
Time-dependent density functional theory (TDDFT) is a method of choice for calculations of excitatio...
131 p.This thesis is devoted to the formulation and implications of the time-dependent density funct...
We demonstrate how a recently developed method Nielsen et al. [Nielsen et al., EPL 101, 33001 (2013)...
In this work, the existence, uniqueness, and regularity of solutions to the timedependent Kohn-Sham ...
Time-dependent density-functional theory (TDDFT) describes the quantum dynamics of interacting elect...
Time-dependent density functional theory (TDDFT) is rapidly emerging as a premier method for solving...
A viable way to develop optimal control strategies for multi-particle quantum systems is to consider...
Time-dependent density functional theory for lattice Hamiltonians In all practical implementations, ...
For the calculation of neutral excitations, time-dependent density functional theory (TDDFT) is an e...
In this article, we prove the one-to-one correspondence between vector potentials and particle and c...
In this work we review the mapping from densities to potentials in quantum mechanics, which is the ...
Ground-state density-functional theory (DFT) and time-dependent density-functional theory (TDDFT) ar...
Time-dependent density functional theory (TDDFT) for quantum many-body systems on a lattice is formu...
The time-periodic density of a Floquet state of a time-periodic potential does not uniquely determin...
We present a local control scheme to construct the external potential v that, for a given initial st...
Time-dependent density functional theory (TDDFT) is a method of choice for calculations of excitatio...
131 p.This thesis is devoted to the formulation and implications of the time-dependent density funct...
We demonstrate how a recently developed method Nielsen et al. [Nielsen et al., EPL 101, 33001 (2013)...
In this work, the existence, uniqueness, and regularity of solutions to the timedependent Kohn-Sham ...
Time-dependent density-functional theory (TDDFT) describes the quantum dynamics of interacting elect...