In this thesis we developed the time-dependent version of the multicomponent density functional approach to treat time-dependent electron-nuclear systems. The method enables to describe the electron-nuclear coupling fully quantum mechanically. No Born-Oppenheimer approximation is involved in the approach. The multicomponent density functional theory is formulated for an electron-nuclear system in the body-fixed coordinate frame attached to the nuclei. It allows us to describe properly the internal properties of the system.
The solution of the time-dependent Schrodinger equation for systems of interacting electrons is gene...
In the context of the exact factorization of the electron-nuclear wave function, the coupling betwee...
We formulate the time-dependent variational principle in the form of the Euler-Lagrange equations, a...
In this thesis we developed the time-dependent version of the multicomponent density functional appr...
In this thesis we developed the time-dependent version of the multicomponent density functional appr...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
The quantum mechanical treatment of both electrons and protons in the calculation of excited state p...
The electronic system is driven far from its ground state in many applications today: attosecond co...
Abstract. Time-dependent density functional theory (TDDFT) is a general and robust method allowing t...
Electron-positron interactions have been utilized in various fields of science. Here we develop time...
International audienceThe nuclear time-dependent density functional theory (TDDFT) is a tool of choi...
The solution of the time-dependent Schrodinger equation for systems of interacting electrons is gene...
In the context of the exact factorization of the electron-nuclear wave function, the coupling betwee...
We formulate the time-dependent variational principle in the form of the Euler-Lagrange equations, a...
In this thesis we developed the time-dependent version of the multicomponent density functional appr...
In this thesis we developed the time-dependent version of the multicomponent density functional appr...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
We derive the basic formalism of density functional theory for time-dependent electron-nuclear syste...
The quantum mechanical treatment of both electrons and protons in the calculation of excited state p...
The electronic system is driven far from its ground state in many applications today: attosecond co...
Abstract. Time-dependent density functional theory (TDDFT) is a general and robust method allowing t...
Electron-positron interactions have been utilized in various fields of science. Here we develop time...
International audienceThe nuclear time-dependent density functional theory (TDDFT) is a tool of choi...
The solution of the time-dependent Schrodinger equation for systems of interacting electrons is gene...
In the context of the exact factorization of the electron-nuclear wave function, the coupling betwee...
We formulate the time-dependent variational principle in the form of the Euler-Lagrange equations, a...
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