Time-dependent density functional theory

Known as: TD-DFT, TDDFT

Time-dependent density functional theory (TDDFT) is a quantum mechanical theory used in physics and chemistry to investigate the properties and…

Papers overview

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2017

The last two decades have witnessed increasing experimental interest in the study and control of many-electron systems strongly…

2016

We compute the exact exchange-correlation potential of the time-dependent density-functional theory (TDDFT) for the correlated…

2015

Density Functional Theory (DFT) and Time-Dependent Density Functional Theory (TDDFT) are powerful methods for solving a variety…

2014

2008

National Science Foundation of China [20673104, 50121202]; National Basic Research Program of China [2004CB719901, 2006CB922004]

2005

OF THE DISSERTATION Scattering states from Time-dependent Density Functional Theory by Adam Wasserman Dissertation Director: Prof…

2003

Two narrow band gap polymers, polyazopyrrole (PAPY) and polyazothiophene (PATH), were theoretically investigated by means of time…

2003

Time-dependent density functional theory appears to be a valuable tool to study multiphoton ionization of atoms or molecules…

2001

In this thesis the time-dependent version of density functional theory is described, which has been developed for crystalline non…

1999

OF THE THESIS OSCILLATOR STRENGTHS FROM TIME-DEPENDENT DENSITY FUNCTIONAL THEORY by Heiko Appel Thesis Director: Kieron Burke We…