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Propagator Methods and Time-dependent DFT

If a molecule is subjected to a linear electric field E that is fluctuating such that [Pg.501]

A detailed comparison of several methods for local and charge-transfer excitation energies in benzenes substituted with donor and acceptor groups has been provided by Jamorski et al. [Pg.502]

Efforts to improve TDDFT for higher-energy excitations have shown some early success. Tozer and Handy (1998) have proposed a correction procedure to deliver functionals having [Pg.503]


See other pages where Propagator Methods and Time-dependent DFT is mentioned: [Pg.501]   


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DFT methods

Propagator method

Time propagation

Time propagator

Time-dependent DFT

Time-dependent method

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