Application of time-dependent density-functional theory to the 3Σu− first excited state of H2
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.480544
Reference52 articles.
1. Treatment of electronic excitations within the adiabatic approximation of time dependent density functional theory
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3. A time-dependent density functional theory study of the electronically excited states of formaldehyde, acetaldehyde and acetone
4. An efficient implementation of time-dependent density-functional theory for the calculation of excitation energies of large molecules
5. Density-functional-theory response-property calculations with accurate exchange-correlation potentials
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