Abstract
The recent time-dependent density functional theory approach within the two-component zero order relativistic approximation implemented in the ADF code has been modified in order to treat core electron excitations. The method has been applied to the calculation of the Ti 2p (L
Original language | English |
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Pages (from-to) | 56-63 |
Journal | Chemical Physics Letters |
Volume | 416 |
Issue number | 1-3 |
DOIs | |
Publication status | Published - 2005 |