Charge-Transfer Excitations in Uranyl Tetrachloride ([UO 2 Cl 4 ] 2– ): How Reliable are Electronic Spectra from Relativistic Time-Dependent Density Functional Theory?
Tecmer, Paweł, Bast, Radovan, Ruud, Kenneth, Visscher, LucasТом:
116
Мова:
english
Журнал:
The Journal of Physical Chemistry A
DOI:
10.1021/jp3011266
Date:
July, 2012
Файл:
PDF, 726 KB
english, 2012