| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5382011 | Chemical Physics Letters | 2013 | 8 Pages |
Abstract
- B3LYP, CASPT2 and RCCSD(T) geometry optimizations for MnC2-/0 carried out.
- Ground states and spectroscopic relevant excited states determined.
- CASPT2 and RCCSD(T) adiabatic and vertical detachment energies calculated.
- Assignment for anion photoelectron spectra proposed.
- Multidimensional Franck-Condon simulations given.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Van Tan Tran, Christophe Iftner, Marc F.A. Hendrickx,