Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5380146 | Chemical Physics Letters | 2015 | 18 Pages |
Abstract
- DFT, NEVPT2 and RCCSD(T) geometry optimizations for MnSâ/0 carried out.
- Ground states and spectroscopic relevant excited states determined.
- NEVPT2 detachment energies calculated.
- Assignment for anion photoelectron spectra proposed.
- Franck-Condon simulations given.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Van Tan Tran, Quoc Tri Tran, Marc F.A. Hendrickx,