| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5382818 | Chemical Physics Letters | 2012 | 5 Pages |
Abstract
⺠It is first studied by high-level ab inito methods for the electronic structure for IrO molecule. ⺠Both the relativistic effect and electronic correlation are considered in the present Letter. ⺠The ground state of IrO is clarified and assigned to the X4Î7/2. ⺠The calculated rotationally resolved spectra of IrO are in good agreement with experimental data.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Bingbing Suo, Aimin Dong, Huixian Han, Yibo Lei, Yangqiang Wang,