科研之友
微信
新浪微博
Facebook
分享链接
摘要
We propose a straightforward and efficient procedure to perform dynamical mean field (DMFT) calculations on the top of the static mean-field LDA+U approximation. Starting from self-consistent LDA+U ground state we included multiplet transitions using the Hubbard-I approximation, which yields a very good agreement with experimental photoelectron spectra of delta-Pu, Am, and their selected compounds.
- 出版日期2007
