DMRG-Tailored Coupled Cluster Method in the 4c-Relativistic Domain: General Implementation and Application to the NUHFI and NUF(3) Molecules
DMRG定制耦合簇方法在4c相对论域中的应用:通用实现及其在NUHFI和NUF(3)分子中的应用
期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.4c00641
Višňák, Jakub; Brandejs, Jan; Máté, Mihály; Visscher, Lucas; Legeza, Örs; Pittner, Jiří