位置：成果数据库 > 期刊 > 期刊详情页
Four-component relativistic theory for nuclear magnetic shielding constants: The orbital decompositi
  • 时间：0
  • 相关项目：NMR化学位移的相对论密度泛函计算方法与应用
同期刊论文项目
NMR化学位移的相对论密度泛函计算方法与应用
期刊论文 11
同项目期刊论文
Comprehensive Theoretical Studies on the Low-lying Electronic States of NiF, NiCl, NiBr, and NiI
Comprehensive ab initio calculation and simulation on the low-lying excited states of TlX (X=F, Cl,
Making four-and two-component relativistic density functional methods fully equivalent based on the
Ab inito investigation on electron transfer in molecular electronic devices: A minimal model study
Four-component relativistic theory for nuclear magnetic shielding constants: Critical assessments of
Matrix formulation of direct perturbation theory of relativistic effects in a kinetically balanced b
Quasi-relativistic theory. II Theory at matrix level
Infinite-order Quasirelativistic Density Functional Method Based on the Exact Matrix Quasirelativist
相对论量子化学新进展