Densityfun相关论文
In this work,we studied the elec-tronic band structure of the halogen (F,Cl,and Br) functionalized graphdiynes(GDYs) by ......
Theoretical Study of Non-heme Mn(Ⅴ)-oxo Complexes:Formation Mechanism,Electronic Nature,and Hydroxyl
Many non-heme manganese complexes exhibit high reactivity and enantioselectivity for the activation of C-H bonds.Recentl......