167 citations · 267 across the 5 of their papers we have counts for
6 papers
Spin-orbit interaction in Au structures of various dimensionalities
Xiaoping Yang, Jian Zhou, Hongming Weng +1
Variation of the geometrical and electronic properties of the gold materials in different dimensions has been investigated by method, taking into account the spin-orb…
Optical properties of 4 A single-walled carbon nanotubes inside the zeolite channels studied from first principles calculations
X. P. Yang, H. M. Weng, Jinming Dong
The structural, electronic, and optical properties of 4 A single-walled carbon nanotubes (SWNTs) contained inside the zeolite channels have been studied based upon the density-func…
First principles investigation of transition-metal doped group-IV semiconductors: RY (R=Cr, Mn, Fe; Y=Si, Ge)
Hongming Weng, Jinming Dong
A number of transition-metal (TM) doped group-IV semiconductors, RY (R=Cr, Mn and Fe; Y=Si, Ge), have been studied by the first principles calculations. The obtained…
Electronic Structure and Optical Properties of the Co-doped Anatase TiO Studied from First Principles
Hongming Weng, Xiaoping Yang, Jinming Dong +3
The Co-doped anatase TiO, a recently discovered room-temperature ferromagnetic insulator, has been studied by the first-principles calculations in the pseudo-potential plane-…
Electronic Structure and Linear Optical Properties of SrCuOCl Studied from the First Principles Calculation
Hongming Weng, Xiangang Wan, Jian Zhou +1
First-principles calculations with the full-potential linearized augmented plane-wave (FP-LAPW) method have been performed to investigate detailed electronic and linear optical pro…
Electronic structures and optical properties of layered perovskites Sr_2MO_4 (M=Ti, V, Cr, and Mn): An ab initio study
Hongming Weng, Y. Kawazoe, Xiangang Wan +1
A series of layered perovskites SrO (=Ti, V, Cr, and Mn) is studied by calculations within generalized gradient approximation (GGA) and GGA+ schemes…