2 papers
cond-mat.mtrl-sci2013
Interatomic potential for the calculation of barrier distributions in amorphous oxides
J. P. Trinastic, R. Hamdan, Y. Wu +2
Amorphous oxides are important for implants, optics, and gate insulators. Understanding the effects of oxide doping is crucial to optimize performance. Here we report energy barrie…
cond-mat.str-el2009
Accurate projected augmented wave datasets for BaFeAs
Chao Cao, Yu-ning Wu, Rashid Hamdan +2
By carefully choosing parameters and including more semi-core orbitals as valence electrons, we have constructed a high quality projected augmented wave (PAW) dataset that yields r…