2 papers
cond-mat.mtrl-sci2020
Structure and charge transport of amorphous -doped : An ab initio study
Rajendra Thapa, Bishal Bhattarai, M. N. Kozicki +2
In this paper, we present ab initio computer models of Cu-doped amorphous Ta2O5 , a promising candidate for Conducting Bridge Random Access Memory (CBRAM) memory devices, and study…
cond-mat.mtrl-sci2019
Ab initio inversion of structure and the lattice dynamics of a metallic glass: The case of Pd40Ni40P20
Bishal Bhattarai, Rajendra Thapa, David A. Drabold
In this paper we infer the structure of Pd40Ni40P20 from experimental diffraction data and ab initio interactions using Force Enhanced Atomic Refinement (FEAR). Our model accuratel…