The actinide oxides have been extensively studied in the context of the nuclear fuel cycle.
They are also of fundamental interest as members of a class of strongly correlated materials …

For over a century, platinum oxides find technologically relevant applications in various
fields ranging from catalysis to electrochemistry and nanoelectronics. We have performed a …

We assess two newly developed exchange-correlation functionals on four bulk phases of
zinc oxide (ZnO) and compare results with conventional local density and the Perdew-Burke …

The total cross sections of electron-impact single-K-shell ionization of 14 atomic targets
ranging from H to U (1⩽ Z⩽ 92) are calculated using a modified version of the BELI formula …

A generalized binary-encounter-Bethe (GBEB) model is proposed to calculate the partial
ionization cross sections of all shells. The present model improves the original version of …

Platinum plays an important role in catalysis and electrochemistry, and it is known that the
direct interaction of oxygen with Pt surfaces can lead to the formation of platinum oxides (PtO …

Published experimental photon and electron impact ionization cross sections of CH4 have
been reviewed and analyzed. Absolute partial ionization oscillator strengths (fij) for CH4+ …

We present the results of ground state electronic structure calculations of the zinc-blende
and rocksalt phases of binary platinum nitride (PtN) using density functional theory. Several …

In this paper, the K-shell ionization cross sections of Si element in the threshold energy
region of 3–25 keV have been measured by using the thick-target method. With the Monte …

In this paper, the Tikhonov regularization method and the classical molecular dynamics
method are used to deal with the inverse problem involved in the measurement of inner …