T. Nakazawa

High energy heavy ion induced structural disorder in Li2TiO3

Ab initio calculations of Fe–Ni clusters

Density functional investigation of Fen clusters (n ≤ 6) with Cr substitutions: UB3LYP/LanL2DZ calculation

A density functional theory investigation of the reactions of Fe and FeO2 with O2

Structural, bonding, and magnetic properties of Fen–xSix (n, x ⩽ 6) clusters: Theoretical investigation based on density functional theory

Structural, bonding, and magnetic properties of small Fen–xMox (n, x ≤ 6) clusters

Density functional calculations for small iron clusters with substitutional phosphorus

Fast calculation approach to semi-empirical molecular orbital method using real space division method

Ab initio calculations of FeNi clusters

Density functional theory study on the geometric and electronic structures of Fe 2 O 2 and the reaction of Fe 2 + O 2