In this paper, semiempirical formula for the bulk modulus (B in GPa) of perovskite structured
solids are elaborated in terms of lattice constant (a in Å) and product of ionic charges …

First-principles calculations are used to investigate the effects of the epitaxial strain on the
structure of the perovskite oxide CaTiO 3. At 1.5% tensile strain, we find an epitaxial …

In this work, we investigate calcium titanate [CaTiO 3 (CTO)] using x-ray diffraction and
Raman spectroscopy up to 60 GPa and 55 GPa, respectively. Both experiments show that …

We present a throughout multivariate technique in order to predict the formability of
perovskites and inverse perovskites compounds, on the basis of the unified atomic-ionic …

An investigation into the structural stabilities and the electronic and optical properties of Ca F
2 under high pressure was conducted using first-principles calculations based on density …

The phase transitions, electronic structures and optical properties of Mg2Si under high
pressure were researched by using the first-principles density functional theory. The …

C mcm Ca Ir O 3 is isostructural to the newly discovered high-pressure postperovskite
polymorph of Mg Si O 3. Due to the high transition pressure in Mg Si O 3 over 100 GPa, low …

The structural stability of manganese titanate MnTiO3 at high pressure was investigated by X-
ray diffraction and Raman spectroscopy with diamond anvil cells. Ilmenite-type MnTiO3 is …

We present in this work a strategy for predicting new oxide perovskites with the potential for
achieving high ionic conductivity for applications as a solid oxide fuel cell (SOFC). We …

This research investigates the high-pressure behavior of the Ca (Ti0. 95Ge0. 05) O3
perovskite, a candidate of the locked-tilt perovskite family (orthorhombic compounds …