Ab-initio probe into the elastic, mechanical and thermo-mechanical properties of CsSe binary compound
RS Sunmonu, OY Fadimu, OI Sonde - International Journal of …, 2023 - World Scientific
First principles computational simulations were performed using Quantum ESPRESSO
package within the framework of Density Functional Theory (DFT) in order to analyze the …
package within the framework of Density Functional Theory (DFT) in order to analyze the …
Ab-initio Assessment of the Electronic, Mechanical, Thermal, Optical and Phonon Properties of B3-AlAs
The applications of group III–V minerals are closely linked to their structural and
compositional polymorphs and have drawn great attention due to their vast electronic and …
compositional polymorphs and have drawn great attention due to their vast electronic and …
First-Principles Study of the Half-Metallic Properties of (001),(110), and (111) Surfaces of RbSe in the CsCl Structure
OR Jolayemi, BI Adetunji, IJ Onuorah… - Journal of Electronic …, 2021 - Springer
We extend the study on the half-metallic ferromagnetism in bulk caesium chloride RbSe
compound [H. Xie, R. Ma, Q. Gao, L. Li, and J. Deng, Chemical Physics Letters 661, 89–93 …
compound [H. Xie, R. Ma, Q. Gao, L. Li, and J. Deng, Chemical Physics Letters 661, 89–93 …