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Understanding Surface Characteristics and 2-Mercaptobenzothiazole Adsorption on Pyrite, Arsenopyrite and Chalcopyrite Surfaces Using DFT Approach

Elastic and thermal parameters of lanthanide-orthophosphate (LnPO4) ceramics from atomistic simulations - ScienceDirect

Unleashing Photocarrier Transport in Mesoporous Single‐Crystalline LaTiO2N for High‐Efficiency Photocatalytic Water Splitting - Wang - Advanced Energy Materials - Wiley Online Library

Computational Simulations to Predict the Morphology of Nanostructures and Their Properties

AntiOS-1/identity_data.py at master · Sts0mrg0/AntiOS-1 · GitHub

Understanding Surface Characteristics and 2-Mercaptobenzothiazole Adsorption on Pyrite, Arsenopyrite and Chalcopyrite Surfaces Using DFT Approach

On the stability of hydroxyl groups on substituted titania - Physical Chemistry Chemical Physics (RSC Publishing) DOI:10.1039/C9CP05525H

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comp anies - maa tskappye - ("CIPC")is

Epitaxial TiOx Surface in Ferroelectric BaTiO3: Native Structure and Dynamic Patterning at the Atomic Scale - Barzilay - 2020 - Advanced Functional Materials - Wiley Online Library

Effect of carbon content and electronic strong correlation on the mechanical and thermodynamic properties of ytterbium carbides - RSC Advances (RSC Publishing) DOI:10.1039/C5RA23189B