Cargando…

Data sets of predicted stable and meta-stable crystalline phase structural of NB-N system under pressure

This document presents a dataset on various stoichiometric Niobium nitrides compounds under different pressures, which have been identified by first-principles calculations in combination with an evolutionary algorithm methodology implemented in the USPEX code in its variable-composition mode. The f...

Descripción completa

Detalles Bibliográficos
Autores principales: Restrepo-Leal, Diego, Sierra-Ortega, José, Escorcia-Salas, Gene Elizabeth
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7399131/
https://www.ncbi.nlm.nih.gov/pubmed/32775570
http://dx.doi.org/10.1016/j.dib.2020.106054