Novel lithium-nitrogen compounds at ambient and high pressures

Using ab initio evolutionary simulations, we predict the existence of five novel stable Li-N compounds at pressures from 0 to 100 GPa (Li(13)N, Li(5)N, Li(3)N(2), LiN(2), and LiN(5)). Structures of these compounds contain isolated N atoms, N(2) dimers, polyacetylene-like N chains and N(5) rings, res...

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Detalles Bibliográficos
Autores principales: Shen, Yanqing, Oganov, Artem R., Qian, Guangri, Zhang, Jin, Dong, Huafeng, Zhu, Qiang, Zhou, Zhongxiang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2015
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4570992/
https://www.ncbi.nlm.nih.gov/pubmed/26374272
http://dx.doi.org/10.1038/srep14204

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4570992/
https://www.ncbi.nlm.nih.gov/pubmed/26374272
http://dx.doi.org/10.1038/srep14204

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