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The polymerization of nitrogen in Li(2)N(2) at high pressures
The polymerization of nitrogen can be used as high energy density materials. The crystal structures of Li(2)N(2) at high pressures are explored by using the first-principles method combined with evolutionary algorithm. The phase transitions Pmmm → Immm → Pnma → Cmcm-1 → I4(1)/acd are predicted in th...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6120935/ https://www.ncbi.nlm.nih.gov/pubmed/30177855 http://dx.doi.org/10.1038/s41598-018-31355-z |