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Formation of the –N(NO)N(NO)– polymer at high pressure and stabilization at ambient conditions

A number of exotic structures have been formed through high-pressure chemistry, but applications have been hindered by difficulties in recovering the high-pressure phase to ambient conditions (i.e., one atmosphere and 300 K). Here we use dispersion-corrected density functional theory [PBE-ulg (Perde...

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Detalhes bibliográficos
Main Authors: Xiao, Hai, An, Qi, Goddard, William A., Liu, Wei-Guang, Zybin, Sergey V.
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3619361/
https://ncbi.nlm.nih.gov/pubmed/23503849
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1222890110
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