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First principle studies of ammonium chloride under high pressure

We performed a thorough high-pressure structural exploration of ammonium chloride up to 300 GPa by ab initio calculations. Two new phases, namely, P2(1)/m and Cmma, were predicted to be stable within the pressure ranges of 71–107 and 107–300 GPa, respectively. Like the known phase IV and V, the two...

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Detalles Bibliográficos
Autores principales:	Lu, Mengya, Tian, Fubo, Zhou, Qiang, Cui, Tian
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2021
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8694683/ https://www.ncbi.nlm.nih.gov/pubmed/35424432 http://dx.doi.org/10.1039/d0ra09718g

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