Network topology for the formation of solvated electrons in binary CaO–Al(2)O(3) composition glasses

Glass formation in the CaO–Al(2)O(3) system represents an important phenomenon because it does not contain typical network-forming cations. We have produced structural models of CaO–Al(2)O(3) glasses using combined density functional theory–reverse Monte Carlo simulations and obtained structures tha...

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Detalhes bibliográficos
Main Authors: Akola, Jaakko, Kohara, Shinji, Ohara, Koji, Fujiwara, Akihiko, Watanabe, Yasuhiro, Masuno, Atsunobu, Usuki, Takeshi, Kubo, Takashi, Nakahira, Atsushi, Nitta, Kiyofumi, Uruga, Tomoya, Weber, J. K. Richard, Benmore, Chris J.
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2013
Assuntos:
Physical Sciences
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3690860/
https://ncbi.nlm.nih.gov/pubmed/23723350
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1300908110
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