Ab-initio study of the vibrational properties of Mg(AlH$_4$)$_2$

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Based on Density Functional Theory and Density Functional Perturbation Theory we have studied the thermodynamical and vibrational properties of Mg(AlH$_4$)$_2$.
Eleonora Spanò and Marco Bernasconi

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Materials Science

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http://salesiana.dossiersoluciones.com/handle/123456789/25173

Consulte el texto completo en el siguiente enlace:

https://arxiv.org/abs/cond-mat/0410759
 http://arxiv.org/abs/cond-mat/0410759

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arXiv