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Investigation of the structural and acidic properties of bulk offretite using first principles molecular dynamics
J. Weber, L. Campana, A. Selloni, A. Pasquarello, I. Papai and A. Goursot
in "Thermodynamic Modeling and Materials Data Engineering"
(J.P. Caliste, A. Truyol and J.H. Westbrook, eds.), Springer, Berlin,
(1998), p129-134
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