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THE ROLE OF CLAY CHARGE IN THE MOBILITY OF COMPENSATING CATIONS: AN APPROACH FROM MOLECULAR DYNAMICS.

The charge of clays plays an important role in the mobility of compensating cations and in swelling processes. In this work we have developed a method to generate Lithium Fluorhectorite (Li-Fh) clay models with a charge of -1.2e and a non-homogeneous charge distribution. This charge is closer to the...

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Publicado en:Revista Cubana de Física Vol. 42; no. 1; pp. 37 - 44
Autores principales: MARRERO-PÉREZ, C. D., ROJAS-LORENZO, G., Lam, A.
Formato: Artículo
Publicado: Universidad de La Habana 7/15/2025
Materias:
Molecular dynamics
Kirkendall effect
Structural dynamics
Computer simulation
Diffusion coefficients
Acceso en línea:Ver este registro en EBSCOhost