Centro de Nanociencia y Tecnologías Sostenibles (CNATS)
Centro de investigación
Rafael
Rodríguez Pappalardo
Publicacións nas que colabora con Rafael Rodríguez Pappalardo (5)
2004
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A molecular dynamics study on Rh3+ hydration: Development and application of a first principles hydrated ion-water interaction potential
Theoretical Chemistry Accounts, Vol. 111, Núm. 2-6, pp. 101-109
2003
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Interplay of computer simulations and x-ray absorption spectra in the study of the bromide hydration structure
Journal of Chemical Physics, Vol. 119, Núm. 13, pp. 6647-6654
2001
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Combination of XANES spectroscopy and molecular dynamics to probe the local structure in disordered systems
Physical Review B - Condensed Matter and Materials Physics, Vol. 64, Núm. 9
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Molecular-dynamics-based investigation of scattering path contributions to the EXAFS spectrum: The (formula presented) aqueous solution case
Physical Review B - Condensed Matter and Materials Physics, Vol. 64, Núm. 1
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Molecular-dynamics-based investigation of scattering path contributions to the EXAFS spectrum: The Cr3+ aqueous solution case
Physical Review B - Condensed Matter and Materials Physics, Vol. 64, Núm. 1, pp. 122011-122014