31 citations · 54 across the 4 of their papers we have counts for
6 papers
Ab initio study of the atomic motion in liquid metal surfaces: comparison with Lennard-Jones systems
Luis E. Gonzalez, David J. Gonzalez
It is established that liquid metals exhibit surface layering at the liquid-vapor interface, while dielectric simple systems, like those interacting through Lennard-Jones potential…
Surface structure in simple liquid metals. An orbital free first principles study
David J. Gonzalez Luis E. Gonzalez, Malcolm J. Stott
Molecular dynamics simulations of the liquid-vapour interfaces in simple sp-bonded liquid metals have been performed using first principles methods. Results are presented for liqui…
Temperature dependent surface relaxation for Al(110) and Mg(10-10) studied by orbital free ab initio molecular dynamics
Luis E. Gonzalez, David J. Gonzalez
We have performed orbital free ab initio molecular dynamics simulations in order to study the thermal behaviour of two open surfaces of solid metallic systems, namely the (110) fac…
Pressure induced structural and dynamical changes in liquid Si. An ab-initio study
A. Delisle, D. J. Goznalez, M. J. Stott
The static and dynamic properties of liquid Si at high-pressure have been studied using the orbital free ab-initio molecular dynamics method. Four thermodynamic states at pressures…
Interplay between the ionic and electronic density profiles in liquid metal surfaces
L. E. Gonzalez, D. J. Gonzalez, M. J. Stott
First principles molecular dynamics simulations have been performed for the liquid-vapor interfaces of liquid Li, Mg, Al and Si. We analize the oscillatory ionic and valence electr…
Viscoelastic model for the dynamic structure of binary systems
Napoleon Anento, Luis E. Gonzalez, David J. Gonzalez +2
This paper presents the viscoelastic model for the Ashcroft-Langreth dynamic structure factors of liquid binary mixtures. We also provide expressions for the Bhatia-Thornton dynami…