We study with variational Monte Carlo simulations a single ion impurity in nanodroplets and in liquid He-4. Within the shadow wave function (SWF) approach we have studied alkali-earth ion doped He-4 systems (Be+ and Mg+) and we have also improved our previous variational results for alkali ion impurities (Na+, K+, and Cs+). The new SWF allows for anisotropic correlations between He-4 atoms and the ion. The first shell of He-4 atoms around the ions has always a well defined solidlike structure, which is remarkably different for each ion but it does not depend on the He-4 system (bulk liquid or cluster). We also give results for the chemical potential, the single particle excitation spectrum, and the effective mass of the ions in the bulk.
Alkali and alkali-earth ions in 4He systems / M. Rossi, M. Verona, D.E. Galli, L. Reatto. - In: PHYSICAL REVIEW. B, CONDENSED MATTER AND MATERIALS PHYSICS. - ISSN 1098-0121. - 69:21(2004), pp. 212510.212510-1-212510.212510-4.
Alkali and alkali-earth ions in 4He systems
M. RossiPrimo
;D.E. GalliPenultimo
;L. ReattoUltimo
2004
Abstract
We study with variational Monte Carlo simulations a single ion impurity in nanodroplets and in liquid He-4. Within the shadow wave function (SWF) approach we have studied alkali-earth ion doped He-4 systems (Be+ and Mg+) and we have also improved our previous variational results for alkali ion impurities (Na+, K+, and Cs+). The new SWF allows for anisotropic correlations between He-4 atoms and the ion. The first shell of He-4 atoms around the ions has always a well defined solidlike structure, which is remarkably different for each ion but it does not depend on the He-4 system (bulk liquid or cluster). We also give results for the chemical potential, the single particle excitation spectrum, and the effective mass of the ions in the bulk.Pubblicazioni consigliate
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