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physics.atm-clus2001
An Ab Initio Study of the Structures and Relative Stabilities of Doubly Charged [(NaCl)m(Na)2]2+ Cluster Ions
Andres Aguado
We present ab initio perturbed ion calculations on the structures and relative stabilities of doubly charged [(NaCl)_m(Na)_2]2+ cluster ions. The obtained stabilities show excellen…
physics.atm-clus2000
Structures and Stabilities of CaO and MgO Clusters and Cluster Ions: An alternative interpretation of the experimental mass spectra
Andres Aguado, Jose M. Lopez
The structures and relative stabilities of doubly-charged nonstoichiometric (CaO)Ca (n=1--29) cluster ions and of neutral stoichiometric (MgO) and (CaO) (n=3,6,9…
physics.atm-clus1999
Melting in large sodium clusters: An orbital-free molecular dynamics study
Andres Aguado, Jose M. Lopez, Julio A. Alonso +1
The melting-like transition in sodium clusters Na_N, with N=55, 92, and 142 is studied by using constant-energy molecular dynamics simulations. An orbital-free version of the Car-P…