Wanda Andreoni, Giorgio Pastore
Physical Review B
We show that new aspects of the physics of microclusters can be investigated accurately with ab initio molecular dynamics. We present results on a number of properties of SiN aggregates (N up to 10) at both zero and finite temperatures. The results of dynamical simulated annealing for the ground state point to a complex growth sequence. Simulations at finite temperatures show the existence of two regimes, solidlike and liquidlike, with substantially different electronic and structural properties. © 1988 The American Physical Society.
Wanda Andreoni, Giorgio Pastore
Physical Review B
Wanda Andreoni, Carlo A. Pignedoli
Applied Physics Letters
Tiziana Mordasini, Alessandro Curioni, et al.
ChemBioChem
Henrik Grönbeck, Arne Rosén, et al.
Zeitschrift fur Physik D-Atoms Molecules and Clusters