3 papers
cond-mat.mes-hall2006
Theoretical study of structure and energetics of gold clusters with the EAM method
Denitsa Alamanova, Valeri G. Grigoryan, Michael Springborg
Using the Embedded Atom Method as developed by Voter and Chen in combination with the {\it variable metric/quasi-Newton} and our own {\it Aufbau/Abbau} methods, we have identified…
cond-mat.mes-hall2006
Structural and Electronic Properties of Gold Clusters
Denitsa Alamanova, Yi Dong, Habib ur Rehman +2
We study the structure and energetics of Au clusters by means of parameter-free density-functional calculations (), jellium calculations (), embedded-atom calc…
physics.atm-clus2003
Structure and energetics of Ni clusters with up to 150 atoms
V. G. Grigoryan, M. Springborg
We present a method (the Aufbau/Abbau method) for optimizing the structure of a whole series of clusters without making any assumptions on the structure. Subsequently, the method i…