Ab initio calculations Amorphisation Atomic clusters Bonds (chemical) Density functional theory Gold Internal stresses Metal clusters Nanostructured materials Potential energy functions
Metallic bonding Cluster structure Many-body semiempirical Gupta potential Global minimization First principles density functional calculations Energy ordering Local minima Intermediate-size disordered nanoclusters Au Lowest-energy ordered structure Magic cluster sizes Compact-ordered structure Local stress analysis Amorphization Pair potentials Surface bond contraction Surface bond coordination Bond length Coordination disorder Amorphous structure