Universidad Nacional Autónoma de México
Instituto de Investigaciones en Materiales
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Molecular dynamics study of the Ag/sub 6/ cluster using an ab initio many-body model potential.

Garzon, I.L. Kaplan, I.G. Santamaria, R. Novaro, O.

Molecular dynamics study of the Ag/sub 6/ cluster using an ab initio many-body model potential. - 1998. - Vol. 109, no. 6, 8 Aug., pp. 2176-2184. = Journal of Chemical Physics

Ab initio calculations Atomic clusters Isomerisation Many-body problems Metal clusters Molecular dynamics method Potential energy surfaces Silver


Molecular dynamics study
Ag/sub 6/ cluster
ab initio many-body model potential
ab initio energy surfaces
Many-body nonadditive effects
Structural properties
Dynamical properties
Two-dimensional isomers
C/sub 2u/ symmetry
C/sub 2h/ symmetry
Potential surface
Simulated quenching technique
Thermal stability
Cluster temperature
Two-step isomerization
Cluster configurations
Cluster fragmentation
Dimer evaporation
300 K
500 K

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