Dynamics and excitations of a solvated electron in molecular clusters

R. N. Barnett*, Uzi Landman, Abraham Nitzan

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

Abstract

A method for investigations of the ground and excited states and the dynamical evolution of coupled quantum-classical systems is presented. A time-dependent self-consistent-field procedure is used where the time evolution of the wave function is evaluated with use of fast Fourier transforms and the coupled classical motion is treated via classical molecular dynamics. Different modes of simulations are demonstrated for electron attachment to NaCl and water clusters.

Original languageEnglish
Pages (from-to)2178-2181
Number of pages4
JournalPhysical Review A
Volume38
Issue number4
DOIs
StatePublished - 1988

Fingerprint

Dive into the research topics of 'Dynamics and excitations of a solvated electron in molecular clusters'. Together they form a unique fingerprint.

Cite this