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Acoustic modes in metallic nanoparticles: atomistic versus elasticity modeling

2009

The validity of the linear elasticity theory is examined at the nanometer scale by investigating the vibrational properties of silver and gold nanoparticles whose diameters range from about 1.5 to 4 nm. Comparing the vibration modes calculated by elasticity theory and atomistic simulation based on the Embedded Atom Method, we first show that the anisotropy of the stiffness tensor in elastic calculation is essential to ensure a good agreement between elastic and atomistic models. Second, we illustrate the reduction of the number of vibration modes due to the diminution of the number of atoms when reducing the nanoparticles size. Finally, we exhibit a breakdown of the frequency-spectra scalin…

Materials scienceNanostructurePACS: 63.22.-m 63.22.Kn 81.05BxFOS: Physical sciencesNanotechnology02 engineering and technology01 natural sciencesNormal mode0103 physical sciencesAtomPhysics::Atomic and Molecular ClustersElasticity (economics)010306 general physicsAnisotropyScalingStiffness matrix[PHYS.MECA.VIBR]Physics [physics]/Mechanics [physics]/Vibrations [physics.class-ph]Condensed Matter - Materials ScienceCondensed matter physicsLinear elasticity[SPI.MECA.VIBR]Engineering Sciences [physics]/Mechanics [physics.med-ph]/Vibrations [physics.class-ph]Materials Science (cond-mat.mtrl-sci)021001 nanoscience & nanotechnologyCondensed Matter Physics[ SPI.MECA.VIBR ] Engineering Sciences [physics]/Mechanics [physics.med-ph]/Vibrations [physics.class-ph]Electronic Optical and Magnetic Materials[ PHYS.MECA.VIBR ] Physics [physics]/Mechanics [physics]/Vibrations [physics.class-ph]0210 nano-technology
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