... mode propagation in nanostructures of varying geometry. 01 12 2010 22 08 2011 14 02 2012 14 02 2012 elemental semiconductors Fourier analysis heat transfer molecular dynamics method phonon spectra silicon thermal conductivity waveguides molecular dynamics heat...

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... , “ Quasiharmonic Models for the Calculation of Thermodynamic Properties of Crystalline Silicon Under Strain ,” J. Appl. Phys. 0021-8979 , 99 ( 6 ), p. 064314 . 10.1063/1.2185834 Nosé , S. , 1984 , “ A Unified Formulation of the Constant Temperature Molecular Dynamics Methods ,” J. Chem. Phys...

.... 6198 – 6207 . 31 03 2008 05 08 2008 11 02 2009 condensation drops free energy molecular dynamics method nucleation organic compounds surface energy phase transition nucleation molecular dynamics Nucleation processes in vapors at very high...

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... 1089-5647 10.1021/jp034445w , 107 , pp. 9214 – 9219 . 05 07 2007 11 10 2007 11 07 2008 diffusion gold laser sintering molecular dynamics method nanoparticles necking nanoparticles sintering laser molecular dynamics simulation neck growth In this study...

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... of Molecular Dynamics Simulation Approaches ,” Proceedings of the Thirteenth International Heat Transfer Conference , Sydney , Australia , August 8–13, NAN-29. 21 12 2005 15 09 2006 carbon nanotubes thermal conductivity molecular dynamics method phonon dispersion relations...