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Keywords: potential energy functions
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Journal Articles
Publisher: ASME
Article Type: Research Papers
J. Heat Mass Transfer. January 2010, 132(1): 012401.
Published Online: October 22, 2009
... a period of time. Additionally, silicon dispersion relations are directly determined from the equipartition theorem obtained from the normal mode decomposition. The impact of the anharmonic nature of the potential energy function on the thermal expansion of the crystal is determined by computing...
Journal Articles
Publisher: ASME
Article Type: Technical Papers
J. Heat Mass Transfer. June 2007, 129(6): 705–716.
Published Online: September 15, 2006
... conductivity molecular dynamics simulation phonon single-wall carbon nanotube carbon nanotubes thermal conductivity molecular dynamics method phonon dispersion relations ballistic transport stress effects potential energy functions 21 12 2005 15 09 2006 2007 American Society...
Journal Articles
In-Plane and Out-Of-Plane Thermal Conductivity of Silicon Thin Films Predicted by Molecular Dynamics
Publisher: ASME
Article Type: Research Papers
J. Heat Mass Transfer. November 2006, 128(11): 1114–1121.
Published Online: April 6, 2006
... conductivity varies linearly with the film thickness, and is temperature-independent for temperatures near or above the Debye’s temperature. thermal conductivity silicon elemental semiconductors semiconductor thin films molecular dynamics method Green's function methods potential energy functions...