PUBLICATIONS
Journal Publications2010
J. A. Thomas, J. E. Turney, R. M. Iutzi, C. H. Amon, and A. J. H. McGaughey,
"Predicting
phonon dispersion relations and lifetimes from the spectral
energy density." To appear in Physical
Review B.
J. E. Turney, A.
J. H. McGaughey, and C. H. Amon, "In-plane
phonon transport in thin films."
Journal of Applied Physics
107 (2010) 024317.
E. S. Landry and A. J. H. McGaughey,
"Effect
of film thickness on the thermal resistance of confined
semiconductor thin films."
Journal of Applied Physics
107 (2010) 013521.
J. A. Thomas, R. M. Iutzi, and A. J. H. McGaughey,
"Thermal
conductivity and phonon transport in empty and water-filled
carbon nanotubes."
Physical Review B
81 (2010) 045413.
J. A. Thomas, A. J. H. McGaughey, and O. Kuter-Arneback,
"Pressure-driven
water flow through carbon nanotubes: Insights from molecular
dynamics simulations."
International Journal of Thermal Sciences
49 (2010) 481-489.
2009
M. Lee and A. J. H. McGaughey, "Energetics
of oxygen embedment into unreconstructed and reconstructed
Cu(100) surfaces: Density functional theory calculations."
Surface Science
603 (2009) 3404-3409.
E. S. Landry and A. J. H. McGaughey,
"Thermal
boundary resistance predictions from molecular dynamics
simulations and theoretical calculations."
Physical Review B
80 (2009) 165304.
J. E. Turney, A.
J. H. McGaughey, and C. H. Amon, "Assessing the
applicability of quantum corrections to classical thermal
conductivity predictions."
Physical Review B
79 (2009) 224305. J. A. Thomas and A. J. H. McGaughey, "Water
flow in carbon nanotubes: Transition to subcontinuum flow."
Physical Review Letters
102 (2009) 184502. E. S. Landry and A. J. H. McGaughey,
"Effect
of interfacial species mixing on phonon transport in
semiconductor superlattices."
Physical Review B
79 (2009) 075316. J. E. Turney, E. S. Landry, A.
J. H. McGaughey, and C. H. Amon,
"Predicting
phonon properties and thermal conductivity from anharmonic
lattice dynamics calculations and molecular dynamics
simulations."
Physical Review B
79 (2009) 064301. S.
Shenogin, A. Bodapati, P. Keblinski, and A. J. H. McGaughey,
"Predicting
the thermal conductivity of inorganic and polymeric glasses:
The role of anharmonicity."
Journal of Applied Physics
105 (2009) 034906.
S. E. Jee, A J. H.
McGaughey, and D. S. Sholl, "Molecular simulations of
hydrogen and methane permeation through pore mouth modified
zeolite membranes."
Molecular Simulation
35 (2009) 70-78. 2008
J. A. Thomas and A. J. H. McGaughey, "Reassessing fast water
transport through carbon nanotubes."
Nanoletters
8 (2008) 2788-2793.
E. S. Landry, M. I.
Hussein, and A J. H. McGaughey, "Complex
superlattice unit cell designs for reduced thermal
conductivity."
Physical Review B
77 (2008) 184302.
Paper selected to appear in Virtual Journal of Nanoscale Science &
Technology, May 19, 2008 issue. J. A. Thomas and A. J. H.
McGaughey, "Density,
distribution, and orientation of water molecules inside and
outside carbon nanotubes,"
Journal of Chemical Physics
128 (2008) 084715. 2007 E. S. Landry, S.
Mikkilineni, M. Paharia, and A. J. H. McGaughey, "Droplet
Evaporation: A Molecular Dynamics Investigation."
Journal of Applied Physics
102 (2007) 124301. Paper selected to
appear in Virtual Journal of Nanoscale Science &
Technology, January 7, 2008 issue. J. A. Thomas and A. J. H.
McGaughey, "Effect of surface wettability on liquid
density, structure, and diffusion near a solid surface,"
Journal of Chemical Physics
126 (2007) 034707. Paper selected to
appear in Virtual Journal of Nanoscale Science &
Technology, February 5, 2007 issue. B. L. Huang, A. J. H.
McGaughey, and M. Kaviany, "Thermal conductivity of
metal-organic framework 5 (MOF-5): Part I. Molecular
dynamics simulations,"
International Journal of Heat and Mass
Transfer 50 (2007) 393-404. B. L. Huang,
Z. Ni, A. Millward, A. J. H.
McGaughey, C. Uher, M. Kaviany, and O. Yaghi "Thermal conductivity of
metal-organic framework 5 (MOF-5): Part II. Measurement,"
International Journal of Heat and Mass
Transfer 50 (2007) 405-411.
2004-2006 A. J. H. McGaughey, M. I.
Hussein, E. S. Landry, M. Kaviany, and G. M. Hulbert, "Phonon
Band Structure and Thermal Transport Correlation in a
Layered Diatomic Crystal,"
Physical Review B
74 (2006) 104304. A. J. H. McGaughey and M. Kaviany, "Observation and
description of phonon interactions in molecular dynamics
simulations,"
Physical Review B 71,
184305-1-11 (2005). S. R. Phillpot and A. J. H. McGaughey, "Introduction to
thermal transport,"
Materials Today, June 2005,
18-20. J. D. Chung, A. J. H. McGaughey, and M. Kaviany, "Role of
phonon dispersion in lattice thermal conductivity analysis,"
Journal of Heat Transfer 126, 376-380 (2004).
A. J. H. McGaughey and M. Kaviany, "Quantitative validation
of the Boltzmann transport equation phonon thermal
conductivity model under the single-mode relaxation time
approximation,"
Physical Review B 69,
094303-1-12 (2004).
A. J. H. McGaughey and M. Kaviany, "Thermal conductivity
decomposition and analysis using molecular dynamics
simulations. Part I. Lennard-Jones argon,"
International
Journal of Heat and Mass Transfer 47, 1783-1798
(2004).
A. J. H. McGaughey and M. Kaviany, "Thermal conductivity
decomposition and analysis using molecular dynamics
simulations. Part II. Complex silica crystals,"
International Journal of Heat and Mass Transfer 47,
1799-1816 (2004).
2002-2003 A. J. H. McGaughey and C. A. Ward, ``Stability of a droplet
in a finite system: Consideration of the solid-vapor
interface,"
Journal of Applied Physics 93,
3619-3626 (2003).
A. J. H. McGaughey and C. A. Ward, "Temperature
discontinuity at the surface of an evaporating droplet,"
Journal of Applied Physics 91, 6406-6415 (2002).
Selected Conference Papers A. J. H. McGaughey and J.
J. Michalek, "Wiki-based learning in the mechanical
engineering classroom,"
ASEE paper AC 2008-1627,
presented at 2008 ASEE Annual Conference, June 2008,
Pittsburgh, PA.
Presentation slides. A. J. H. McGaughey and J. Li, "Molecular
dynamics prediction of the thermal resistance of solid-solid
interfaces in superlattices,"
ASME paper
IMECE2006-13590, presented at 2006 ASME IMECE,
November 2006, Chicago, IL.
Book Chapters
A. J. H. McGaughey and M. Kaviany, "Phonon transport in
molecular dynamics simulations: Formulation and thermal
conductivity prediction."
Advances in Heat
Transfer, Volume 39,
169-255 (Academic Press, 2006).
Theses
J. E. Turney, "Predicting
phonon properties and thermal conductivity using anharmonic
lattice dynamics calculations." Ph.D. Thesis, Carnegie
Mellon University, 2009.
E. S. Landry, "Thermal
transport by phonons across semiconductor interfaces, thin
films, and superlattices." Ph.D. Thesis, Carnegie
Mellon University, 2009.
A. J. H. McGaughey, "Phonon transport in molecular
dynamics simulations: formulation and thermal conductivity
prediction."
Ph.D. thesis, University of Michigan,
2004.
A. J. H. McGaughey, "The evaporation and stability of a
droplet in a finite system." M.A.Sc. thesis, University of
Toronto, 2000.
|
Home
People
Research
Publications
Courses
Links
LABlog |