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Keywords: molecular dynamics simulation
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Journal Articles
Publisher: ASME
Article Type: Technical Briefs
J. Heat Mass Transfer. May 2021, 143(5): 054501.
Paper No: HT-19-1143
Published Online: March 19, 2021
... . The theoretical prediction made a good agreement with the measured specific heat values from the literature with an error less than 3%. Additional verification of the proposed model was performed by a Molecular Dynamics simulation study. The simulated specific heat of pure molten salt eutectic made a good...
Journal Articles
Publisher: ASME
Article Type: Research-Article
J. Heat Mass Transfer. March 2020, 142(3): 031401.
Paper No: HT-19-1414
Published Online: January 29, 2020
... molecular dynamics simulation monohydric alcohols The rapid development of technologies has promoted energy demand considerably, which has also caused environmental pollution owing to the huge amount of fossil fuel consumption. Great interests have thus been aroused in the investigations of solar...
Journal Articles
Journal Articles
Publisher: ASME
Article Type: Research-Article
J. Heat Mass Transfer. March 2019, 141(3): 032401.
Paper No: HT-17-1735
Published Online: January 14, 2019
... nanoparticles and the liquid is lower than that of energy between spherical nanoparticles and the liquid; consequently, the thermal conductivity of nanofluid with spherical nanoparticles is higher than that of nanofluid with cylindrical nanoparticles. In summary, the molecular dynamics simulations...
Journal Articles
Publisher: ASME
Article Type: Research-Article
J. Heat Mass Transfer. September 2015, 137(9): 091001.
Paper No: HT-13-1562
Published Online: May 14, 2015
... received August 12, 2014; published online May 14, 2015. Assoc. Editor: Yogesh Jaluria. 04 11 2013 12 08 2014 dynamic wetting evaporating nanodroplet molecular dynamics simulation Dynamic wetting of fluids on solid surfaces is of great importance in various practical...
Journal Articles
Publisher: ASME
Article Type: Research-Article
J. Heat Mass Transfer. October 2014, 136(10): 102401.
Paper No: HT-13-1369
Published Online: July 15, 2014
... to hydrophilic character [ 10 , 11 ]. Therefore, in order to tailor the heat conduction across the interface for developing novel thermal devices, it is of critical importance to understand the interfacial thermal energy transfer in terms of affinity. molecular dynamics simulation heat conduction self...
Journal Articles
Journal Articles
Publisher: ASME
Article Type: Research Papers
J. Heat Mass Transfer. October 2011, 133(10): 101501.
Published Online: August 11, 2011
...Ian A. Cosden; Jennifer R. Lukes Molecular dynamics simulations are performed to calculate the surface tension of bubbles formed in a metastable Lennard–Jones (LJ) argon fluid. The calculated normal and transverse pressure components are used to compute a surface tension which is compared...
Journal Articles
Journal Articles
Publisher: ASME
Article Type: Technical Papers
J. Heat Mass Transfer. June 2007, 129(6): 705–716.
Published Online: September 15, 2006
... dynamics simulation results range from several hundred to 6600 W∕m K and existing theoretical predictions range from several dozens to 9500 W∕m K. To clarify the several-order-of-magnitude discrepancy in the literature, this paper utilizes molecular dynamics simulation to systematically examine the thermal...
Journal Articles
Publisher: ASME
Article Type: Technical Papers
J. Heat Mass Transfer. August 2001, 123(4): 741–748.
Published Online: November 20, 2000
...J. H. Walther, Postdoctoral Fellow; P. Koumoutsakos, Professor Molecular dynamics simulations are used to study the sub-critical evaporation of a nanometer-size droplet at 300 K and 3 MPa. Classical molecular dynamics techniques are combined with an adaptive tree data structure for the construction...