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Keywords: molecular dynamics simulation
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Proceedings Papers

Proc. ASME. IMECE2020, Volume 12: Mechanics of Solids, Structures, and Fluids, V012T12A042, November 16–19, 2020
Paper No: IMECE2020-23777
... interface adhesion durability laser shock adhesion test (LaSAT) molecular dynamics simulation MOLECULAR DYNAMICS STUDY ON INTERFACIAL FRACTURE OF ALUMINUM ALLOY AND EPOXY RESIN ADHESIVE SUBJECTED TO CYCLIC LOADING Kohei KANAMORI, Yoshikatsu KIMOTO, Akio YONEZU Department of Precision Mechanics Chuo...
Proceedings Papers

Proc. ASME. IMECE2020, Volume 2A: Advanced Manufacturing, V02AT02A010, November 16–19, 2020
Paper No: IMECE2020-23859
.... Experiments can help to identify relationships, but simulation tools are needed to derive general predictions. Therefore, Molecular Dynamics Simulation (MD) is used to analyze the material removal process. By considering synchronous grinding at this level, the microstructural development of the workpiece...
Proceedings Papers

Proc. ASME. IMECE2019, Volume 12: Advanced Materials: Design, Processing, Characterization, and Applications, V012T10A035, November 11–14, 2019
Paper No: IMECE2019-12109
... are observed at elevated temperatures. SAC305 nanocrystalline molecular dynamics simulation inverse Hall-Petch decohesion ATOMISTIC INVESTIGATION ON MECHANICAL PROPERTIES OF Sn-Ag-Cu BASED NANOCRYSTALLINE SOLDER MATERIAL Mohammad Motalab1, Rafsan A.S.I. Subad, Ayesha Ahmed, Pritom Bose, Ratul Paul...
Proceedings Papers

Proc. ASME. IMECE2019, Volume 12: Advanced Materials: Design, Processing, Characterization, and Applications, V012T10A003, November 11–14, 2019
Paper No: IMECE2019-11694
...) are studied. S-S debond protein is found to favor the formation of amorphous PVDF; whereas, high temperature denatured one has stronger interactions with β phase. soy protein poly(vinylidene fluoride) molecular dynamics simulation conformational change functional modifier NUMERICAL STUDY...
Topics: Proteins
Proceedings Papers

Proc. ASME. IMECE2012, Volume 7: Fluids and Heat Transfer, Parts A, B, C, and D, 1565-1571, November 9–15, 2012
Paper No: IMECE2012-86111
... Molecular dynamics simulation electrically insulating nanofluids thermal conductivity of nanofluids In applications such as coolants in electrical devices, in addition to high heat transfer capabilities, the cooling fluids are required to have low electrical conductivity also...
Proceedings Papers

Proc. ASME. IMECE2009, Volume 14: Processing and Engineering Applications of Novel Materials, 189-198, November 13–19, 2009
Paper No: IMECE2009-10802
... 08 07 2010 The fatigue crack propagation behavior of magnesium single crystal was analyzed using molecular dynamics simulation. The inter-atomic potential used in this investigation is Embedded Atom Method (EAM) potentials. The studies of the influences of crystal orientation...
Proceedings Papers

Proc. ASME. IMECE2003, Electronic and Photonic Packaging, Electrical Systems and Photonic Design, and Nanotechnology, 815-819, November 15–21, 2003
Paper No: IMECE2003-41138
..., the interfacial bonding of SWNT reinforced epoxy composites is investigated using molecular mechanics and molecular dynamics simulations based on a cured epoxy resin model, which is constructed by incorporating three-dimensional crosslinks formed with Shell EPON 862 epoxy resin and EPI CURE W curing agent during...
Proceedings Papers

Proc. ASME. IMECE2003, Design Engineering, Volumes 1 and 2, 585-593, November 15–21, 2003
Paper No: IMECE2003-42706
... and asperity level are presented. The general trends observed here agree with the results obtained by other researchers for different materials. 13 05 2008 Adhesion asperity friction metallic MEMS molecular dynamics simulation Morse potential Proceedings of IMECE 03 2003 ASME...
Proceedings Papers

Proc. ASME. IMECE2004, Heat Transfer, Volume 2, 605-611, November 13–19, 2004
Paper No: IMECE2004-61074
... Interfacial phenomenon appears frequently in practice. It plays important roles in various fields of science and technology. In order to make a clear understanding on the characteristics of an interface, a molecular dynamics simulation (MDS) was performed. The simulation results show...
Proceedings Papers

Proc. ASME. IMECE2004, Electronic and Photonic Packaging, Electrical Systems Design and Photonics, and Nanotechnology, 65-73, November 13–19, 2004
Paper No: IMECE2004-61665
... in the thermal conductivity values. Existing theoretical predictions based on molecular dynamics simulation range from several hundred to 6600 W/m-K. In an attempt to clarify the order-of magnitude discrepancy in the literature, this paper utilizes molecular dynamics simulation to systematically examine...
Proceedings Papers

Proc. ASME. IMECE2004, Advanced Energy Systems, 279-283, November 13–19, 2004
Paper No: IMECE2004-62334
... Molecular dynamics simulation (MDS) is adopted to investigate the characteristic of fractional motion of molecules in liquid phase, vapor phase and liquid-vapor interface in the paper. Based on the theory of mean free path and Shannon sampling theorem, the way to determine a universal criterion...