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Keywords: molecular dynamics
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Journal Articles
Publisher: ASME
Article Type: Research Papers
J. Manuf. Sci. Eng. November 2023, 145(11): 111001.
Paper No: MANU-22-1669
Published Online: July 20, 2023
.... In this paper, molecular dynamics simulations are conducted to evaluate the chemical and physical crosslinking of the EPDM rubber over a range of temperatures using a COMPASS force field. Then, once the ethylene propylene diene monomer (EPDM) model was equilibrated and all possible crosslinks were formed...
Journal Articles
Publisher: ASME
Article Type: Research Papers
J. Manuf. Sci. Eng. November 2022, 144(11): 111008.
Paper No: MANU-21-1519
Published Online: July 26, 2022
... perspective, the formation mechanism of subsurface damage during the nano-cutting of tungsten is still unclear. Herein, the molecular dynamics (MD) simulation of nano-cutting single-crystal tungsten was established to elucidate the evolution of subsurface damage and the effects of cutting force on subsurface...
Journal Articles
Publisher: ASME
Article Type: Technical Briefs
J. Manuf. Sci. Eng. October 2011, 133(5): 054501.
Published Online: August 30, 2011
... by studying the dipalmitoylphosphatidylcholine bilayer behavior under different normal pressures using molecular dynamics. As the normal pressure increases, the force necessary to rupture the bilayer structure decreases, which indicates cell membrane instability under high normal pressure. This phenomenon can...
Journal Articles
Publisher: ASME
Article Type: Technical Papers
J. Manuf. Sci. Eng. April 2007, 129(2): 281–286.
Published Online: September 18, 2006
... is monocrystalline and the hardness is lower than that of the diamond cutting tool at room temperature. In this study, the mechanism of the groove wear in nanoscale ductile mode cutting of monocrystalline silicon by diamond is investigated by molecular dynamics simulation of the cutting process. The results show...