TY - JOUR
T1 - Atomistic investigation on the structure-property relationship during thermal spray nanoparticle impact
AU - Goel, Saurav
AU - Faisal, Nadimul Haque
AU - Ratia, Vilma
AU - Agrawal, Anupam
AU - Stukowski, Alexander
N1 - Funding Information:
First author (SG) would like to acknowledge the funding support from J M Lessells travel scholarship from the Royal Society of Edinburgh (2013 RSE/J M Lessells Travel Scholarship) and International Research Fellowship account of Queen’s University, Belfast. The authors would also like to acknowledge the use of University of Huddersfield Queensgate Grid and STFC Hartree Centre resources in undertaking this work.
PY - 2014/3
Y1 - 2014/3
N2 - During thermal spraying, hot particles impact on a colder substrate. This interaction of crystalline copper nanoparticles and copper substrate is modeled, using MD simulation. The quantitative results of the impacts at different velocities and temperatures are evaluated using a newly defined flattening aspect ratio. This ratio between the maximum diameter after the impact and the height of the splat increases with increasing Reynolds numbers until a critical value is reached. At higher Reynolds numbers the flattening aspect ratio decreases again, as the kinetic energy of the particle leads to increasing substrate temperature and, therefore, decreases the substrate resistance. Thus, the particle penetrates into the substrate and deforms less.
AB - During thermal spraying, hot particles impact on a colder substrate. This interaction of crystalline copper nanoparticles and copper substrate is modeled, using MD simulation. The quantitative results of the impacts at different velocities and temperatures are evaluated using a newly defined flattening aspect ratio. This ratio between the maximum diameter after the impact and the height of the splat increases with increasing Reynolds numbers until a critical value is reached. At higher Reynolds numbers the flattening aspect ratio decreases again, as the kinetic energy of the particle leads to increasing substrate temperature and, therefore, decreases the substrate resistance. Thus, the particle penetrates into the substrate and deforms less.
KW - Copper
KW - Flattening aspect ratio
KW - Molecular dynamics
KW - Particle impact
KW - Thermal spray coating
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U2 - 10.1016/j.commatsci.2013.12.011
DO - 10.1016/j.commatsci.2013.12.011
M3 - Article
AN - SCOPUS:84891791442
SN - 0927-0256
VL - 84
SP - 163
EP - 174
JO - Computational Materials Science
JF - Computational Materials Science
ER -