TY - GEN
T1 - Simulation of liquid/solid interfacial structures in metal/ceramics wetting systems
AU - Makino, T.
AU - Tanaka, S. I.
N1 - Copyright:
Copyright 2020 Elsevier B.V., All rights reserved.
PY - 2006
Y1 - 2006
N2 - Wetting can be regarded as a kind of effective nanostructure-forming process. To control the structure, a study on the relationship between atomic interactions and the resultant wetting behaviors is required. To model the wetting system, two sets of interatomic potentials for Metal/MgO(100) systems are derived from first principles calculation results for the simple configurations. A molecular dynamics method is applied to simulate the system and shows that Al atoms wet better than Sn atoms on the MgO substrate. The tendency is consistent with the experimental contact angles. The interfacial structures are different between these two systems.
AB - Wetting can be regarded as a kind of effective nanostructure-forming process. To control the structure, a study on the relationship between atomic interactions and the resultant wetting behaviors is required. To model the wetting system, two sets of interatomic potentials for Metal/MgO(100) systems are derived from first principles calculation results for the simple configurations. A molecular dynamics method is applied to simulate the system and shows that Al atoms wet better than Sn atoms on the MgO substrate. The tendency is consistent with the experimental contact angles. The interfacial structures are different between these two systems.
KW - Atomistic simulation
KW - Interfacial structure
KW - MgO
KW - Wetting
UR - http://www.scopus.com/inward/record.url?scp=33745935032&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=33745935032&partnerID=8YFLogxK
U2 - 10.4028/www.scientific.net/amr.11-12.485
DO - 10.4028/www.scientific.net/amr.11-12.485
M3 - Conference contribution
AN - SCOPUS:33745935032
SN - 0878499792
SN - 9780878499793
T3 - Advanced Materials Research
SP - 485
EP - 488
BT - AICAM 2005 - Proceedings of the Asian International Conference on Advanced Materials
PB - Trans Tech Publications
T2 - AICAM 2005 - Asian International Conference on Advanced Materials
Y2 - 3 November 2005 through 5 November 2005
ER -