Interaction properties between molten metal and quartz by molecular dynamics simulation

被引:4
|
作者
Zhou, Yu [1 ]
Luo, Guohu [1 ]
Hu, Yongxiang [1 ]
Wu, Di [1 ]
Yao, Zhenqiang [1 ]
机构
[1] Shanghai Jiao Tong Univ, Sch Mech Engn, State Key Lab Mech Syst & Vibrat, Shanghai 200240, Peoples R China
基金
中国国家自然科学基金;
关键词
Contact angle; Slip length; Molten metal; Quartz; Molecular dynamics simulation; SHEAR-FLOW; SLIP; SUBSTRATE; SURFACES; SILICON; MODEL; FILM;
D O I
10.1016/j.molliq.2021.117474
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The interaction properties between metal droplet and substrate play a crucial role in additive manufacturing technology based on depositing microdroplet. However, few studies have focused on the wettability and slippage between them due to the experimental observation challenge. In this work, molecular dynamics simulation is employed to investigate the effects of metal type, temperature, feature size, and driving force on contact angle and slip length and clarify their influence mechanisms. The results suggest that Ag has the smallest contact angle and slip length among Cu, Ag, and Au, and the more intense interaction between metal and quartz results in a smaller contact angle and slip length. The temperature has a weak influence on contact angle and slip length, and both of them decrease slightly with increasing temperature. The slip length rises rapidly and then trends to a constant when the feature size becomes large, which can be interpreted by the change in apparent viscosity of molten metal near the quartz. Furthermore, the slip length is proportional to the driving force, while it will reach a plateau when the driving force is considerably large. These conclusions can provide theoretical guidance and reference for continuous medium simulation. (C) 2021 Elsevier B.V. All rights reserved.
引用
收藏
页数:9
相关论文
共 50 条
  • [1] Molecular Dynamics Simulation of the Interaction between Common Metal Ions and Humic Acids
    Wu, Xu
    Xia, Yu
    Yuan, Lianhua
    Xia, Kaiyu
    Jiang, Yu
    Li, Na
    He, Xuwen
    WATER, 2020, 12 (11) : 1 - 11
  • [2] Interfacial interaction-driven rheological properties of quartz nanofluids from molecular dynamics simulations and density functional theory calculations
    Lou, Zhaoyang
    Cheng, Chen
    Cui, Yingqi
    Tian, Hao
    JOURNAL OF MOLECULAR MODELING, 2022, 28 (07)
  • [3] A molecular dynamics simulation of the electric properties in molten chloride and fluoride quaternary systems
    Matsumiya, M
    Takagi, R
    ELECTROCHIMICA ACTA, 2001, 46 (23) : 3563 - 3572
  • [4] Molecular dynamics simulation of latent track formation in α-quartz
    Lan Chun-E
    Xue Jian-Ming
    Wang Yu-Gang
    Zhang Yan-Wen
    CHINESE PHYSICS C, 2013, 37 (03)
  • [5] Molecular dynamics simulation of latent track formation in α-quartz
    兰春娥
    薛建明
    王宇钢
    张燕文
    Chinese Physics C, 2013, (03) : 128 - 134
  • [7] Conformation and molecular dynamics simulation of the interaction between cytochrome c and DNA
    Xiao, Bao-Lin
    Ma, Xin-Xin
    Li, Yang-Yang
    Hong, Jun
    Moosavi-Movahedi, Ali Akbar
    JOURNAL OF THE IRANIAN CHEMICAL SOCIETY, 2023, 20 (11) : 2747 - 2756
  • [8] Numerical Simulation of Interaction between Plasma and Azithromycin Based on Molecular Dynamics
    Zang, Yuanfu
    Zhou, Minqi
    Wu, Yangchen
    Qin, Si
    Huang, Shihai
    Meng, Jianzong
    APPLIED SCIENCES-BASEL, 2022, 12 (24):
  • [9] Conformation and molecular dynamics simulation of the interaction between cytochrome c and DNA
    Bao-Lin Xiao
    Xin-Xin Ma
    Yang-Yang Li
    Jun Hong
    Ali Akbar Moosavi-Movahedi
    Journal of the Iranian Chemical Society, 2023, 20 : 2747 - 2756
  • [10] Molecular dynamics simulation of mechanism of interaction between dislocation and amorphism in magnesium
    Zhang Bo-Jia
    An Min-Rong
    Hu Teng
    Han La
    ACTA PHYSICA SINICA, 2022, 71 (14)