Molecular dynamics simulations in semiconductor material processing: A comprehensive review

Y Yun, S Wu, D Wang, X Luo, J Chen, G Wang… - Measurement, 2024 - Elsevier
Molecular dynamics (MD) simulations have become a pivotal tool in the nanofabrication of
semiconductor materials, a key area of contemporary semiconductor process research. This …

[HTML][HTML] Probing the atomic-scale origins of anti-friction and wear-resisting in graphene-coated high-entropy alloys

H **e, Z Ma, W Zhang, H Zhao, L Ren - Materials & Design, 2022 - Elsevier
Multilayer graphene (Gr) reinforced high-entropy alloys (HEAs) matrix composite shows
promising prospects in anti-friction and wear-resisting. Nevertheless, a potential …

Molecular dynamics simulations of ultrasonic vibration-assisted grinding of polycrystalline iron: Nanoscale plastic deformation mechanism and microstructural …

W Huang, J Tang, W Zhou, J Wen, M Yi - Applied Surface Science, 2023 - Elsevier
Ultrasonic vibration-assisted grinding (UVAG) has attracted plenty of attention to significantly
improve surface integrity. However, existing research has not systematically investigated the …

[HTML][HTML] Atomic study on the deformation behavior of nanotwinned CoCrCuFeNi high entropy alloy during nanoscratching

B Zhu, D Zhao, Y Niu, Z Zhang, H Zhao - Journal of Materials Research and …, 2023 - Elsevier
Nanotwinned high entropy alloys (HEA) offer promising applications in engineering due to
their remarkable mechanical properties. However, the influence of twin boundaries (TB) on …

Mechanical characteristics and deformation behavior of Al polycrystal reinforced with SiC particles

XT Vu, VH Nguyen, TV Tran, QM Nguyen… - Journal of Physics and …, 2023 - Elsevier
Molecular dynamics models are established to investigate the influence of silicon carbide
(SiC) particle size and strain rate on the mechanical characteristics and deformation …

Insight into the effect of vibration parameters on deformation mechanism during scratching of nanograin iron alloy by molecular dynamics

W Huang, J Tang, W Zhou, W Shao, J Wen, Z Li - Tribology International, 2025 - Elsevier
Molecular dynamics simulations were employed to study the deformation behavior and
microstructure evolution of nanocrystalline iron alloy during vibration-assisted scratching …

Development of a vibration-assisted micro/nano scratch tester for evaluating the scratch behaviors of materials under vibration environment

H Wu, H Huang, Z Xu, X Li… - IEEE Transactions on …, 2024 - ieeexplore.ieee.org
Micro/nano scratch testing is an effective technique for characterizing the mechanical
properties and wear resistance of materials. In practical applications, most of the materials in …

Mechanical properties of dual-phase eutectic high-entropy alloys

DK Nguyen, TH Fang, CC Huang - International Journal of Mechanical …, 2024 - Elsevier
The dual-phase alloys exhibit a promising combination of properties that either neutralize or
compensate for the weakness of the two contained components and are characterized by …

Atomistic insights into friction and wear responses of NiCoCr medium entropy alloy: Influence of pre-strained monolayer graphene coating

P Chen, X Ye, J Yang, L Wu, X Qiao, J Zhang… - Journal of Alloys and …, 2025 - Elsevier
This study investigates the friction and wear responses of the NiCoCr medium entropy alloy
(MEA), which was coated with graphene but with different pre-strain conditions, through …

Study of atomic-scale wear characteristics of a dual-phase TiAl alloy at different vibration frequencies

M Zheng, Q Lu, D Qu, H Zhang, B Yi, H Tan, Z Zhu - Tribology International, 2025 - Elsevier
Duplex titanium-aluminum alloys have significant advantages in terms of mechanical
properties, lightweight potential, and application prospects, and have become one of the …