High-performance large-scale atomistic simulation of thin films deposition

DOI10.1134/S1995080222070137zbMath1502.82024MaRDI QIDQ2674994

Yanyan Li

Publication date: 20 September 2022

Published in: Lobachevskii Journal of Mathematics (Search for Journal in Brave)

zbMATH Keywords

computational efficiency; molecular dynamics; thin films; high-performance modeling; ion-assisted deposition

Mathematics Subject Classification ID

65Y05: Parallel numerical computation

81V55: Molecular physics

35Q82: PDEs in connection with statistical mechanics

82M37: Computational molecular dynamics in statistical mechanics

Uses Software

• Gromacs