Temporal coarse-graining method to simulate the movement of atoms

DOI10.1016/J.JCP.2013.05.049MaRDI QIDQ347959zbMATH OpenOpenAlexFDO

Authors Takashi Ichinomiya

Publication date 5 December 2016

Published in Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.jcp.2013.05.049

zbMATH Keywords

Langevin equationmolecular dynamicsrenormalization

Mathematics Subject Classification ID

Numerical solutions to stochastic differential and integral equations (65C30) Quantum dynamics and nonequilibrium statistical mechanics (general) (82C10) Dynamics of disordered systems (random Ising systems, etc.) in time-dependent statistical mechanics (82C44)

Recommendations

• Multiple time scale method for atomistic simulations
• Coarse-grained molecular dynamics: concurrent multiscale simulation at finite temperature
• Bottom-Up Transient Time Models in Coarse-Graining Molecular Systems
• Solving the equations of motion for mixed atomistic and coarse-grained systems
• Atomistic long-term simulation of heat and mass transport
• Simulating kinetic processes in time and space on a lattice
• Coarse-grained atomistic simulation of dislocations

Cites work

• scientific article; zbMATH DE number 3002670 (Why is no real title available?)
• Renormalization Group Theory for Global Asymptotic Analysis

Cited in

(1)

• Extended molecular dynamics: seamless temporal coarse-graining and transition between deterministic and probabilistic paradigms

This page was built for publication: Temporal coarse-graining method to simulate the movement of atoms

Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q347959)