Questions tagged [multiscale-modeling]
Questions pertaining to multiscale phenomena in materials modeling.
5
questions
4
votes
2
answers
136
views
What does it mean by "scale mismatch" and "bridging of scales"?
As far as I understood, molecular simulation works in two types of scales:
temporal scale - how much time is required to simulate the model.
spatial scale - how much memory-space is required to ...
1
vote
0
answers
51
views
What would the items look like if we put them on a length scale? [closed]
The following table is taken from page#434 of the book Schlick, Tamar. Molecular modeling and simulation: an interdisciplinary guide. Vol. 2. New York: Springer, 2010.
What would the same items ...
5
votes
2
answers
268
views
Scales for simulation
I am looking for literature on various scales (time, length, etc.) in atomistic or molecular simulation.
So far I have found bits and pieces here and there. E.g. this is one of them. However, this is ...
4
votes
0
answers
95
views
Understanding use of Machine Learning in Multiscale Enhanced Sampling
Multiscale Enhanced Sampling Using Machine Learning
Multiscale enhanced sampling (MSES) allows for enhanced sampling of all-atom protein structures by coupling with the accelerated dynamics of the ...
19
votes
2
answers
101
views
What are some common techniques for building multiscale models for materials?
Most, if not all, material systems are multiscale in nature that are described by different physics at different length and time scales, ranging from density functional theory (DFT) to phase field ...