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en.wikipedia.org/wiki/GranularityPrivate View Precision and ambiguity. Coarse-grained materials or systems have fewer, larger discrete components than fine-grained materials or systems.. A coarse-grained description of a system regards large subcomponents.; A fine-grained description regards smaller components of which the larger ones are composed.; The concepts granularity, coarseness, and fineness are relative; and are used when ...
Evaluation of Essential Dynamics and Fixed-Length Coarse Graining for ... pubs.acs.org/doi/10.1021/acs.jpcb.3c08198Private View For multiscale modeling of biomolecules, reliable coarse-grained (CG) models can offer great potential to simulate larger temporal and spatial scales than traditional all-atom (AA) models. In this study, we explore the essential dynamics coarse graining (EDCG) and fixed-length coarse graining (FLCG) approaches for constructing highly coarse-grained models for multidomain proteins (MDPs), with ...
Ultrafine-Grained Materials | SpringerLink link.springer.com/chapter/10.1007/978-3-030-80359-9_17Private View The common grain size of the metals in the industry is >10 μm and are called coarse-grained materials [ 16 ]. Fine-grained metals that are processed using industrial thermomechanical processing have a grain size of ∼1–10 μm. It is hard to achieve a metal with grain size <1 μm (called ultrafine grained) or <100 nm (called nanograined ...
Energy renormalization for coarse-graining polymers having ... - Science www.science.org/doi/10.1126/sciadv.aav4683Private View Polymer glass-forming (GF) materials exhibit complex dynamic and mechanical properties that strongly depend on temperature due to the glass transition (), and assessing these properties using all-atomistic (AA) molecular dynamics (MD) simulations is inherently challenging because of their limitations of accessing extended time and length scales.. Multiscale modeling, such as coarse-grained (CG ...
Simulations of Coarse-Grained Materials - NRC www.nrc.gov/docs/ML2024/ML20241A106.pdfPrivate View Approach. Generate realistic models of austenitic welds and coarse-grain materials, including crystalline orientations (Euler angles). Evaluate beam simulations in CIVA, and compare results to empirical beam maps. Compare the beam simulations from realistic specimen models to those from simple structural models that are included with CIVA.