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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 ...
Approaches and Perspective of Coarse-Grained Modeling and Simulation ... pubs.acs.org/doi/10.1021/acsomega.2c06248Private View On the basis of the extent of coarse-graining, the systemic CG methods are roughly divided into three major classes: (i) low coarse-graining degrees, with one or two monomers in one bead, e.g., DBI and IBI schemes and MARTINI approach; (ii) medium coarse-graining degrees, having 10–20 monomers in one bead, e.g., blob model; and (iii) high coarse-graining degrees, having the whole chain ...
Coarse-Grained Modeling of Ion-Containing Polymers pubs.acs.org/doi/10.1021/acs.chemrev.1c00913Private View Coarse-grained modeling provides an efficient approach for exploring the structural and dynamical properties of these soft materials. The unique physicochemical properties of such polymers are of broad interest. In this review, we summarize the current development and understanding of the structure–property relationship of ion-containing ...
Coarse-grained modeling - Wikipedia en.wikipedia.org/wiki/Coarse-grained_modelingPrivate View Coarse-grained modeling, coarse-grained models, aim at simulating the behaviour of complex systems using their coarse-grained (simplified) representation. Coarse-grained models are widely used for molecular modeling of biomolecules [1] [2] at various granularity levels. A wide range of coarse-grained models have been proposed.
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 ...
Enhancing Coarse-Grained Models through Machine Learning pubs.acs.org/doi/10.1021/acs.jcim.4c00537Private View We introduce a general framework for constructing coarse-grained potential models without ad hoc approxns. such as limiting the potential to two- and/or three-body contributions. The scheme, called the Deep Coarse-Grained Potential (abbreviated DeePCG), exploits a carefully crafted neural network to construct a many-body coarse-grained potential.
Mechanical Modeling of Frozen Coarse-Grained Materials ... - Hindawi www.hindawi.com/journals/amse/2021/6639428Private View In the cold regions of China, coarse-grained materials are frequently encountered or used as backfilling materials in infrastructure construction, such as dams, highways, railways, and mineral engineering structures. Effects of confining pressure (0.2, 0.5, and 1 MPa) and frozen temperature (−2, −5, −10, and −15°C) on the stress-strain response and elastic modulus were ...
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