Multiscale Simulations

2015 ◽  
pp. 2326-2334
Author(s):  
Moran Wang ◽  
Shiyi Chen
Keyword(s):  
Multiscale Simulations

Multiscale Simulations of Triblock Copolymers

2007 ◽  
Vol 5 (3-4) ◽  
pp. 167-179 ◽  
Author(s):  
Jan Andzelm ◽  
Frederick L. Beyer ◽  
James Snyder ◽  
Peter W. Chung
Keyword(s):  
Triblock Copolymers ◽  
Multiscale Simulations

scholarly journals Multiscale simulations of concrete mechanical tests

2012 ◽  
Vol 236 (18) ◽  
pp. 4882-4892 ◽  
Author(s):  
Jan Vorel ◽  
Vít Šmilauer ◽  
Zdeněk Bittnar
Keyword(s):  
Mechanical Tests ◽  
Multiscale Simulations

Effects of lateral-chain thiophene fluorination on morphology and charge transport of BDT-T based small molecule donors: A study with multiscale simulations

2021 ◽  
Author(s):  
Chunlin Xu ◽  
Chuang Yao ◽  
Shaohui Zheng
Keyword(s):  
Solar Cells ◽  
Charge Transport ◽  
Small Molecule ◽  
Organic Solar Cells ◽  
Building Block ◽  
Multiscale Simulations

Thiophene substituted benzo[1,2-b:4,5-b′]dithiophene (BDT-T) is widely used as the building block of promising donor materials in organic solar cells (OSCs). Fluorination on the lateral-chain thiophenes of BDT-T is a considerable...

scholarly journals Multiscale simulations of protein-facilitated membrane remodeling

2016 ◽  
Vol 196 (1) ◽  
pp. 57-63 ◽  
Author(s):  
Aram Davtyan ◽  
Mijo Simunovic ◽  
Gregory A. Voth
Keyword(s):  
Multiscale Simulations ◽  
Membrane Remodeling

scholarly journals Flexible composition and execution of high performance, high fidelity multiscale biomedical simulations

2013 ◽  
Vol 3 (2) ◽  
pp. 20120087 ◽  
Author(s):  
D. Groen ◽  
J. Borgdorff ◽  
C. Bona-Casas ◽  
J. Hetherington ◽  
R. W. Nash ◽  
...  
Keyword(s):  
High Performance ◽  
Multiscale Simulation ◽  
High Fidelity ◽  
Biomedical Domain ◽  
Multiscale Simulations ◽  
Total Execution Time ◽  
Stent Restenosis ◽  
Single Scale ◽  
Wide Range ◽  
In Stent Restenosis

Multiscale simulations are essential in the biomedical domain to accurately model human physiology. We present a modular approach for designing, constructing and executing multiscale simulations on a wide range of resources, from laptops to petascale supercomputers, including combinations of these. Our work features two multiscale applications, in-stent restenosis and cerebrovascular bloodflow, which combine multiple existing single-scale applications to create a multiscale simulation. These applications can be efficiently coupled, deployed and executed on computers up to the largest (peta) scale, incurring a coupling overhead of 1–10% of the total execution time.

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