scholarly journals Temperature and length scale dependence of solvophobic solvation in a single-site water-like liquid

2013 ◽  
Vol 138 (6) ◽  
pp. 064506 ◽  
Author(s):  
John R. Dowdle ◽  
Sergey V. Buldyrev ◽  
H. Eugene Stanley ◽  
Pablo G. Debenedetti ◽  
Peter J. Rossky
Keyword(s):  
Scale Dependence ◽  
Single Site ◽  
Length Scale ◽  
Site Water

A Study on Length Scale Effects on Indentation Delamination of Thin Films

2004 ◽  
Author(s):  
W. Li ◽  
S. Qu ◽  
T. Siegmund ◽  
Y. Huang
Keyword(s):  
Plastic Deformation ◽  
Strain Gradient ◽  
Cohesive Zone ◽  
Cohesive Zone Model ◽  
Scale Effects ◽  
Scale Dependence ◽  
Zone Model ◽  
Length Scale ◽  
Gradient Plasticity ◽  
Elastic Substrates

Simulations of indentation delamination of ductile films on elastic substrates are performed. A cohesive zone model accounts for initiation and growth of interface delaminations and a strain gradient plasticity framework for the length scale dependence of plastic deformation. With the cohesive zone model and the strain gradient formulation two length scales are introduced in to the analysis.

scholarly journals Oxo-Bridge Scenario behind Single-Site Water-Oxidation Catalysts

2014 ◽  
Vol 54 (2) ◽  
pp. 658-666 ◽  
Author(s):  
Isidoro López ◽  
Somnath Maji ◽  
J. Benet-Buchholz ◽  
Antoni Llobet
Keyword(s):  
Water Oxidation ◽  
Single Site ◽  
Oxidation Catalysts ◽  
Site Water ◽  
Oxo Bridge

Length-Scale Dependence of Hydration Free Energy: Effect of Solute Charge

2011 ◽  
Vol 145 (2) ◽  
pp. 253-264 ◽  
Author(s):  
Jihang Wang ◽  
Dusan Bratko ◽  
Alenka Luzar
Keyword(s):  
Free Energy ◽  
Scale Dependence ◽  
Length Scale ◽  
Hydration Free Energy ◽  
Energy Effect

Length-scale dependence of pH- and temperature-response of PDMAEMA-b-PHPMA block copolymer self-assemblies in aqueous solutions

Polymer ◽  
2021 ◽  
pp. 124428
Author(s):  
Aristeidis Papagiannopoulos ◽  
Theodoros Sentoukas ◽  
Stergios Pispas ◽  
Aurel Radulescu ◽  
Vitali Pipich ◽  
...  
Keyword(s):  
Block Copolymer ◽  
Aqueous Solutions ◽  
Temperature Response ◽  
Scale Dependence ◽  
Length Scale

Length-scale dependence of protein hydration-shell density

2020 ◽  
Vol 22 (14) ◽  
pp. 7340-7347
Author(s):  
Akash Deep Biswas ◽  
Vincenzo Barone ◽  
Andrea Amadei ◽  
Isabella Daidone
Keyword(s):  
Hydration Shell ◽  
Scale Dependence ◽  
Protein Hydration ◽  
Length Scale ◽  
Protein Size ◽  
Protein Hydration Shell

An increase in protein hydration-shell density relative to that of the bulk is observed (in the range of 4–14%) for all studied proteins and this density-increment, which decreases for decreasing protein size, is caused by the protein size only.

scholarly journals Theoretical study of catalytic mechanism for single-site water oxidation process

2012 ◽  
Vol 109 (39) ◽  
pp. 15669-15672 ◽  
Author(s):  
X. Lin ◽  
X. Hu ◽  
J. J. Concepcion ◽  
Z. Chen ◽  
S. Liu ◽  
...  
Keyword(s):  
Water Oxidation ◽  
Catalytic Mechanism ◽  
Theoretical Study ◽  
Oxidation Process ◽  
Single Site ◽  
Site Water
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