scholarly journals A Molecular Simulation Approach to Bond Reorganization in Epoxy Resins: From Curing to Deformation and Fracture

2021 ◽  
Author(s):  
Julian Konrad ◽  
Robert H. Meißner ◽  
Erik Bitzek ◽  
Dirk Zahn
Keyword(s):  
Molecular Simulation ◽  
Epoxy Resins ◽  
Simulation Approach ◽  
Deformation And Fracture ◽  
Bond Reorganization

A Spectroscopic and Molecular Simulation Approach toward the Binding Affinity between Lysozyme and Phenazinium Dyes: An Effect on Protein Conformation

2017 ◽  
Vol 121 (7) ◽  
pp. 1475-1484 ◽  
Author(s):  
Sabera Millan ◽  
Lakkoji Satish ◽  
Krishnendu Bera ◽  
B. Susrisweta ◽  
Durg Vijay Singh ◽  
...  
Keyword(s):  
Binding Affinity ◽  
Molecular Simulation ◽  
Protein Conformation ◽  
Simulation Approach

Mechanism study of ammonium nitrate decomposition with chloride impurity using experimental and molecular simulation approach

2019 ◽  
Vol 378 ◽  
pp. 120585 ◽  
Author(s):  
Rong Xia ◽  
Jingyao Wang ◽  
Zhe Han ◽  
Zhenhua Li ◽  
M. Sam Mannan ◽  
...  
Keyword(s):  
Ammonium Nitrate ◽  
Molecular Simulation ◽  
Simulation Approach ◽  
Mechanism Study

Deformation and Fracture Characteristics of Cenosphere Filled Epoxies Under Compressive Loading Conditions

2001 ◽  
Author(s):  
Nikhil Gupta ◽  
Eyassu Woldesenbet
Keyword(s):  
Epoxy Resins ◽  
Fracture Behavior ◽  
Moisture Absorption ◽  
Compressive Loading ◽  
Polymeric Materials ◽  
Local Stress ◽  
Fracture Characteristics ◽  
Structured Materials ◽  
Deformation And Fracture

Abstract Close cell structured foams are made by incorporation of cenospheres in polymeric materials. Low moisture absorption characteristics and considerably higher compressive strength of these materials compared to open cell structured foams make them suitable for use as core materials in sandwich structured materials. Incorporation of cenospheres in the epoxy resins enhances their impact strength and damage tolerance, especially if these materials are used in sandwich configurations. Present study analyzes and compares the effect of incorporation of cenospheres like flyash and glass microballoons in the epoxy resins on the deformation and fracture behavior of the material. Approach based on determination of local stress intensity factors is used to obtain estimate of the stresses in the material.

scholarly journals In vivo evaluation of an Ultra-fast Disintegrating Wafer matrix: A molecular simulation approach to the ora-mucoadhesivity

2017 ◽  
Vol 37 ◽  
pp. 123-133 ◽  
Author(s):  
Deshika Reddy ◽  
Yahya E. Choonara ◽  
Pradeep Kumar ◽  
Mershen Govender ◽  
Sunaina Indermun ◽  
...  
Keyword(s):  
Molecular Simulation ◽  
Simulation Approach ◽  
In Vivo Evaluation

The molecular simulation approach to complex hydrodynamics

1993 ◽  
Vol 46 (1) ◽  
pp. 39-53 ◽  
Author(s):  
M. Mareschal ◽  
E. Kestemont ◽  
M. Malek Mansour
Keyword(s):  
Molecular Simulation ◽  
Simulation Approach

Size and shape matter! A multiscale molecular simulation approach to polymer nanocomposites

2012 ◽  
Vol 22 (12) ◽  
pp. 5398 ◽  
Author(s):  
Radovan Toth ◽  
Francesca Santese ◽  
Simão P. Pereira ◽  
Daniel R. Nieto ◽  
Sabrina Pricl ◽  
...  
Keyword(s):  
Molecular Simulation ◽  
Polymer Nanocomposites ◽  
Simulation Approach ◽  
Size And Shape
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