Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio Lammps and Gromacs

Written By Sumit Sharma
Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio  Lammps and Gromacs
  • Publsiher : Elsevier
  • Release : 09 August 2019
  • ISBN : 0128169559
  • Pages : 365 pages
  • Rating : 4/5 from 21 reviews
GET THIS BOOKMolecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio Lammps and Gromacs


Read or download book entitled Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio Lammps and Gromacs written by Sumit Sharma which was release on 09 August 2019, this book published by Elsevier. Available in PDF, EPUB and Kindle Format. Book excerpt: Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio, Lammps and Gromacs presents the three major software packages used for the molecular dynamics simulation of nanocomposites. The book explains, in detail, how to use each of these packages, also providing real-world examples that show when each should be used. The latter two of these are open-source codes which can be used for modeling at no cost. Several case studies how each software package is used to predict various properties of nanocomposites, including metal-matrix, polymer-matrix and ceramic-matrix based nanocomposites. Properties explored include mechanical, thermal, optical and electrical properties. This is the first book that explores methodologies for using Materials Studio, Lammps and Gromacs in the same place. It will be beneficial for students, researchers and scientists working in the field of molecular dynamics simulation. Gives a detailed explanation of basic commands and modules of Materials Studio, Lammps and Gromacs Shows how Materials Studio, Lammps and Gromacs predict mechanical, thermal, electrical and optical properties of nanocomposites Uses case studies to show which software should be used to solve a variety of nanoscale modeling problems

Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio Lammps and Gromacs

Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio  Lammps and Gromacs
  • Author : Sumit Sharma
  • Publisher : Elsevier
  • Release Date : 2019-08-09
  • Total pages : 365
  • ISBN : 0128169559
GET BOOK

Summary : Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio, Lammps and Gromacs presents the three major software packages used for the molecular dynamics simulation of nanocomposites. The book explains, in detail, how to use each of these packages, also providing real-world examples that show when each should be used. The ...

Metallic Glass Based Nanocomposites

Metallic Glass Based Nanocomposites
  • Author : Sumit Sharma
  • Publisher : CRC Press
  • Release Date : 2019-09-23
  • Total pages : 152
  • ISBN : 0128169559
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Summary : Metallic Glass-Based Nanocomposites: Molecular Dynamics Study of Properties provides readers with an overview of the most commonly used tools for MD simulation of metallic glass composites and provides all the basic steps necessary for simulating any material on Materials Studio. After reading this book, readers will be able to model ...

Theoretical and Computational Chemistry Aspects

Theoretical and Computational Chemistry Aspects
  • Author : Ponnadurai Ramasami
  • Publisher : Walter de Gruyter GmbH & Co KG
  • Release Date : 2021-10-25
  • Total pages : 210
  • ISBN : 0128169559
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Summary : Based on "The Virtual Conference on Chemistry and its Applications (VCCA-2020) – Research and Innovations in Chemical Sciences: Paving the Way Forward" held in August 2020 and organized by the Computational Chemistry Group of the University of Mauritius. The chapters reflect a wide range of fundamental and applied research in the chemical ...

Mechanics of Particle and Fiber Reinforced Polymer Nanocomposites

Mechanics of Particle  and Fiber Reinforced Polymer Nanocomposites
  • Author : Sumit Sharma
  • Publisher : John Wiley & Sons
  • Release Date : 2021-02-22
  • Total pages : 320
  • ISBN : 0128169559
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Summary : Learn to model your own problems for predicting the properties of polymer-based composites Mechanics of Particle- and Fiber-Reinforced Polymer Nanocomposites: Nanoscale to Continuum Simulations provides readers with a thorough and up-to-date overview of nano, micro, and continuum approaches for the multiscale modeling of polymer-based composites. Covering nanocomposite development, theoretical models, ...

Composite Materials

Composite Materials
  • Author : Sumit Sharma
  • Publisher : CRC Press
  • Release Date : 2021-03-11
  • Total pages : 632
  • ISBN : 0128169559
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Summary : Composite materials find diverse applications in areas including aerospace, automotive, architecture, energy, marine and military. This comprehensive textbook discusses three important aspects including manufacturing, mechanics and dynamic mechanical analysis of composites. The textbook comprehensively presents fundamental concepts of composites, manufacturing techniques and advanced topics including as advances in composite materials ...

Recent Advances in Computational Mechanics and Simulations

Recent Advances in Computational Mechanics and Simulations
  • Author : Sandip Kumar Saha,Mousumi Mukherjee
  • Publisher : Springer Nature
  • Release Date : 2020-11-13
  • Total pages : 658
  • ISBN : 0128169559
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Summary : This volume presents selected papers from the 7th International Congress on Computational Mechanics and Simulation held at IIT Mandi, India. The papers discuss the development of mathematical models representing physical phenomena and applying modern computing methods and simulations to analyse them. The studies cover recent advances in the fields of ...