Description

Book Synopsis
This work presents three chapters, each of which detail a recent advancement in the field of molecular dynamics simulations research. Chapter One describes the molecular dynamics method to simulate the transport processes in nanofluids and the molecular dynamics simulation of transport processes in confined conditions and in nanochannels in particular. Chapter Two provides a comprehensive review on the investigations into the nanoscopic deformation mechanisms of silicon carbide (SiC) and potassium dihydrogen phosphate (KDP) crystals using molecular dynamics simulations under various mechanical loading conditions. Chapter Three reports the effects of pressures applied during rapid solidification of local structures formed in the glassy NiTi alloy based on molecular dynamics simulation results.

Table of Contents
Preface; Molecular Dynamics Modeling Transport Processes of Fluids and Nanofluids in Bulk and Nanochannels; Mechanisms of the Nanoscopic Deformation of SIC and KDP; Molecular Dynamics Simulations of Rapid Solidification of NiTi Alloy under Various Pressure Amounts; Index.

Advances in Molecular Dynamics Simulations

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    A Paperback / softback by Steffen Köhler

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      Publisher: Nova Science Publishers Inc
      Publication Date: Publication Date: 01/08/2021
      ISBN13: 9781536194661, 978-1536194661
      ISBN10: 1536194662

      Description

      Book Synopsis
      This work presents three chapters, each of which detail a recent advancement in the field of molecular dynamics simulations research. Chapter One describes the molecular dynamics method to simulate the transport processes in nanofluids and the molecular dynamics simulation of transport processes in confined conditions and in nanochannels in particular. Chapter Two provides a comprehensive review on the investigations into the nanoscopic deformation mechanisms of silicon carbide (SiC) and potassium dihydrogen phosphate (KDP) crystals using molecular dynamics simulations under various mechanical loading conditions. Chapter Three reports the effects of pressures applied during rapid solidification of local structures formed in the glassy NiTi alloy based on molecular dynamics simulation results.

      Table of Contents
      Preface; Molecular Dynamics Modeling Transport Processes of Fluids and Nanofluids in Bulk and Nanochannels; Mechanisms of the Nanoscopic Deformation of SIC and KDP; Molecular Dynamics Simulations of Rapid Solidification of NiTi Alloy under Various Pressure Amounts; Index.

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