Advances in molecular dynamics simulations research / Steffen Köhler (editor).

Format:

Book

Contributor:

Köhler, Steffen, editor.

Series:

Chemistry Research and Applications

Language:

English

Subjects (All):

Molecular dynamics--Simulation methods.

Molecular dynamics.

Physical Description:

1 online resource (211 pages)

Place of Publication:

New York, New York : Nova Science Publishers, [2020]

Summary:

"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"-- Provided by publisher.

Contents:

Molecular dynamics modeling transport processes of fluids and nanofluids in bulk and nanochannels / Valery Rudyak, Alexander Belkin and Sergey Krasnolutskii

Mechanisms of the nanoscopic deformation of SIC and KDP / Zhonghuai Wu, Shengyao Yang and Liangchi Zhang

Molecular dynamics simulations of rapid solidification of NiTi alloy under various pressure amounts / Ridwan, Rizal Arifin and Munaji.

Notes:

Description based on print version record.

Includes bibliographical references and index.

ISBN:

1-5361-9734-3

OCLC:

1255237885