Description

Book Synopsis


Table of Contents
1. Fundamentals of classical molecular dynamics (MD) simulation 2. Potential energy functions 3. Control techniques of MD simulation 4. Advanced ab initio MD and coarse-grained MD 5. Application of MD simulation in mechanical problems 6. Application of MD simulation in thermal problems 7. Application of MD simulation in mass transport problems 8. Application of MD simulation in other problems

Molecular Dynamics Simulation

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A Paperback / softback by Kun Zhou, Bo Liu

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    Publisher: Elsevier Science Publishing Co Inc
    Publication Date: 14/02/2022
    ISBN13: 9780128164198, 978-0128164198
    ISBN10: 0128164190
    Also in:
    Technology, Engineering & Agriculture Mechanical engineering

    Description

    Book Synopsis


    Table of Contents
    1. Fundamentals of classical molecular dynamics (MD) simulation 2. Potential energy functions 3. Control techniques of MD simulation 4. Advanced ab initio MD and coarse-grained MD 5. Application of MD simulation in mechanical problems 6. Application of MD simulation in thermal problems 7. Application of MD simulation in mass transport problems 8. Application of MD simulation in other problems

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