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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      Book details

      Published 14 February 2022
      ISBN-13 9780128164198
      978-0128164198
      ISBN-10 0128164190

      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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