ME 697R Lecture 3.8: Molecular Dynamics - Introduction to LAMMPS

By Xiulin Ruan

Mechanical Engineering, Purdue University, West Lafayette, IN

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  • Xiulin Ruan (2019), "ME 697R Lecture 3.8: Molecular Dynamics - Introduction to LAMMPS," https://nanohub.org/resources/31252.

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2004 Mechanical Engineering, Purdue University, West Lafayette, IN

ME 697R Lecture 3.8: Molecular Dynamics - Introduction to LAMMPS
  • Lecture 3.8: Introduction to LAMMPS 1. Lecture 3.8: Introduction to L… 0
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  • Readings 2. Readings 24.357691024357692
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  • LAMMPS: A General Purpose MD Code 3. LAMMPS: A General Purpose MD C… 29.32932932932933
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  • Case Study 1: Argon 4. Case Study 1: Argon 147.88121454788123
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  • Optimization of lattice constant 5. Optimization of lattice consta… 363.697030363697
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  • Case Study 2: Diamond 6. Case Study 2: Diamond 453.52018685352022
    00:00/00:00
  • Meaning of PBC 7. Meaning of PBC 503.37003670337003
    00:00/00:00
  • Case Study 3: CNT–Silicon Interface 8. Case Study 3: CNT–Silicon In… 607.67434100767434
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