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Quick Introduction of QE

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Liu Theory Group wiki

sliutheorygroup/sliutheorygroup.github.io

Home
Development
Development
- C
  C
  - C/C++
- MATLAB
  MATLAB
  - How to write MATLAB
- Python
  Python
  - TEST
New Members
New Members
- Books recommended
- Skills
Software
Software
- Install
  Install
  - DFT
    DFT
    
    Qe
    
    Vasp
  - MD
    MD
    
    Lmp
- Runscripts
  Runscripts
  - test
- Usage
  Usage
  - DP
    DP
    
    How to freeze
    
    How to train
  - LAMMPS
    LAMMPS
    
    How to run NPT simulations
    
    How to prepare LAMMPS input
Tutorial
Tutorial
Contributing
Contributing

Quick Introduction of QE¶

Quick Introduction of LAMMPS

Quick Introduction of VASP

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