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Liu Theory Group wiki
sliutheorygroup/sliutheorygroup.github.io
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C
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MATLAB
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LAMMPS
LAMMPS
How to run NPT simulations
How to prepare LAMMPS input
Tutorial
Tutorial
Quick Introduction of ABACUS
CP2K Polaron DFT-MD with PBE+U
CP2K Polaron Geometry Optimisation with PBE+U
Quick Introduction of DP
Quick Introduction of LAMMPS
Quick Introduction of QE
Quick Introduction of VASP
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Contributing
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