DingChangjie's repositories

vaspcode

Some scripts to postprocess the vasp data

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deepmd-kit

A deep learning package for many-body potential energy representation and molecular dynamics

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f90wrap

F90 to Python interface generator with derived type support

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fox

A Fortran XML library

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lammps

Public development project of the LAMMPS MD software package

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Molecular-Dynamics-Simulation

Sample codes for my book on molecular dynamics simulation

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QUIP

libAtoms/QUIP molecular dynamics framework: http://www.libatoms.org

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Simulations

Simulation code for molecular dynamics

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