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1. Syntax-highlighting-for-DFT-codes Syntax-highlighting-for-DFT-codes Public

   11 2

2. kramers-kronig-transformation kramers-kronig-transformation Public

   Calculate the real part of the dielectric function from the imaginary part for vasp users

   Python 3 3

3. useful-scripts useful-scripts Public

   Some useful scripts for first-principles calculations.

   Python 4

4. mlrap mlrap Public

   Forked from NianSan-H/mlrap

   Machine Learning Regression Analyse Packages

   Python