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Popular repositories

  1. INCAR INCAR Public

    Forked from WMD-group/INCAR

    A generic INCAR file for the density functional theory package VASP

    1

  2. dielectric_mixture dielectric_mixture Public

    Forked from WMD-group/dielectric_mixture

    A python script for the calculation of the effective dielectric constant for a mixture of two phases

    Python 1

  3. IETsim IETsim Public

    Forked from Quantum-Dynamics-Hub/IETsim

    Simulations of Interfacial Electron Transfer

    C 1

  4. StarryNight StarryNight Public

    Forked from WMD-group/StarryNight

    Monte Carlo codes to simulate the ferroelectric domains in a hybrid perovskite solar cell

    C

  5. Phonons Phonons Public

    Forked from WMD-group/Phonons

    A collection of structures, force constants and phonon data obtained from first-principles calculations

    Jupyter Notebook

  6. hybrid-perovskites hybrid-perovskites Public

    Forked from WMD-group/hybrid-perovskites

    DFT optimised crystal structures of inorganic and hybrid halide perovskites

    1