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1. alc_eqcm alc_eqcm Public

   Forked from stfc/alc_eqcm

   This program performs post-processing of EQCM data to the purpose of electrochemical characterization and building of atomistic models compatible with experiments.

   Fortran

2. alc_trajectory alc_trajectory Public

   Forked from stfc/alc_trajectory

   A code to compute orientational correlation functions (from MD trajectories) for reactive and non-reactive systems whose sizes are compatible with DFT simulations. For reactive systems, it is also …

   Fortran

3. Euphonic Euphonic Public

   Forked from pace-neutrons/Euphonic

   Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intensities from force constants.

   Python