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  1. monitor_VASP_convergence monitor_VASP_convergence Public

    Plots the evolution of forces and energy from VASP's OUTCAR file. Useful for analyzing optimization progression between or during job submissions.

    Python 6 2

  2. VASP_dos_tools VASP_dos_tools Public

    Tools for evaluating the site projected and total density of states (DOS) from a VASP calculation

    Python 3 1

  3. VASP_POSCAR_methods VASP_POSCAR_methods Public

    Assorted methods for modifying VASP structure files (POSCAR or CONTCAR). Most methods pertain to modifying selective dynamics conditions or manipulating the structure itself.

    Python 5 1

  4. VASP_ldos_map VASP_ldos_map Public

    Methods for interpolating the local density of states (ldos) from a VASP calculation. The ldos is weighted by the tunneling probability from a specified position above the surface, producing result…

    Python 5 1

  5. phonon_tools_VASP phonon_tools_VASP Public

    Methods for analyzing and manipulating phonon modes in VASP

    Python 2

  6. charge_density_methods_VASP charge_density_methods_VASP Public

    Methods for slicing charge densities output by a VASP calculation

    Python 6 1