Atomsk: A Tool For Manipulating And Converting Atomic Data Files -

BandUP: Band Unfolding code for Plane-wave based calculations

An updated version of the VASP2WANNIER90v2 interface

Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code

A code for generating irreducible site-occupancy configurations

ElATools: A tool for analyzing anisotropic elastic properties of the 2D and 3D materials

Unfolding the band structure of a supercell obtained with VASP

Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry

An interface for ELK-Wannier90 calculations

Effective mass calculation with DFT

Based on the classical lattice model (Heisenberg, XY, XYZ, etc.), code Ether has been developed to study the thermodynamics of ANY CRYSTAL SYSTEM by performing the classical Monte Carlo methods.

Utility scripts and programs for VASP calculations

This code is to plot the projected density of states (Spin pol. + SO) from the VASP output file. It requires only POSCAR, DOSCAR files.

BAnd Unfolding Machinery for VASP (VASP-BAUM)

This code can be used to integrate the Density of states (DOS) by simply using Simpson's rule for integration

Utilities used to translate WAVECAR in vasp

Implementation of Bardeen and Tersoff-Hamann approximations.

Vasp TST Tools

tool to post process the files of vasp code to get density of states and atom projected density of states

The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical conductivities, and electronic thermal conductivities) by using (1) the momentum matrix method (Method 1) or (2) derivative method same as adopted in BoltzTrap (Method 2).