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10 search results found

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

Vasp2wan90_v2_fix ⭐ 76

An updated version of the VASP2WANNIER90v2 interface

BandUP: Band Unfolding code for Plane-wave based calculations

Vaspberry ⭐ 39

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

Disorder ⭐ 36

A code for generating irreducible site-occupancy configurations

Elatools ⭐ 31

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

Fold2bloch Vasp ⭐ 20

Unfolding the band structure of a supercell obtained with VASP

Periodic_nbo ⭐ 18

Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry

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 basic Monte Carlo methods. Metropolis algorithm has been used to equate all the observables

Vasp Dos Plots ⭐ 5

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

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