Shahram_Yalameha's repositories
3D-Winding-Number
Tool for computing the phase diagram and gap data of 3D condensed matter systems, via the winding number
bandstructure_utils
Utilities for creating, comparing and plotting bandstructures of materials.
burai
BURAI, a GUI system of Quantum ESPRESSO
Chern_nubmer_calculation
Using different method to calculate Chern number for Haldane model
dft-book
A book on modeling materials using VASP, ase and vasp
gibbs2
Thermodynamics of solids in the quasiharmonic approximation.
kpr2ksc
klist_band converter, for primitive to supercell conversion. Designed for fold2bloch under WIEN2k
linux-elast
elast linux version
prog4comp
Resources for the book "Programming for Computations" by S. Linge and H. P. Langtangen
PyTB
ab-initio Tight Binding Hamiltonians
runwien
A text-based interface for WIEN2k.
Rvasp
Tools for loading, manipulating and plotting VASP files within R
SOFTX-D-17-00033
Inelastic neutron scattering software package. Update 1.5 to "Takin: An Open-Source Software for Experiment Planning, Visualisation, and Data Analysis", (PII: S2352711016300152). To cite this Software Publication: http://www.sciencedirect.com/science/article/pii/S2352711017300183
TBmodels
A tool for creating and manipulating tight-binding models.
Tight-Binding-Model
Post-Processing routines for Wannier90 package output. Contains routines for calculating/plotting band structure, locating band-gap minima, calculating 1st/2nd order photocurrent, etc.
topology
Calculate bandstructures, DOS, spectral function, chern number and Z2 invariant from a given tight-binding Hamiltonian
twod_materials
High throughput workflow tools for characterizing 2D materials in VASP.
vasp
New ASE compliant Python interface to VASP
VASP-Examples
A collection of examples for running different types of VASP calculations.
VASP-Tools
A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP package
VaspCat
Package for generating VASP files from crystal geometry input.
vrml-stl
vrml-stl geometry converter
wanndos
DOS & PDOS from wannier90 outputs
wien2wannier
from linearized augmented plane waves to maximally localized Wannier functions