band-structure

Scientific Python package for tight-binding calculations in solid state physics

BandUP: Band Unfolding code for Plane-wave based calculations

This can construct the tight-binding model and calculate energies

Modeling and Crystallographic Utilities

Scientific Python package for solving Slater Koster tight-binding topological hamiltonian

Band diagram and Field of 2D photonic cristal

The project represents an extendable Python framework for the electronic structure computations based on the tight-binding method and transport modeling based on the non-equilibrium Green's function (NEGF) method. The code can deal with both finite and periodic system translated in one, two or three dimensions.

Electronic structure calculations using Julia

Materials Studio (DMol3 and CASTEP) tools for calculating effective mass and electron density difference. 有效质量计算器，Materials Studio 计算结果后处理。

Computes the electronic band structure of bulk ZB semiconductor with various k.p models

Semi-empirical tight-binding computation of the electronic structure of semiconductors

FDF files for relaxation, PDOS and Denchar calculations in SIESTA 4.0.2 version as well as 4.1v and PSML supported version

Effective mass from a (VASP?) bandstructure calculation via ApproxFun fitting to the bands, a WIP.

Computes the electronic band structure of bulk ZB semiconductor with k.p models WITH STRAIN

Computes the electronic band structure of Zinc Blende semiconductor

Nearest neighbor tight-binding estimation of band structures of bulk and nano-ribbon (Armchair and Zigzag) graphene.

Integrated computational framework for reconstruction and parametrization of electronic band sturcture from photoemission spectroscopy data

A General Purpose Exact diagonalization library

Computes the electronic band structure of bulk Wurtzite semiconductors

Band structure computation using empirical pseudopotentials

Julia binding to kwant

A simple script to draw band structure and DOS diagram

Codes and plots for 2D correlated Oxides review paper

utility for plotting band structure and density of states from wien2k or VASP

Simple band structure computation for Bravais-lattice materials in Python.

Repository for the work published in Phys. Rev. B 102, 205123 (2020)

Distributed multicomponent lineshape fitting routines and benchmarks for multidimensional spectroscopy and spectral imaging

Band structure calculations for large systems

Tool in the Fortran 77 language to extract from the VASP output files (CONTCAR, OUTCAR, and PROCAR), the band structure, orbital projections (S, Px, Py, Pz, D), and spin component projections (Sx, Sy, Sz).

Repository for the Master-Thesis project on OBCs Drude weight (2019)