band-structure
There are 48 repositories under band-structure topic.
dean0x7d/pybinding
Scientific Python package for tight-binding calculations in solid state physics
band-unfolding/bandup
BandUP: Band Unfolding code for Plane-wave based calculations
cometscome/TightBinding.jl
This can construct the tight-binding model and calculate energies
santoshkumarradha/pysktb
Scientific Python package for solving Slater Koster tight-binding topological hamiltonian
hungpham2017/mcu
Modeling and Crystallographic Utilities
LaurentNevou/Light_PhotonicCrystal_2D
Band diagram and Field of 2D photonic cristal
freude/NanoNet
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.
rubel75/fold2Bloch-VASP
Unfolding the band structure of a supercell obtained with VASP
pritampanda15/Siesta
FDF files for relaxation, PDOS and Denchar calculations in SIESTA 4.0.2 version as well as 4.1v and PSML supported version
JuDFTteam/masci-tools
Post-processing toolkit for electronic structure calculations
LaurentNevou/Q_band_ZB
Computes the electronic band structure of Zinc Blende semiconductor
LaurentNevou/Q_kp_multiband_ZB_strain
Computes the electronic band structure of bulk ZB semiconductor with k.p models WITH STRAIN
tpolakovic/SimpleQuantum
A Julia package for calculating properties of crystalline solids.
aromanro/TightBinding
Semi-empirical tight-binding computation of the electronic structure of semiconductors
f-fathurrahman/ffr-ElectronicStructure.jl
Electronic structure calculations using Julia
JuDFTteam/aiida-fleur
AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calculations.
JuDFTteam/aiida-kkr
AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.
LaurentNevou/Q_kp_multiband_ZB
Computes the electronic band structure of bulk ZB semiconductor with various k.p models
alejandrojuria/tightbinder
General purpose Slater-Koster tight-binding library for electronic structure calculations
RemiHelleboid/UltimateEPM
Band Structure and Density of States computation of the Brillouin Zone.
rubel75/fold2Bloch-Wien2k
Unfolding of first-principle electronic band structure
mpes-kit/fuller
Probabilistic machine learning for reconstruction and parametrization of electronic band sturcture from photoemission spectroscopy data
harrisonlabollita/w2kplot
Matplotlib wrapper for WIEN2k post-processing
jarvist/ApproxEffectiveMass
Effective mass from a (VASP?) bandstructure calculation via ApproxFun fitting to the bands, a WIP.
emanuelm33/BinPo
BinPo: A code for electronic properties of 2D electron systems
LaurentNevou/Q_kp_multiband_WZ_strain
Computes the electronic band structure of bulk Wurtzite semiconductors
shamim-hussain/graphene_bulk_nanoribbon_tightbinding
Nearest neighbor tight-binding estimation of band structures of bulk and nano-ribbon (Armchair and Zigzag) graphene.
Anupam-Bh/ML_2D_flat_band
Codes and data used in our paper 'Deep learning approach to genome of two-dimensional materials with flat electronic bands'
aromanro/EmpiricalPseudopotential
Band structure computation using empirical pseudopotentials
LaurentNevou/Q_band_ZB_3dplot
Computes and plot the electrons distribution in the ZB Brillouin zone
ChangChunHe/draw_band_dos
A simple script to draw band structure and DOS diagram
rjrosati/band-structure
Simple band structure computation for Bravais-lattice materials in Python.
TITAN-FZJ/TITAN
Tight-binding suite code for electronic structure of nanomaterials
santoshkumarradha/oxides-perspective
Codes and plots for 2D correlated Oxides review paper
wrs28/Kwant.jl
Julia binding to kwant
EgorcaA/qe_helper
Tool to help you analyze and visualize the results from Quantum Espresso (Band structure BS, DOS, pDOS)