Condensed Matter Physics Python Packages

erlab

Complete python workflow for Angle-Resolved Photoemission Spectroscopy (ARPES)

pythtb

Python library for constructing and analyzing tight-binding models

tbkit

Build and solve tight-binding models in Python: band structures, band topology (Chern, Z2, higher-order), quantum transport, Floquet and moiré systems, in vectorized NumPy/SciPy, for teaching and research

spinspg

Python package for detecting spin space group on top of spglib

aiida-kkr

AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.

physicskit

Watch the laws of physics play out: a Python toolkit for learning and teaching computational physics across 14 domains, from quantum mechanics to black holes, built on numpy/scipy

aiida-fleur

AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calculations.

thztools

Tools for terahertz time-domain spectroscopy (THz-TDS)

hofstadtertools

A Python package for analyzing the Hofstadter model.

piva

Interactive tools for the visualization and analysis of multidimensional photoemission data

quartic2d

QUARTIC2D: four-center interaction tensors for localized 2D orbital bases using angular harmonics and Hankel transforms with general radial kernels.

arpespythontools

Explore, analyze, visualize Angle Resolved Photoemission Spectroscopy (ARPES) data.

risb

Solve strongly correlated condensed matter systems. Fast and simple.

wyckoff

A package for working with Wyckoff positions in crystallography

aiida-spirit

AiiDA plugin for the spirit code

dompap

Simulations of point-like particles in any dimension with any pair potential using Python.

spatialstats

spatialstats is collection of statistical tools and utility routines used to analyze the multi-scale structure of 2D and 3D spatial fields and particle distributions.

hextof-processor

Code for preprocessing data from the HEXTOF instrument at FLASH, DESY in Hamburg (DE)

kappamin

A python3 code for calculations of the minimum limit to thermal conductivity

nano-negf

A Python framework for the self-consistent solution of 1D Non-Equilibrium Green's Function (NEGF) and Poisson equations for nanowire (nano device) ballistic structures.

mpes

Distributed data processing routines for multidimensional photoemission spectroscopy (MPES)

pesfit

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

tightbinder

General purpose Slater-Koster tight-binding library for electronic structure calculations

gigaanalysis

A toolbox for processing data that can be expressed as a dependent and independent variable.