maon-del's repositories
angr-z3
The Z3 Theorem Prover - repository for staging python distributions
banddownfolder
Downfold electron/phonon/magnon/etc Hamiltonian
BrillouinZones
Programs for constructing Brillouin zones in three- and two-dimensional space.
compPhy
Assortment of code for model systems in computational physics - https://github.com/rajeshrinet/compPhy
DeepH-pack
Deep neural networks for density functional theory Hamiltonian.
DFT-EXERCISES
DENSITY FUNCTIONAL THEORY EXERCISES
Group-meeting
整理组会上的PPT以及代码
jarvis
JARVIS-Tools: an open-source software package for data-driven atomistic materials design
Model-Hamiltonian
Generate Model Hamiltonian under a basis using symmetry
nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
OptimizedTensorContraction
Global search algorithms for finding optimal tensor network contraction sequences.
papers-code-GrapheneCorrugation
Code repository for paper on corrugation effects in graphene.
pcn
Calculate the partial Chern number for a given spinor slab(finite in one direction, periodic in the other two) model.
Phonon_scattering_frequency_dependence
Script to parse ShengBTE outputfiles to check the frequency dependence of scattering rates and calculate the analytical Gruneisen parameter.
seekpath
A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
skyrmion-model
python code modelling skyrmion dynamics
TBmodels
A tool for creating and manipulating tight-binding models.
TBpack
Tight-binding calculations in Mathematica
Two_band_model_p-type_PbTe
Two-band transport model for Thermopower vs. carrier concentration relations of p-type PbTe
VASP2KP
compute kp parameters and Lande g-factors directly from the VASP wavefunctions.
wannier-berri
Advanced tool for Wannier interpolation and integration of k-space integrals
Z2Pack
A tool for calculating topological invariants.