jtsun

aiida-phonopy

Phonon for AiiDA

ascii-phonons

Blender extensions for illustrations of phonons

BerryPI

Software to study polarization of crystalline solids with density functional all-electron package

BrillouinZones

Programs for constructing Brillouin zones in three- and two-dimensional space.

chinese-poetry

The most comprehensive database of Chinese poetry 🧶最全中华古诗词数据库, 唐宋两朝近一万四千古诗人, 接近5.5万首唐诗加26万宋诗. 两宋时期1564位词人，21050首词。

cif2cell

Generating geometries for electronic structure calculations from CIF files.

Elements

⚛⚗ A desktop App which displays the periodic table

FL_transport

Floquet transport of periodic driven system

Floquet_Lattice

Periodic-Time Driven System

floquetgraphene

Matlab codes for running in the cluster

jtsun.github.io

Brief introduction for Personal Website

lime

Computational tools for light-matter interaction including quantum dynamics, periodically driven quantum systems, open quantum systems and electronic and optical properties of matter.

matgenb

Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.

periodic-table

PERIODIC TABLE WITH VUE JS

periodictable

Extensible periodic table for python

phonon_bandplot

Plot phonon band structure and fix the ordering problem in Phonopy

phonon_structure_factor_calculations

Example for NaCl based almost entirely on phonopy

PhononCode

PhononSED

Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors

phononTB

Construct phonon tight-binding model and calculate its topological properties

PhononTrans

Phonopy-Spectroscopy

A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.

plotly_svg

Convenient way of generating vector graphics from plotly offline

PROPhet

PROPhet is a code to integrate machine learning techniques with first-principles quantum chemistry approaches

quantum-honeycomp

Package to perform tight binding calculation in graphene systems, with a friendly user interface

rampy

Python software for spectral data processing (IR, Raman, XAS...)

scikit-opt

Genetic Algorithm, Particle Swarm Optimization, Simulated Annealing, Ant Colony Optimization Algorithm,Immune Algorithm, Artificial Fish Swarm Algorithm, Differential Evolution and TSP(Traveling salesman) 遗传算法、粒子群算法、模拟退火算法、蚁群算法等

svg_parser

tightbinding

Rust tools for tight-binding calculations

wannier

Julia code for the computation of Wannier functions