wwjCMP's repositories
boltzTrap-extraction
Extracting Boltzrap data
deeplearningbook-chinese
Deep Learning Book Chinese Translation
DFTfun_A_density_functional_theory_solver
A matlab implementation of density functional theory, for demonstrative purpose
DynaPhoPy
Phonon Analysis from Molecular Dynamics Data
Electronic-structure-calculations-course
Matherials for the course Electronic structure calculations
JQ_lanczos
Exact diagonalization for Sandvik's JQ model
KMCLib
A kinetic Monte Carlo Python/C++ library.
LaTeX2Word-Equation
Copy LaTeX Equations as Word Equations, Chrome Extension
lev00
L. N. Kantorovich, User-friendly visualisation program for ab initio DFT codes VASP, SIESTA, QE and QUICKSTEP, 1996-2012, unpublished.
libmin
FFTW style library that encapsulates LBFGS minization algorithm
molgw
Accurate many-body perturbation theory calculations of the electronic structure of molecules
numerical-mooc
A collaborative educational initiative in computational science and engineering.
pdfminer
Python PDF Parser
physical_chemistry
Files used in TMP Chem videos on physical chemistry
scipy-lecture-notes_cn
Pytho科学计算生态介绍的中文翻译，英文原文地址：
TREE
Density Matrix Renormalization Group (DMRG) algorithm on Tree Tensor Network States (TTNS)
VASPy
Manipulating VASP files with Python.