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yw-fang.github.io Public
Forked from RayeRen/acad-homepage.github.ioWelcome to Academic Personal Homepage of Yuewen
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tool_library Public
my personal tools including shell, python, sed
Python Mozilla Public License 2.0 UpdatedDec 30, 2024 -
quacc Public
Forked from Quantum-Accelerators/quaccquacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.
Python BSD 3-Clause "New" or "Revised" License UpdatedOct 7, 2024 -
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phtools Public
Tools for the visualization of phonon results
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sGDML Public
Forked from stefanch/sGDMLsGDML - Reference implementation of the Symmetric Gradient Domain Machine Learning model
Python MIT License UpdatedJun 13, 2023 -
API_Phonons Public
Forked from xinqian-mit/API_PhononsThis API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.
Python UpdatedApr 23, 2023 -
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readingnotes Public
This repository shows my reading notes on ab-initio codes, machine learning, programming, and so on
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jabbrv Public
Forked from compholio/jabbrvAutomatic Journal Title Abbreviation Package for LaTeX
TeX UpdatedFeb 24, 2023 -
supercell Public
Forked from orex/supercellThe program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
C++ GNU General Public License v2.0 UpdatedJan 7, 2023 -
CrySPY_utility Public
Forked from Tomoki-YAMASHITA/CrySPY_utilityJupyter Notebook UpdatedDec 1, 2022 -
Tools-1 Public
Forked from Chengcheng-Xiao/ToolsDFT post processing tools
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q-e Public
revised-qe based on official release of https://github.com/QEF/q-e/commit/ce561e80fa51fbc2904c59db0bf7fc0b825e1bb9
Fortran GNU General Public License v2.0 UpdatedSep 16, 2022 -
dwm Public
Forked from pastebt/dwmDownload Web Movies
Python GNU General Public License v3.0 UpdatedAug 11, 2022 -
CrySPY Public
Forked from Tomoki-YAMASHITA/CrySPYWebsite and document: https://tomoki-yamashita.github.io/CrySPY
Python MIT License UpdatedJul 20, 2022 -
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CRYSTREE Public
Forked from bliseu/CRYSTREEA crystal structure predictor based on machine learning
UpdatedMay 28, 2022 -
xtb Public
Forked from grimme-lab/xtbSemiempirical Extended Tight-Binding Program Package
Fortran GNU Lesser General Public License v3.0 UpdatedMar 18, 2022 -
SVM-bandgap Public
SVM benchmark for prediction of band gaps of semiconductors.
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CSP-maise Public
Forked from maise-guide/maiseMAISE Module for Ab Initio Structure Evolution (MAISE)
C GNU General Public License v3.0 UpdatedFeb 28, 2022 -
dpti Public
Forked from deepmodeling/dptiPython GNU Lesser General Public License v3.0 UpdatedFeb 16, 2022 -
SurfinPy Public
Forked from symmy596/SurfinPyThermodynamic Phase Diagram Generator
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qeAPI Public
Forked from Lonitch/qeAPIAn API btw Quantum ESPRESSO and Python
Jupyter Notebook UpdatedJan 28, 2022 -
sumo Public
Forked from SMTG-Bham/sumoHeavyweight plotting tools for ab initio calculations
Python MIT License UpdatedJan 7, 2022 -
PlotNeuralNet Public
Forked from HarisIqbal88/PlotNeuralNetLatex code for making neural networks diagrams
TeX MIT License UpdatedJan 5, 2022 -
pymatgen-notebook Public
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vaspwiki Public
An easy way to getting access to The VASP Manual
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tools Public
Forked from fxcoudert/toolsTools and scripts I wrote and regularly use
Jupyter Notebook MIT License UpdatedAug 21, 2021
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