renpj Goto Github PK

ase-mindmap

Mindmap for ASE

ase-quantumespresso

ASE interface to Quantum Espresso

auto_phase_diagram

Automatic analysis and plot phase diagram from DFT calculation.

autoase

Automatically generate tool of ase job

autografs

Python library for generation of MOFs, COFs, Zeolites...

autopilot-reaction-pathway-searching

awesome-tmux

搜集各种 tmux 资源

bayesian-machine-learning

Notebooks about Bayesian methods for machine learning

bayesian-optimization

Python code for bayesian optimization using Gaussian processes

catmap

Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening

daily_writing

Count the word number of your daily writing.

dj-paginator

Django + Pagination made easy.

django-admin-bootstrapped

A Django admin theme using Twitter Bootstrap. It doesn't need any kind of modification on your side, just add it to the installed apps.

django-feed-reader

An RSS/Atom/JSONFeed reading + storing library for Django

django-yarr

A lightweight customisable RSS reader for Django.

feedthing

A Django based personal RSS reader

iron-database

Database for iron based materials, formation enegy, phase, morphology, etc

joplin-custom-css

📝 My custom styles for Joplin, the open source note taking app

kmc_zeolite

lyrics-translate

把外文歌词音译成中文，发现其韵脚

molscience

Selective molecular simulation stuffs.

notes-python

中文 Python 笔记

objgraph

Visually explore Python object graphs

p4vasp

p4vasp, the VASP Visualization Tool

performance-in-lab

A general framework for share the performance of frontier techniques in laboratory, such as catalyst activity, photocatalytic water splitting.

python_course

python course for our group members in Wen's group@synfuels china.

scan_ts

Automated Relaxed Potential Energy Surface Scans (ARPESS)

sensor-being

Collect the knowledge about sensor, physical, chemical, biological etc.

thunder-master

This is the master directory containing all the modules for the FIREBALL codes. All the codes utilize the same modules to maintain input and output consistency between the different codes.

zeolite-genetic-algo

Python code to generate an initial set of adsorbed molecules in random configurations within a Zeolite framework, which is subsequently used for Global minimization in a genetic algorithm