twang0686

Pinned Repositories

ase-espresso
ase interface for Quantum Espresso
Language:Python00
CatKit
General purpose tools for high-throughput catalysis
Language:Python1 2 00
CatLearn
An atomistic machine learning environment for catalysis
Language:Python00
catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
Language:Python00
decaf-espresso
Light weight wrapper for ASE integration with Quantum Espresso
Language:Python0 2 00
documentation
Plotly's Documentation
Language:Jupyter Notebook0 2 00
fireworks
The Fireworks Workflow Management Repo.
Language:Python00
handson-ml
A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in python using Scikit-Learn and TensorFlow.
Language:Jupyter Notebook0 2 00
MacroDensity
Analyse VASP density & potential grids using python
Language:Jupyter Notebook0 2 00

twang0686's Repositories

twang0686/CatKit
General purpose tools for high-throughput catalysis
Language:Python1 2 00
twang0686/ase-espresso
ase interface for Quantum Espresso
Language:Python00
twang0686/CatLearn
An atomistic machine learning environment for catalysis
Language:Python00
twang0686/catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
Language:Python00
twang0686/decaf-espresso
Light weight wrapper for ASE integration with Quantum Espresso
Language:Python0 2 00
twang0686/documentation
Plotly's Documentation
Language:Jupyter Notebook0 2 00
twang0686/fireworks
The Fireworks Workflow Management Repo.
Language:Python00
twang0686/handson-ml
A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in python using Scikit-Learn and TensorFlow.
Language:Jupyter Notebook0 2 00
twang0686/MacroDensity
Analyse VASP density & potential grids using python
Language:Jupyter Notebook0 2 00
twang0686/matgenb
Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.
Language:Jupyter Notebook2 0
twang0686/molSimplify
molSimplify code
Language:HTML
twang0686/neural-networks-and-deep-learning
Code samples for my book "Neural Networks and Deep Learning"
Language:Python
twang0686/periodic-table-plotter
Make periodic table map plots and pettifor-style trend plots.
Language:Python
twang0686/Python_Tutorials
Python tutorials in both Jupyter Notebook and youtube format.
Language:Jupyter Notebook
twang0686/q-e
Official mirror of Quantum ESPRESSO
twang0686/qmpy
A suite of computational materials science tools.
Language:Python
twang0686/rexgen_direct
Template-free prediction of organic reaction outcomes
Language:Jupyter Notebook
twang0686/scikit-learn
scikit-learn: machine learning in Python
Language:Python