ec-mos-toolkits

This is a toolkit for interfacial electrochemistry of metal oxide semicondutors.

Installation

You can install the package directly from the GitHub repository:

pip install git+https://github.com/Cyclones-X/ec-mos-toolkits.git

Or from source:

git clone https://github.com/Cyclones-X/ec-mos-toolkits.git
cd ec-mos-toolkits
pip install .

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Upgrade

Currently this toolkits is developing, and the version would not be always changed. Therefore, it is recommended to upgrade it with --force-reinstall.

Similarly, you can upgrade from GitHub repository:

pip install --upgrade --force-reinstall git+https://github.com/Cyclones-X/ec-mos-toolkits.git 

Or from source:

git clone https://github.com/Cyclones-X/ec-mos-toolkits.git
cd ec-mos-toolkits
pip install --upgrade --force-reinstall .

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Manual

Interface Structure Analysis

• Interface

Wannier Centroid Analysis

• Wannier/Electrostatic Potential Calculator
• Wannier/Cell Dipole Calculator