MoHa is abbreviation of Molecular&Model Hamiltonian, it is a quantum chemistry program written in python. MoHa now is not a formal program but a toy for practice coding and help myself to have a better understanding of quantum chemistry.
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Prerequisties:
- Python 3.5 or above
- numpy 1.13.1
- scipy 0.19.1
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Compile
git clone https://github.com/ZhaoYilin/modelham.git cd moha python setup.py install --user
For more information, visit MOHA's website: https://zhaoyilin.github.io/moha/