JOSS Papers: transition states

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3747
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366
published Published about 2 months ago

FIRECODE: A Computational Chemistry Workflow Driver and Modular Hub

Python
@ntampellini
10.21105/joss.10698
published Published 2 months ago

PyDMF: A Python package for variational double-ended reaction-path and transition-state optimization

Python
@shin1koda
10.21105/joss.10379
published Published over 6 years ago

UPOsHam: A Python package for computing unstable periodic orbits in two-degree-of-freedom Hamiltonian systems

Python Jupyter Notebook
@WyLyu
10.21105/joss.01684
Displaying 3 papers

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ISSN 2475-9066