The CMI Active-Learning-of-PES is provided by the CFEL-CMI group as is. It is licensed under the GPL v3 with the following additional requests to users:
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Its use for scientific work is acknowledged by the appropriate reference of the following publication in any resulting work, e.g., scientific publication.
Y. Saleh, V. Sanjay, A. Iske, A. Yachmenev, and J. Küpper, “Active learning of potential-energy surfaces of weakly-bound complexes with regression-tree ensembles,” arXiv (2021), arXiv:2104.00708 [Physics].
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All corrections and enhancements are contributed back to the development of the package within an appropriate time, i.e., no later than the publication of its first use. Please create a pull request on GitHub (preferred) or send an appropriate patch against the latest program version on the
developbranch.
See the documentation for a full list of contributors.