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Library focused on fragment-based methods and basis-set superposition corrections

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jlheflin/GhostFragment

 
 

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GhostFragment

GhostFragment is a computational chemistry library focused on reusable, modular implementations of fragment-based methods and basis-set superposition corrections.

Primary features include:

  • Extensive background documentation.
  • Nothing yet!!!

Funding

TODO: Thank LDRD and CTC projects.

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Library focused on fragment-based methods and basis-set superposition corrections

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  • C++ 87.3%
  • Python 11.2%
  • CMake 1.5%