Quantum Package : a programming environment for wave function methods

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Open-source programming environment for quantum chemistry specially designed for wave function methods. Its main goal is the development of determinant-driven selected CI methods and multi-reference PT2.

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Scripts to export the SPIP MySQL database of the current website to plain text Markdown files with YAML front-matter metadata.

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Plugins for QP2

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Miroir du script de test face aux failles CPU.

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Cost_package backup

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Quantum chemistry written with OCaml

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QuAcK is a small quantum chemistry package written in Fortran. It is mostly used for easy prototyping.

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Repository related to the organization of the ERC PTEROSOR mid-term workshop Organisers: Amandine Laurent Yann Damour Fabris Kossoski Pierre-Francois Loos

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Poster on Excited-state functional for the emerging excited-state methods workshop

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source files of the QUEST papers

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