Apptainer recipes
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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
Updated 2024-04-17 20:23:17 +02:00
Fortran90 preprocessor for programming using the Implicit Reference to Parameters (IRP) method. It simplifies the development of large fortran codes in the field of scientific high performance computing.
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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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Quantum Package : a programming environment for wave function methods
Updated 2024-05-02 16:22:43 +02:00
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.
Updated 2024-05-02 16:22:43 +02:00