mp2
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Fermi quantum chemistry program
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Apr 8, 2024 - Julia
Electronic Structure Package with the NEO/APMO implementation
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Aug 16, 2024 - Fortran
Simple code for quantum chemistry
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Jun 10, 2023 - Python
Massively parallel electronic structure code for experimentation
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May 15, 2024 - C
The Hartree-Fock algorithm, a method for approximating the wave function and energy of a quantum many-body system by assuming that the exact N-body wave function of the system can be adequately described by a single Slater determinant. The goal of this project is to implement the HF algorithm for the H2 molecule.
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Feb 16, 2024 - Fortran
An attempt at an MPEG-2 part 3 decoder in Rust.
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Nov 17, 2020
forked from CMSI SMASH dev 2.30, using this repo to try and incorporate ddpcm, nothing is working, this is just holding the code for me whilst i work on it. I do NOT own any of this code, its very good fortran mind you. However, 2 electron integrals are complex and this will take ages.
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Jun 25, 2024 - Fortran
Misc python utilities
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Oct 3, 2023 - Python
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