hartree-fock

Open-source projects categorized as hartree-fock
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Language: + C++ + Fortran + Jupyter Notebook
Topics: computational-chemistry quantum-chemistry Physics computational-physics density-functional-theory
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Top 4 hartree-fock Open-Source Projects

  • nwchem

    NWChem: Open Source High-Performance Computational Chemistry

  • HartreeFock

    A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaussian orbitals

    • Project mention: Help making plot for experiment | /r/cpp_questions | 2023-06-02

    For this one I used my own code that draws the chart: https://github.com/aromanro/HartreeFock

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  • PythonCompphys

    Some python workbooks with various topics from Computational Physics

  • hfcxx

    Hartree-Fock C++ code

NOTE: The open source projects on this list are ordered by number of github stars. The number of mentions indicates repo mentiontions in the last 12 Months or since we started tracking (Dec 2020).

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  • Did I just understand Quantum Theory?

    4 projects | /r/AskPhysics | 19 Aug 2022
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Index

What are some of the best open-source hartree-fock projects? This list will help you:

Project Stars
1 nwchem 461
2 HartreeFock 51
3 PythonCompphys 46
4 hfcxx 28

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