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Brief History of Electronic Structure Calculations in Computational Chemistry
Article
  • Jan 2022
  • DOI: 10.26502/jnr.2688-85210027
  • Wenfa Ng
    Wenfa Ng
Preview image for history and philosophy of computational chemistry
Source
history and philosophy of computational chemistry
Conference Paper
  • Aug 2022
  • Mike Renier
    Mike Renier
Computational chemistry
Chapter
  • Aug 2023
  • DOI: 10.1093/hesc/9780198504467.003.0006
  • ISBN: 9780198504467
  • Biggs Pete
    Biggs Pete
Education in Green Chemistry supported by Computational Chemistry - A Brief Review
Conference Paper
  • Mar 2023
  • DOI: 10.54265/UBFV3817
  • Jaelson Marques Martins
    Jaelson Marques Martins
  • José Renato Gomes Lopes
    José Renato Gomes Lopes
  • Lucas de Sá Batista
    Lucas de Sá Batista
  • Carlos Alberto Da Silva Júnior
    Carlos Alberto Da Silva Júnior
Preview image for Free and Open Source Software for Computational Chemistry Education
Source
Free and Open Source Software for Computational Chemistry Education
Preprint
  • Nov 2021
  • DOI: 10.26434/chemrxiv-2021-hr1r0-v2
  • Susi Lehtola
    Susi Lehtola
  • Antti J. Karttunen
    Antti J. Karttunen
Free and Open Source Software for Computational Chemistry Education
Preprint
  • Nov 2021
  • DOI: 10.33774/chemrxiv-2021-hr1r0-v2
  • Susi Lehtola
    Susi Lehtola
  • Antti J. Karttunen
    Antti J. Karttunen
Preview image for Free and open source software for computational chemistry education
Source
Free and open source software for computational chemistry education
Article
  • Mar 2022
  • DOI: 10.1002/wcms.1610
  • ISBN: 1759-0876
  • Susi Lehtola
    Susi Lehtola
  • Antti J. Karttunen
    Antti J. Karttunen
Preview image for Free and Open Source Software for Computational Chemistry Education
Source
Free and Open Source Software for Computational Chemistry Education
Preprint
  • Feb 2022
  • DOI: 10.26434/chemrxiv-2021-hr1r0-v3
  • Susi Lehtola
    Susi Lehtola
  • Antti J. Karttunen
    Antti J. Karttunen
WebMO : Web‐based computational chemistry calculations in education and research
Article
  • Jun 2021
  • DOI: 10.1002/wcms.1554
  • ISBN: 1759-0876
  • William F. Polik
    William F. Polik
  • J. R. Schmidt
    J. R. Schmidt
Preview image for COMPUTATIONAL HISTORY OF CHEMISTRY
Source
COMPUTATIONAL HISTORY OF CHEMISTRY
Article
  • Jan 2022
  • ISBN: 1053-4385
  • Guillermo Restrepo
    Guillermo Restrepo
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