Skip to main content

SBQT 2021

ISSN: 2965-5900
Login
SBQT 2021
  • Presentation
  • Organizing committee
  • Publication standards
  • Papers
  • Tracks
  • Authors
  • Feed
  • Ranking
  • Contact
  • Current edition

Anais do Simpósio Brasileiro de Química Teórica
Proceedings of the XXI Brazilian Symposium on Theoretical Chemistry - Vol. 1 2021

ISSN: 2965-5900
  • English
  • Portuguese, Brazil
Login
Universidade Federal de Pernambuco - UFPE

ALFREDO MAYALL SIMAS

Also published on: SBQT 2023

Is this your profile? Do login to access your certificates
Papers 2Topics 1
  • An Uncomplicated but Effective Force Field for the Pre-optimization of Geometries of Metal Complexes for Quantum Chemical Calculations

    • Gabriel Urquiza 1
    • Gabriel Henrique Lima Munguba 2
    • Frederico Teixeira Silva 3
    • ALFREDO MAYALL SIMAS 1
    • 1 Universidade Federal de Pernambuco - UFPE
    • 2 Universidade Federal de Pernambuco
    • 3 Hilab
    Vol 21, 2021 -
    141127
    Computational Chemistry
    Apresentação Oral Síncrona / Synchronous Oral Communication
  • Starting Structures of Lanthanoid Complexes with Stereochemical Control for Molecular Modeling

    • Gabriel Henrique Lima Munguba 1
    • Gabriel Urquiza 1
    • Frederico Teixeira Silva 2
    • ALFREDO MAYALL SIMAS 3
    • 1 Universidade Federal de Pernambuco
    • 2 Hilab
    • 3 Universidade Federal de Pernambuco - UFPE
    Vol 21, 2021 -
    141123
    Computational Chemistry
    Apresentação de Pôster / Poster Communications

Co-authors (3)

  • Gabriel Urquiza

    3 publications

  • Frederico Teixeira Silva

    3 publications

  • Gabriel Henrique Lima Munguba

    2 publications

Publications in other proceedings

  • SBQT 2023

    Complex Build 1.1.0: From Lanthanides to Scandium and Yttrium with New Functionalities for Advanced Complex Design

  • SBQT 2023

    Decision trees for coordination chirality in metal complexes

  • 44ª RASBQ

    Multiplicidade de estereoisômeros e reconhecimento da quiralidade de coordenação em complexos de íons lantanídeos pelo software Complex Build

Streamline your Scholarly Event

With nearly 200,000 papers published, Galoá empowers scholars to share and discover cutting-edge research through our streamlined and accessible academic publishing platform.
Learn more about our products:

Proceedings Call for Papers Mobile Apps AMS for Scientific Associations
Galoá logo
Learn more

How to cite this proceedings?

This proceedings is identified by a DOI , for use in citations or bibliographic references. Attention: this is not a DOI for the paper and as such cannot be used in Lattes to identify a particular work.

Check the link "How to cite" in the paper's page, to see how to properly cite the paper