The Devil’s Triangle of Kohn–Sham density functional theory and excited states (2021)
- Authors:
- USP affiliated authors: HAIDUKE, ROBERTO LUIZ ANDRADE - IQSC ; MENDES, RODRIGO ARAÚJO - IQSC
- Unidade: IQSC
- DOI: 10.1063/5.0035446
- Assunto: QUÍMICA QUÂNTICA
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Source:
- Título do periódico: The Journal of Chemical Physics
- ISSN: 1089-7690 (online)
- Volume/Número/Paginação/Ano: v. 154, p. 074106, FEB, 2021
- Este periódico é de assinatura
- Este artigo é de acesso aberto
- URL de acesso aberto
- Cor do Acesso Aberto: hybrid
- Licença: publisher-specific-oa
-
ABNT
MENDES, Rodrigo Araujo e HAIDUKE, Roberto Luiz Andrade e BARTLETT, Rodney J. The Devil’s Triangle of Kohn–Sham density functional theory and excited states. The Journal of Chemical Physics, v. 154, p. 074106, 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0035446. Acesso em: 03 jun. 2024. -
APA
Mendes, R. A., Haiduke, R. L. A., & Bartlett, R. J. (2021). The Devil’s Triangle of Kohn–Sham density functional theory and excited states. The Journal of Chemical Physics, 154, 074106. doi:10.1063/5.0035446 -
NLM
Mendes RA, Haiduke RLA, Bartlett RJ. The Devil’s Triangle of Kohn–Sham density functional theory and excited states [Internet]. The Journal of Chemical Physics. 2021 ; 154 074106.[citado 2024 jun. 03 ] Available from: https://doi.org/10.1063/5.0035446 -
Vancouver
Mendes RA, Haiduke RLA, Bartlett RJ. The Devil’s Triangle of Kohn–Sham density functional theory and excited states [Internet]. The Journal of Chemical Physics. 2021 ; 154 074106.[citado 2024 jun. 03 ] Available from: https://doi.org/10.1063/5.0035446 - An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors
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Informações sobre o DOI: 10.1063/5.0035446 (Fonte: oaDOI API)
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