Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules (2024)
- Authors:
- USP affiliated authors: COUTINHO, KALINE RABELO - IF ; VARELLA, MARCIO TEIXEIRA DO NASCIMENTO - IF ; KIATAKI, MATHEUS BACIGALUPO - IF
- Unidade: IF
- DOI: 10.1021/acs.jctc.4c00256
- Subjects: ELÉTRONS; MOLÉCULA; MASSA
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Publisher: American Chemical Society
- Publisher place: New York
- Date published: 2024
- Source:
- Título: Journal of Chemical Theory and Computation
- Volume/Número/Paginação/Ano: v. 20, n. 11, p. 4385-4950, 2024
- Este periódico é de assinatura
- Este artigo é de acesso aberto
- URL de acesso aberto
- Cor do Acesso Aberto: green
- Licença: other-oa
-
ABNT
KIATAKI, Matheus Bacigalupo et al. Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules. Journal of Chemical Theory and Computation, v. 20, n. 11, p. 4385-4950, 2024Tradução . . Disponível em: https://doi.org/10.1021/acs.jctc.4c00256. Acesso em: 03 jan. 2026. -
APA
Kiataki, M. B., Varella, M. T. do N., Coutinho, K. R., & Rabilloud, F. (2024). Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules. Journal of Chemical Theory and Computation, 20( 11), 4385-4950. doi:10.1021/acs.jctc.4c00256 -
NLM
Kiataki MB, Varella MT do N, Coutinho KR, Rabilloud F. Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules [Internet]. Journal of Chemical Theory and Computation. 2024 ; 20( 11): 4385-4950.[citado 2026 jan. 03 ] Available from: https://doi.org/10.1021/acs.jctc.4c00256 -
Vancouver
Kiataki MB, Varella MT do N, Coutinho KR, Rabilloud F. Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules [Internet]. Journal of Chemical Theory and Computation. 2024 ; 20( 11): 4385-4950.[citado 2026 jan. 03 ] Available from: https://doi.org/10.1021/acs.jctc.4c00256 - Solvent effect upon resonances
- New approach to instantaneous polarizable electrostatic embedding of the solvent
- Toward a numerically efficient description of bulk-solvated anionic states
- Solvatação de atomos de positrônio
- Shape Resonances and Elastic Cross Sections in Electron Scatteringby CF3Br and CF3I
- Estados aniônicos de moléculas isoladas, microsolvatadas, e solvatadas
- Electron collisions with the HCOOH...('H IND. 2' O) n ( n =1, 2 and 3) complexes in liquid phase: the influence on the 'pi' POT. *' shape resonance of formic acid
- Electron collisions with the 'H''C''O''O''H'⋯'('H'IND. 2''O') IND. n' complexes (n = 1, 2) in liquid phase: the influence of microsolvation on the 'pi' POT. *' resonance of formic acid
- Communication: Transient anion states of phenol…(H2O) n (n = 1, 2) complexes: search for microsolvation signatures
- Free energy barrier for dissociation of the guanosine monophosphate anion in water
Informações sobre o DOI: 10.1021/acs.jctc.4c00256 (Fonte: oaDOI API)
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