Combining ab initio multiconfigurational and free energy gradient methods to study the 'pi'–'pi' POT. *' excited state structure and properties of uracil in water (2014)
- Authors:
- Autor USP: CANUTO, SYLVIO ROBERTO ACCIOLY - IF
- Unidade: IF
- DOI: 10.1016/j.comptc.2014.04.024
- Subjects: FLUORESCÊNCIA; ELETROSTÁTICA
- Language: Inglês
- Imprenta:
- Source:
- Título do periódico: COMPUTATIONAL AND THEORETICAL CHEMISTRY
- Volume/Número/Paginação/Ano: v. 1040, p. 312-320, jul.2014
- Este periódico é de assinatura
- Este artigo NÃO é de acesso aberto
- Cor do Acesso Aberto: closed
-
ABNT
BISTAFA, Carlos e GEORG, Herbert C. e CANUTO, Sylvio Roberto Accioly. Combining ab initio multiconfigurational and free energy gradient methods to study the 'pi'–'pi' POT. *' excited state structure and properties of uracil in water. COMPUTATIONAL AND THEORETICAL CHEMISTRY, v. 1040, p. 312-320, 2014Tradução . . Disponível em: https://doi.org/10.1016/j.comptc.2014.04.024. Acesso em: 19 abr. 2024. -
APA
Bistafa, C., Georg, H. C., & Canuto, S. R. A. (2014). Combining ab initio multiconfigurational and free energy gradient methods to study the 'pi'–'pi' POT. *' excited state structure and properties of uracil in water. COMPUTATIONAL AND THEORETICAL CHEMISTRY, 1040, 312-320. doi:10.1016/j.comptc.2014.04.024 -
NLM
Bistafa C, Georg HC, Canuto SRA. Combining ab initio multiconfigurational and free energy gradient methods to study the 'pi'–'pi' POT. *' excited state structure and properties of uracil in water [Internet]. COMPUTATIONAL AND THEORETICAL CHEMISTRY. 2014 ; 1040 312-320.[citado 2024 abr. 19 ] Available from: https://doi.org/10.1016/j.comptc.2014.04.024 -
Vancouver
Bistafa C, Georg HC, Canuto SRA. Combining ab initio multiconfigurational and free energy gradient methods to study the 'pi'–'pi' POT. *' excited state structure and properties of uracil in water [Internet]. COMPUTATIONAL AND THEORETICAL CHEMISTRY. 2014 ; 1040 312-320.[citado 2024 abr. 19 ] Available from: https://doi.org/10.1016/j.comptc.2014.04.024 - Estudo teorico de espectroscopia de absorcao de liquidos moleculares
- Detailed theoretical analysis of the elctron correlation contribution to the static dipole hyperpolarizabilities of atomic anions: 'H POT.-','C POT.-','F POT.-'
- Estudo teorico de efeitos de solvente no espectro de absorcao do benzeno
- Resposta optica nao-linear de moleculas organicas
- Simulacao de Monte Carlo da Molecula de DIMETHYLAMINOINDOANILINE Dissolvida em Cloroformio
- Interações de van der Waals do 'C IND.5''H IND.5' com He e Ne
- Monte Carlo-quantum mechanics study of the solvatochromic shifts of the lowest transition of benzene
- Theoretical analysis of the hydrogen bond interaction between acetone and water
- Solvent effect and emission spectra the excited state of formaldehyde in water
- Monte Carlo-quantum mechanics study of the UV-visible spectrum of benzophenome in water
Informações sobre o DOI: 10.1016/j.comptc.2014.04.024 (Fonte: oaDOI API)
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