Optical absorption measurements and optoelectronic DFT calculations for ethanol solvated quercetin and anhydrous/hydrated quercetin crystals

UV–vis optical absorption measurements of the ethanol solvated quercetin molecule and the dihydrate triclinic quercetin crystal were performed, as well as the electronic structure of the ethanol solvated quercetin molecule and the properties of anhydrous and mono(di)hydrated quercetin crystals emplo...

Full description

Autores:

de Paula V.F., Jr
Guedes M.I.F.
van Tilburg M.F
Vieira I.G.P.
Silva J.B.
dos Santos R.C.R.
Echeverry J.P.
Costa G
Silva B.P
Maia F.F., Jr.
Caetano E.W.S.
Freire V.N.

Tipo de recurso:

Article of investigation

Fecha de publicación:

2022

Institución:

Universidad de Ibagué

Repositorio:

Repositorio Universidad de Ibagué

Idioma:

eng

OAI Identifier:

oai:repositorio.unibague.edu.co:20.500.12313/5499

Acceso en línea:

https://hdl.handle.net/20.500.12313/5499

Palabra clave:

Mediciones de absorción optica
Cálculos DFT optoelectrónicos
Quercetina disuelta en etanol
Cristales de quercetina
Cristales moleculares hidratados
Cálculos de DFT
Propiedades estructurales
Propiedades optoelectrónicas
Estabilidad relativa
DFT calculations
Ethanol solvated quercetin
Hydrated molecular crystals
Optoelectronic properties
Quercetin crystals
Relative stability
Structural properties

Rights

openAccess

License

http://purl.org/coar/access_right/c_abf2