Detail publikačního výsledku

Spectroscopic behavior of alloxazine derivates: Theory vs Experiment

D. Cagardová, M. Michalík, J. Richtár, M. Weiter, J. Krajčovič, V. Lukeš

Originální název

Spectroscopic behavior of alloxazine derivates: Theory vs Experiment

Anglický název

Spectroscopic behavior of alloxazine derivates: Theory vs Experiment

Druh

Abstrakt

Originální abstrakt

Novel photoactive materials have a great number of applications, such as photoelectronics, photocatalysis, or even photoantimicrobial therapy. Furthermore, the molecules of interest in our research, derivates of benzo[g]pteridine (alloxazine) are biologically compatible and may therefore be used in the growing area of biosensing and bioelectronics. Light absorption and emission spectra play an important role in these applications, since the electronic transition energies determine whether the photoactive molecule is capable of driving a photocatalytic process or the wavelength of light-emitting diodes. In alloxazine derivatives, the electronic spectra are noticeably red-shifted when the molecule undergoes tautomerization. Combined with the possibility to tune absorption energies by adding substituents, it is possible to cover a broad range of the solar spectrum.

Anglický abstrakt

Novel photoactive materials have a great number of applications, such as photoelectronics, photocatalysis, or even photoantimicrobial therapy. Furthermore, the molecules of interest in our research, derivates of benzo[g]pteridine (alloxazine) are biologically compatible and may therefore be used in the growing area of biosensing and bioelectronics. Light absorption and emission spectra play an important role in these applications, since the electronic transition energies determine whether the photoactive molecule is capable of driving a photocatalytic process or the wavelength of light-emitting diodes. In alloxazine derivatives, the electronic spectra are noticeably red-shifted when the molecule undergoes tautomerization. Combined with the possibility to tune absorption energies by adding substituents, it is possible to cover a broad range of the solar spectrum.

Klíčová slova

Coputational Chemistry; Theoretical Spectroscopy, Experimental Spectroscopy

Klíčová slova v angličtině

Coputational Chemistry; Theoretical Spectroscopy, Experimental Spectroscopy

Autoři

D. Cagardová, M. Michalík, J. Richtár, M. Weiter, J. Krajčovič, V. Lukeš

Rok RIV

2022

Vydáno

14.08.2021

Strany od

60

Strany do

60

Strany počet

1

URL

https://summerschooldresden.science/#Programme

Plný text v Digitální knihovně

http://hdl.handle.net/

BibTex

@misc{BUT173153,
  author="Jan {Truksa} and Jan {Richtár} and Martin {Weiter} and Jozef {Krajčovič}",
  title="Spectroscopic behavior of alloxazine derivates: Theory vs Experiment",
  year="2021",
  pages="60--60",
  url="https://summerschooldresden.science/#Programme",
  note="Abstract"
}