Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones

Duy Duc Nguyen, Jens Spanget-Larsen

Publikation: KonferencebidragPosterForskning

Resumé

SRLD spectra of Quinizarin, Anthrarufin, and Chrysazin partially aligned in stretched polyethylene were measured at the ASTRID synchrotron UV1 beamline (ISA, Aarhus University), yielding absorbance and polarization data up to 57000 cm-1. The observed absorption bands were assigned to electronic transitions predicted by TD-DFT calculations.
OriginalsprogEngelsk
Publikationsdato2009
StatusUdgivet - 2009
BegivenhedAnnual Meeting of the Danish Chemical Society - Odense, Danmark
Varighed: 12 jun. 200912 jun. 2009

Konference

KonferenceAnnual Meeting of the Danish Chemical Society
LandDanmark
ByOdense
Periode12/06/200912/06/2009

Citer dette

Nguyen, D. D., & Spanget-Larsen, J. (2009). Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones. Poster session præsenteret på Annual Meeting of the Danish Chemical Society, Odense, Danmark.
Nguyen, Duy Duc ; Spanget-Larsen, Jens. / Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones. Poster session præsenteret på Annual Meeting of the Danish Chemical Society, Odense, Danmark.
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abstract = "SRLD spectra of Quinizarin, Anthrarufin, and Chrysazin partially aligned in stretched polyethylene were measured at the ASTRID synchrotron UV1 beamline (ISA, Aarhus University), yielding absorbance and polarization data up to 57000 cm-1. The observed absorption bands were assigned to electronic transitions predicted by TD-DFT calculations.",
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Nguyen, DD & Spanget-Larsen, J 2009, 'Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones' Annual Meeting of the Danish Chemical Society, Odense, Danmark, 12/06/2009 - 12/06/2009, .

Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones. / Nguyen, Duy Duc; Spanget-Larsen, Jens.

2009. Poster session præsenteret på Annual Meeting of the Danish Chemical Society, Odense, Danmark.

Publikation: KonferencebidragPosterForskning

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AU - Nguyen, Duy Duc

AU - Spanget-Larsen, Jens

PY - 2009

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N2 - SRLD spectra of Quinizarin, Anthrarufin, and Chrysazin partially aligned in stretched polyethylene were measured at the ASTRID synchrotron UV1 beamline (ISA, Aarhus University), yielding absorbance and polarization data up to 57000 cm-1. The observed absorption bands were assigned to electronic transitions predicted by TD-DFT calculations.

AB - SRLD spectra of Quinizarin, Anthrarufin, and Chrysazin partially aligned in stretched polyethylene were measured at the ASTRID synchrotron UV1 beamline (ISA, Aarhus University), yielding absorbance and polarization data up to 57000 cm-1. The observed absorption bands were assigned to electronic transitions predicted by TD-DFT calculations.

M3 - Poster

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Nguyen DD, Spanget-Larsen J. Synchrotron Radiation Linear Dichroism (SRLD) and Time Dependent Density Functional Theory (TD-DFT) Calculations on Dihydroxy-Anthraquinones. 2009. Poster session præsenteret på Annual Meeting of the Danish Chemical Society, Odense, Danmark.