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1

Thermal and solvent effects on the triplet formation in cinnoline

Etinski, Mihajlo, Tatchen, Jörg, Marian, Christel M.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.00 MB

english, 2014

2

Quantum-Chemical Studies on Excitation Energy Transfer Processes in BODIPY-based Donor-Acceptor Systems

Spiegel, J. Dominik, Kleinschmidt, Martin, Larbig, Alexander, Tatchen, Jörg, Marian, Christel Maria

Journal:

Journal of Chemical Theory and Computation

Year:

2015

Language:

english

File:

PDF, 8.26 MB

english, 2015

3

Singlet and Triplet Excited States and Intersystem Crossing in Free-Base Porphyrin: TDDFT and DFT/MRCI Study

Serhiy Perun, Jörg Tatchen, Christel M. Marian

Journal:

Year:

2008

Language:

english

File:

PDF, 500 KB

english, 2008

4

Spin-orbit coupling of DFT/MRCI wavefunctions: Method, test calculations, and application to thiophene

Martin Kleinschmidt, Jörg Tatchen, Christel M. Marian

Journal:

Journal of Computational Chemistry

Year:

2002

Language:

english

File:

PDF, 219 KB

english, 2002

5

Rotationally resolved electronic spectroscopy of 2,3-bridged indole derivatives: Tetrahydrocarbazole

Olivia Oeltermann, Christian Brand, W. Leo Meerts, Jörg Tatchen, Michael Schmitt

Journal:

Journal of Molecular Structure

Year:

2011

Language:

english

File:

PDF, 1.37 MB

english, 2011

6

Electronic excitation spectra and singlet–triplet coupling in psoralen and its sulfur and selenium analogs

Jörg Tatchen, Martin Kleinschmidt, Christel M. Marian

Journal:

Journal of Photochemistry and Photobiology A: Chemistry

Year:

2004

Language:

english

File:

PDF, 254 KB

english, 2004

7

The photophysics of flavins: What makes the difference between gas phase and aqueous solution?

Susanne Salzmann, Jörg Tatchen, Christel M. Marian

Journal:

Journal of Photochemistry and Photobiology A: Chemistry

Year:

2008

Language:

english

File:

PDF, 1.57 MB

english, 2008

8

On the performance of approximate spin–orbit Hamiltonians in light conjugated molecules: the fine-structure splitting of HC6H+, NC5H+, and NC4N+

Jörg Tatchen, Christel Maria Marian

Journal:

Chemical Physics Letters

Year:

1999

Language:

english

File:

PDF, 130 KB

english, 1999

9

The photophysics of pyranthione: a theoretical investigation focussing on spin-forbidden transitions

Jörg Tatchen, Mirko Waletzke, Christel M. Marian, Stefan Grimme

Journal:

Chemical Physics

Year:

2001

Language:

english

File:

PDF, 238 KB

english, 2001

10

The photophysics of 7H-adenine: A quantum chemical investigation including spin–orbit effects

Christel M. Marian, Martin Kleinschmidt, Jörg Tatchen

Journal:

Chemical Physics

Year:

2008

Language:

english

File:

PDF, 591 KB

english, 2008

11

Excited states of thiophene: ring opening as deactivation mechanism

Salzmann, Susanne, Kleinschmidt, Martin, Tatchen, Jörg, Weinkauf, Rainer, Marian, Christel M.

Journal:

Physical Chemistry Chemical Physics

Year:

2008

Language:

english

File:

PDF, 1.01 MB

english, 2008

12

Quantum Chemical Investigation of the Electronic Spectra of the Keto, Enol, and Keto−Imine Tautomers of Cytosine

Tomić, Katarina, Tatchen, Jörg, Marian, Christel M.

Journal:

Journal of Physical Chemistry A

Year:

2005

Language:

english

File:

PDF, 235 KB

english, 2005

13

Ground and Electronically Excited Singlet-State Structures of 5-Fluoroindole Deduced from Rotationally Resolved Electronic Spectroscopy and ab Initio Theory

Christian Brand, Olivia Oeltermann, Martin Wilke, Prof. Dr. Jörg Tatchen, Prof. Dr. Michael Schmitt

Journal:

Year:

2012

Language:

english

File:

PDF, 956 KB

english, 2012

14

Tautomers and electronic states of jet-cooled 2-aminopurine investigated by double resonance spectroscopy and theory

Seefeld, Kai A., Plützer, Christian, Löwenich, Dennis, Häber, Thomas, Linder, Rolf, Kleinermanns, Karl, Tatchen, Jörg, Marian, Christel M.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 720 KB

english, 2005

15

Vibronic coupling in indole: I. Theoretical description of the 1La–1Lb interaction and the electronic spectrum

Brand, Christian, Küpper, Jochen, Pratt, David W., Leo Meerts, W., Krügler, Daniel, Tatchen, Jörg, Schmitt, Michael

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.44 MB

english, 2010

16

The structure of 5-cyanoindole in the ground and the lowest electronically excited singlet states, deduced from rotationally resolved electronic spectroscopy and ab initio theory

Oeltermann, Olivia, Brand, Christian, Engels, Bernd, Tatchen, Jörg, Schmitt, Michael

Journal:

Physical Chemistry Chemical Physics

Year:

2012

Language:

english

File:

PDF, 1.45 MB

english, 2012

17

Intersystem crossing driven by vibronic spin–orbit coupling: a case study on psoralen

Tatchen, Jörg, Gilka, Natalie, Marian, Christel M.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 818 KB

english, 2007

18

Vibronic coupling in indole: II. Investigation of the 1La–1Lb interaction using rotationally resolved electronic spectroscopy

Küpper, Jochen, Pratt, David W., Leo Meerts, W., Brand, Christian, Tatchen, Jörg, Schmitt, Michael

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 853 KB

english, 2010

19

Photophysical and quantum chemical study on a J-aggregate forming perylene bisimide monomer

Ambrosek, David, Marciniak, Henning, Lochbrunner, Stefan, Tatchen, Jörg, Li, Xue-Qing, Würthner, Frank, Kühn, Oliver

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 2.09 MB

english, 2011

20

Rainbow scattering of argon from

Pollak, Eli, Tatchen, Jörg

Journal:

Physical Review B

Year:

2009

Language:

english

File:

PDF, 247 KB

english, 2009

21

[Phys. Rev. B 80 , 115404 (2009)]

Pollak, Eli, Tatchen, Jörg

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 26 KB

english, 2010

22

Ultrafast Deactivation Mechanism of the Excited Singlet in the Light-Induced Spin Crossover of [Fe(2,2′-bipyridine) 3 ] 2+

Sousa, Carmen, de Graaf, Coen, Rudavskyi, Andrii, Broer, Ria, Tatchen, Jörg, Etinski, Mihajlo, Marian, Christel M.

Journal:

Chemistry - A European Journal

Year:

2013

Language:

english

File:

PDF, 485 KB

english, 2013

23

Three-component one-pot synthesis of novel pyrido[2,3- d ]pyrimidine indole substituted derivatives and DFT analysis

Rangel, Jovanni, Díaz-Uribe, Carlos, Rodriguez-Serrano, Angela, Zarate, Ximena, Serge, York, Vallejo, William, Nogueras, Manuel, Trilleras, Jorge, Quiroga, Jairo, Tatchen, Jörg, Cobo, Justo

Journal:

Journal of Molecular Structure

Year:

2017

Language:

english

File:

PDF, 2.11 MB

english, 2017

24

Protonation-State-Driven Photophysics in Phenothiazinium Dyes: Intersystem Crossing and Singlet-Oxygen Production

Rodriguez-Serrano, Angela, Daza, Martha C., Doerr, Markus, Tatchen, Jörg, Marian, Christel M.

Journal:

Year:

2017

Language:

english

File:

PDF, 1.81 MB

english, 2017

25

Evolution of the Optical Gap in the Acene Series: Undecacene

Shen, Bin, Tatchen, Jörg, Sanchez Garcia, Elsa, Bettinger, Holger

Journal:

Angewandte Chemie International Edition

Year:

2018

Language:

english

File:

PDF, 1.12 MB

english, 2018

26

Evolution of the Optical Gap in the Acene Series: Undecacene

Shen, Bin, Tatchen, Jörg, Sanchez Garcia, Elsa, Bettinger, Holger

Journal:

Angewandte Chemie

Year:

2018

Language:

english

File:

PDF, 1.12 MB

english, 2018

27

DFT/MRCI assessment of the excited‐state interplay in a coumarin‐schiff Mg 2+ fluorescent sensor

Zarate, Ximena, Rodriguez‐Serrano, Angela, Schott, Eduardo, Tatchen, Jörg

Journal:

Journal of Computational Chemistry

Year:

2019

File:

PDF, 2.25 MB

2019