Reinhold F. Fink: search on Z-Library

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1

Comparison of the periodic slab approach with the finite cluster description of metal-organic interfaces at the example of PTCDA on Ag(110)

Banerjee, Jaita, Behnle, Stefan, Galbraith, Martin C. E., Settels, Volker, Engels, Bernd, Tonner, Ralf, Fink, Reinhold F.

Journal:

Journal of Computational Chemistry

Year:

2018

Language:

english

File:

PDF, 636 KB

english, 2018

2

Return to sports after glenoid reconstruction using an implant-free iliac crest bone graft

Ortmaier, Reinhold, Fink, Christian, Schobersberger, Wolfgang, Kindermann, Harald, Mattiassich, Georg, Hochreiter, Josef, Plachel, Fabian, Mitterer, Marian, Resch, Herbert

Journal:

Orthopaedics & Traumatology: Surgery & Research

Year:

2019

Language:

english

File:

PDF, 1.29 MB

english, 2019

3

Molecular Origin of the Charge Carrier Mobility in Small Molecule Organic Semiconductors

Friederich, Pascal, Meded, Velimir, Poschlad, Angela, Neumann, Tobias, Rodin, Vadim, Stehr, Vera, Symalla, Franz, Danilov, Denis, Lüdemann, Gesa, Fink, Reinhold F., Kondov, Ivan, von Wrochem, Florian,

Journal:

Advanced Functional Materials

Year:

2016

Language:

english

File:

PDF, 1.25 MB

english, 2016

4

On the systematic improvement of fixed-node diffusion quantum Monte Carlo energies using pair natural orbital CI guide functions

Lüchow, Arne, Fink, Reinhold F.

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 305 KB

english, 2000

5

Return to Sports after Anterior Cruciate Ligament Injury: aÂ Matched-Pair Analysis of Repair with Internal Brace and Reconstruction Using Hamstring or Quadriceps Tendons

Ortmaier, Reinhold, Fink, Christian, Schobersberger, Wolfgang, Kindermann, Harald, Leister, Iris, Runer, Armin, Hepperger, Caroline, Blank, Cornelia, Mattiassich, Georg

Journal:

Sportverletzung · Sportschaden

Year:

2020

File:

PDF, 1.74 MB

2020

6

Atomistic Insights into the Inhibition of Cysteine Proteases: First QM/MM Calculations Clarifying the Stereoselectivity of Epoxide-Based Inhibitors

Mladenovic, Milena, Ansorg, Kay, Fink, Reinhold F., Thiel, Walter, Schirmeister, Tanja, Engels, Bernd

Journal:

Journal of Physical Chemistry B

Year:

2008

Language:

english

File:

PDF, 3.86 MB

english, 2008

7

Can Experimental Electron-Density Studies be Used as a Tool to Predict Biologically Relevant Properties of Low-Molecular Weight Enzyme Ligands?

Grabowsky, Simon, Jayatilaka, Dylan, Fink, Reinhold F., Schirmeister, Tanja, Engels, Bernd

Journal:

Zeitschrift für anorganische und allgemeine Chemie

Year:

2013

Language:

english

File:

PDF, 1.16 MB

english, 2013

8

Disentangling the complex line profiles in the Cl 2p photoelectron spectra of Cl2

Oksana Travnikova, Reinhold F. Fink, Antti Kivimäki, Denis Céolin, Zhuo Bao, Maria Novella Piancastelli

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 196 KB

english, 2006

9

Front Cover (Phys. Status Solidi B 4/2010)

Anatoly E. Patrakov, Reinhold F. Fink, Karin Fink, Thomas C. Schmidt, Bernd Engels

Journal:

physica status solidi (b)

Year:

2010

File:

PDF, 811 KB

2010

10

Influence of a polarizable surrounding on the electronically excited states of aggregated perylene materials

Bellinger, Daniel, Settels, Volker, Liu, Wenlan, Fink, Reinhold F., Engels, Bernd

Journal:

Journal of Computational Chemistry

Year:

2016

Language:

english

File:

PDF, 522 KB

english, 2016

11

Spin-component-scaled Mo̸ller–Plesset (SCS-MP) perturbation theory: A generalization of the MP approach with improved properties

Fink, Reinhold F.

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 543 KB

english, 2010

12

Why does MP2 work?

Fink, Reinhold F.

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 285 KB

english, 2016

13

Ultrafast Exciton Self-Trapping upon Geometry Deformation in Perylene-Based Molecular Aggregates

Schubert, Alexander, Settels, Volker, Liu, Wenlan, Würthner, Frank, Meier, Christoph, Fink, Reinhold F., Schindlbeck, Stefan, Lochbrunner, Stefan, Engels, Bernd, Engel, Volker

Journal:

The Journal of Physical Chemistry Letters

Year:

2013

Language:

english

File:

PDF, 1.49 MB

english, 2013

14

Exciton Trapping in π-Conjugated Materials: A Quantum-Chemistry-Based Protocol Applied to Perylene Bisimide Dye Aggregates

Fink, Reinhold F., Seibt, Joachim, Engel, Volker, Renz, Manuel, Kaupp, Martin, Lochbrunner, Stefan, Zhao, Hong-Mei, Pfister, Johannes, Würthner, Frank, Engels, Bernd

Journal:

Journal of the American Chemical Society

Year:

2008

Language:

english

File:

PDF, 542 KB

english, 2008

15

[IEEE 2009 IEEE/SP 15th Workshop on Statistical Signal Processing (SSP) - Cardiff, United Kingdom (2009.08.31-2009.09.3)] 2009 IEEE/SP 15th Workshop on Statistical Signal Processing - A hierarchical approach to unsupervised shape calibration of microphone array networks

Hennecke, Marius, Plotz, Thomas, Fink, Gernot A., Schmalenstroer, Jorg, Hab-Umbach, Reinhold

Year:

2009

Language:

english

File:

PDF, 116 KB

english, 2009

16

Isomerization and fragmentation pathways of 1,2-azaborine

Edel, Klara, Fink, Reinhold F., Bettinger, Holger F.

Journal:

Journal of Computational Chemistry

Year:

2016

Language:

english

File:

PDF, 474 KB

english, 2016

17

Effect of molecular packing on the exciton diffusion length in organic solar cells

Rim, Seung-Bum, Fink, Reinhold F., Schöneboom, Jan C., Erk, Peter, Peumans, Peter

Journal:

Applied Physics Letters

Year:

2007

Language:

english

File:

PDF, 474 KB

english, 2007

18

Comparison of the electronic structure of different perylene-based dye-aggregates

Volker Settels, Wenlan Liu, Jens Pflaum, Reinhold F. Fink, Bernd Engels

Journal:

Journal of Computational Chemistry

Year:

2012

Language:

english

File:

PDF, 1.26 MB

english, 2012

19

A general ansatz for constructing quasi-diabatic states in electronically excited aggregated systems

Liu, Wenlan, Lunkenheimer, Bernd, Settels, Volker, Engels, Bernd, Fink, Reinhold F., Köhn, Andreas

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 2.53 MB

english, 2015

20

Theory and ab initio calculations of 2p photoabsorption spectra: The lowest Rydberg resonances in HCl

Fink, Reinhold F., Kivilompolo, Mika, Aksela, Helena

Journal:

The Journal of Chemical Physics

Year:

1999

Language:

english

File:

PDF, 372 KB

english, 1999

21

The resonant Auger electron spectrum of C 1s[sup −1]π[sup ∗] excited ethene: A combined theoretical and experimental investigation

Fink, Reinhold F., Sorensen, Stacey L., de Brito, Arnaldo Naves, Ausmees, Andrus, Svensson, Svante

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 424 KB

english, 2000

22

ChemInform Abstract: From WCl 6 to WCl 2 : Properties of Intermediate Fe-W-Cl Phases.

Mos, Agnieszka, Castro, Cristina, Indris, Sylvio, Stroebele, Markus, Fink, Reinhold F., Meyer, Hans-Juergen

Journal:

Year:

2015

Language:

english

File:

PDF, 21 KB

english, 2015

23

A multi-configuration reference CEPA method based on pair natural orbitals

Reinhold Fink, Volker Staemmler

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1993

Language:

english

File:

PDF, 933 KB

english, 1993

24

Singlet Exciton Diffusion in Organic Crystals Based on Marcus Transfer Rates

Stehr, Vera, Fink, Reinhold F., Engels, Bernd, Pflaum, Jens, Deibel, Carsten

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 2.62 MB

english, 2014

25

A theoretical simulation of the 1s→2π excitation and deexcitation spectra of the NO molecule

Journal:

The Journal of Chemical Physics

Year:

1997

Language:

english

File:

PDF, 507 KB

english, 1997

26

Changes in heated and stored milk with an interpretation by reaction kinetics

HEINZ-GERHARD KESSLER, REINHOLD FINK

Journal:

Journal of Food Science

Year:

1986

Language:

english

File:

PDF, 862 KB

english, 1986

27

levels in

Bueno, André Machado, de Brito, Arnaldo Naves, Fink, Reinhold F., Bässler, Margit, Björneholm, Olle, Burmeister, Florian, Feifel, Raimund, Miron, Catalin, Sorensen, Stacey L., Wang, Honghong, Svensson

Journal:

Physical Review A

Year:

2003

Language:

english

File:

PDF, 116 KB

english, 2003

28

Paracyclophanes as model compounds for strongly interacting π-systems. Part 2: mono-hydroxy[2.2]paracyclophane

Schon, Christof, Roth, Wolfgang, Fischer, Ingo, Pfister, Johannes, Fink, Reinhold F., Engels, Bernd

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 1.64 MB

english, 2011

29

Eine einfache Methode zur Synthese von binären Wolframiodiden

Ströbele, Markus, Castro, Cristina, Fink, Reinhold F., Meyer, H.-Jürgen

Journal:

Angewandte Chemie

Year:

2016

Language:

german

File:

PDF, 1.37 MB

german, 2016

30

Auger-electron spectra of HCl

Fink, Reinhold F., Kivilompolo, Mika, Aksela, Helena, Aksela, Seppo

Journal:

Physical Review A

Year:

1998

Language:

english

File:

PDF, 240 KB

english, 1998

31

Specific production of very long-lived core-excited sulfur atoms by 2p −1 σ* excitation of the OCS molecule followed by ultrafast dissociation

Fink, Reinhold F, Eschner, Annika, Magnuson, Martin, Björneholm, Olle, Hjelte, Ingela, Miron, Catalin, Bassler, Margit, Svensson, Svante, Piancastelli, Maria Novella, Sorensen, Stacey L

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

2006

Language:

english

File:

PDF, 254 KB

english, 2006

32

Density-functional study on the migration of Cd and Te adsorbates on the (001) surface of CdTe

Anatoly E. Patrakov, Reinhold F. Fink, Karin Fink, Thomas C. Schmidt, Bernd Engels

Journal:

physica status solidi (b)

Year:

2010

Language:

english

File:

PDF, 646 KB

english, 2010

33

On the Origin of the Stabilization of the Zwitterionic Resting State of Cysteine Proteases: A Theoretical Study

Mladenovic, Milena, Fink, Reinhold F., Thiel, Walter, Schirmeister, Tanja, Engels, Bernd

Journal:

Journal of the American Chemical Society

Year:

2008

Language:

english

File:

PDF, 2.67 MB

english, 2008

34

Dysbiosis, gut barrier dysfunction and inflammation in dementia: a pilot study

Stadlbauer, Vanessa, Engertsberger, Lara, Komarova, Irina, Feldbacher, Nicole, Leber, Bettina, Pichler, Gerald, Fink, Nicole, Scarpatetti, Monika, Schippinger, Walter, Schmidt, Reinhold, Horvath, Ange

Journal:

Year:

2020

File:

PDF, 2.65 MB

2020

35

Reaktionskinetische Beschreibung chemischer Veränderungen von bei verschiedenen Temperaturen gelagerter und erhitzter Milch

Prof. Dr.-Ing. Heinz-Gerhard Kessler, Dr.-Ing. Reinhold Fink

Journal:

Chemie Ingenieur Technik

Year:

1985

Language:

german

File:

PDF, 318 KB

german, 1985

36

Assessment of TD-DFT- and TD-HF-based approaches for the prediction of exciton coupling parameters, potential energy curves, and electronic characters of electronically excited aggregates

Wenlan Liu, Volker Settels, Philipp H. P. Harbach, Andreas Dreuw, Reinhold F. Fink, Bernd Engels

Journal:

Journal of Computational Chemistry

Year:

2011

Language:

english

File:

PDF, 1.83 MB

english, 2011

37

Structural and Spectroscopic Characterization of Tin–Tin Double Bonds in Cyclic Distannenes

Henning, Jens, Eichele, Klaus, Fink, Reinhold F., Wesemann, Lars

Journal:

Organometallics

Year:

2014

Language:

english

File:

PDF, 2.50 MB

english, 2014

38

ChemInform Abstract: A Facile Method for the Synthesis of Binary Tungsten Iodides.

Stroebele, Markus, Castro, Cristina, Fink, Reinhold F., Meyer, H.-Juergen

Journal:

Year:

2016

File:

PDF, 22 KB

2016

39

The photodissociation of FNO in the S1 state: Three-dimensional calculation on a new potential energy surface

Dobbyn, Abigail J., von Dirke, Michael, Schinke, Reinhard, Fink, Reinhold

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 438 KB

english, 1995

40

The gas phase L[sub 2,3]VV Auger electron spectra of chlorine in XCl (X=H, D, Li, Na, K) molecules

Kivilompolo, Mika, Kivimäki, Antti, Aksela, Helena, Huttula, Marko, Aksela, Seppo, Fink, Reinhold F.

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 428 KB

english, 2000

41

Energie- und Ladungstransport in molekularen Materialien

Stehr, Vera, Fink, Reinhold

Journal:

Nachrichten aus der Chemie

Year:

2016

Language:

german

File:

PDF, 5.08 MB

german, 2016

42

A model hamiltonian tuned toward high level ab initio calculations to describe the character of excitonic states in perylenebisimide aggregates

Liu, Wenlan, Canola, Sofia, Köhn, Andreas, Engels, Bernd, Negri, Fabrizia, Fink, Reinhold F.

Journal:

Journal of Computational Chemistry

Year:

2018

Language:

english

File:

PDF, 2.38 MB

english, 2018

43

Assignment of the normal Auger decay spectrum of by ab initio calculations

Oksana Travnikova, Reinhold F. Fink, Antti Kivimäki, Denis Céolin, Zhuo Bao, Maria Novella Piancastelli

Journal:

Chemical Physics Letters

Year:

2009

Language:

english

File:

PDF, 578 KB

english, 2009

44

Origin of the Reactivity Differences of Substituted Aziridines: CN vs CC Bond Breakages

Paasche, Alexander, Arnone, Mario, Fink, Reinhold F., Schirmeister, Tanja, Engels, Bernd

Journal:

Journal of Organic Chemistry

Year:

2009

Language:

english

File:

PDF, 2.38 MB

english, 2009

45

[IEEE ICTs for improving Patients Rehabilitation Research Techniques - Venice, Italy (2013.05.05-2013.05.05)] Proceedings of the ICTs for improving Patients Rehabilitation Research Techniques - Personal Health Systems for Bipolar Disorder Anecdotes, Challenges and Lessons Learnt from MONARCA Project

Mayora, Oscar, Arnrich, Bert, Bardram, Jakob, Dräger, Carsten, Finke, Andrea, Frost, Mads, Giordano, Silvia, Gravenhorst, Franz, Grunerbl, Agnes, Haring, Christian, Haux, Reinhold, Lukowicz, Paul, Mua

Year:

2013

Language:

english

File:

PDF, 360 KB

english, 2013

46

REMP: A hybrid perturbation theory providing improved electronic wavefunctions and properties

Behnle, Stefan, Fink, Reinhold F.

Journal:

The Journal of Chemical Physics

Year:

2019

Language:

english

File:

PDF, 967 KB

english, 2019

47

The Cl(2p) photoelectron spectra of the HCl and DCl molecules: the effects of the molecular field

Kivilompolo, Mika, Kivimäki, Antti, Jurvansuu, Marko, Aksela, Helena, Aksela, Seppo, Fink, Reinhold F

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

2000

Language:

english

File:

PDF, 605 KB

english, 2000

48

SPIE Proceedings [SPIE International Symposium on Biomedical Optics Europe '94 - Lille, France (Tuesday 6 September 1994)] Biomedical Optoelectronic Devices and Systems II - Combined system for high-time-resolution dual-excitation fluorescence photometry and fluorescence imaging of calcium transients in single normal and diseased skeletal muscle fibers

Uttenweiler, Dietmar, Wojciechowski, Reinhold, Makabe, Makoto, Veigel, Claudia, Fink, Rainer H., Croitoru, Nathan I., Kroo, Norbert, Miyagi, Mitsunobu, Pratesi, Riccardo, Wolfrum, Juergen M.

Year:

1994

Language:

english

File:

PDF, 1011 KB

english, 1994

49

Assessment of quantum chemical methods and basis sets for excitation energy transfer

Reinhold F. Fink, Johannes Pfister, Hong Mei Zhao, Bernd Engels

Journal:

Chemical Physics

Year:

2008

Language:

english

File:

PDF, 625 KB

english, 2008

50

Understanding Ground- and Excited-State Properties of Perylene Tetracarboxylic Acid Bisimide Crystals by Means of Quantum Chemical Computations

Zhao, Hong-Mei, Pfister, Johannes, Settels, Volker, Renz, Manuel, Kaupp, Martin, Dehm, Volker C., Würthner, Frank, Fink, Reinhold F., Engels, Bernd

Journal:

Journal of the American Chemical Society

Year:

2009

Language:

english

File:

PDF, 1.99 MB

english, 2009

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