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36 Publications


2015 | Journal Article | LibreCat-ID: 34307
T. Spura, H. Elgabarty, and T. Kühne, “‘On-the-fly’ coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer,” Physical Chemistry Chemical Physics, vol. 17, no. 22, pp. 14355–14359, 2015, doi: 10.1039/c4cp05192k.
LibreCat | DOI
 

2015 | Journal Article | LibreCat-ID: 41060
A. J. Atkins, M. Bauer, and C. R. Jacob, “High-resolution X-ray absorption spectroscopy of iron carbonyl complexes,” Physical Chemistry Chemical Physics, vol. 17, no. 21, pp. 13937–13948, 2015, doi: 10.1039/c5cp01045d.
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2015 | Journal Article | LibreCat-ID: 25940 | OA
A. Weiss, N. Reimer, N. Stock, M. Tiemann, and T. Wagner, “Surface-modified CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water uptake,” Physical Chemistry Chemical Physics, pp. 21634–21642, 2015, doi: 10.1039/c5cp01988e.
LibreCat | DOI | Download (ext.)
 

2014 | Journal Article | LibreCat-ID: 7485
C. Wiebeler, C. A. Bader, C. Meier, and S. Schumacher, “Optical spectrum, perceived color, refractive index, and non-adiabatic dynamics of the photochromic diarylethene CMTE,” Phys. Chem. Chem. Phys., vol. 16, no. 28, pp. 14531–14538, 2014.
LibreCat | DOI
 

2014 | Journal Article | LibreCat-ID: 34311
T. Watermann, H. Elgabarty, and D. Sebastiani, “Phycocyanobilin in solution – a solvent triggered molecular switch,” Phys. Chem. Chem. Phys., vol. 16, no. 13, pp. 6146–6152, 2014, doi: 10.1039/c3cp54307b.
LibreCat | DOI
 

2014 | Journal Article | LibreCat-ID: 41225
M. Bauer, “HERFD-XAS and valence-to-core-XES: new tools to push the limits in research with hard X-rays?,” Phys. Chem. Chem. Phys., vol. 16, no. 27, pp. 13827–13837, 2014, doi: 10.1039/c4cp00904e.
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2013 | Journal Article | LibreCat-ID: 34312
H. Elgabarty, M. Wolff, A. Glaubitz, D. Hinderberger, and D. Sebastiani, “First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy,” Physical Chemistry Chemical Physics, vol. 15, no. 38, Art. no. 16082, 2013, doi: 10.1039/c3cp51938d.
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2013 | Journal Article | LibreCat-ID: 41235
A. J. Atkins, M. Bauer, and C. R. Jacob, “The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes,” Physical Chemistry Chemical Physics, vol. 15, no. 21, Art. no. 8095, 2013, doi: 10.1039/c3cp50999k.
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2012 | Journal Article | LibreCat-ID: 15872
N. A. Montgomery et al., “Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules,” Physical Chemistry Chemical Physics, 2012.
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2011 | Journal Article | LibreCat-ID: 41987
T. Hikov, C. A. Schröder, J. Cravillon, M. Wiebcke, and K. Huber, “In situ static and dynamic light scattering and scanning electron microscopy study on the crystallization of the dense zinc imidazolate framework ZIF-zni,” Phys. Chem. Chem. Phys., vol. 14, no. 2, pp. 511–521, 2011, doi: 10.1039/c1cp22855b.
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2011 | Journal Article | LibreCat-ID: 41991
C. Kunze, M. Valtiner, R. Michels, K. Huber, and G. Grundmeier, “Self-localization of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces,” Physical Chemistry Chemical Physics, vol. 13, no. 28, Art. no. 12959, 2011, doi: 10.1039/c1cp20913b.
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2010 | Journal Article | LibreCat-ID: 41266
M. Bauer and C. Gastl, “X-Ray absorption in homogeneous catalysis research: the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional spectroscopy,” Physical Chemistry Chemical Physics, vol. 12, no. 21, Art. no. 5575, 2010, doi: 10.1039/b926385c.
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2010 | Journal Article | LibreCat-ID: 41264
A. B. Ene, M. Bauer, T. Archipov, and E. Roduner, “Adsorption of oxygen on copper in Cu/HZSM5 zeolites,” Physical Chemistry Chemical Physics, vol. 12, no. 24, Art. no. 6520, 2010, doi: 10.1039/c000750a.
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2008 | Journal Article | LibreCat-ID: 41278
Y. Akdogan, C. Vogt, M. Bauer, H. Bertagnolli, L. Giurgiu, and E. Roduner, “Platinum species in the pores of NaX, NaY and NaA zeolites studied using EPR, XAS and FTIR spectroscopies,” Physical Chemistry Chemical Physics, vol. 10, no. 20, Art. no. 2952, 2008, doi: 10.1039/b718932j.
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2005 | Journal Article | LibreCat-ID: 41287
M. Bauer, T. Kauf, J. Christoffers, and H. Bertagnolli, “Investigations into the metal species of the homogeneous iron(iii) catalyzed Michael addition reactions,” Physical Chemistry Chemical Physics, vol. 7, no. 13, Art. no. 2664, 2005, doi: 10.1039/b501204j.
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2002 | Journal Article | LibreCat-ID: 42040
B. Neumann, K. Huber, and P. Pollmann, “A comparative experimental study of the aggregation of Acid Red 266 in aqueous solution by use of 19F-NMR, UV/Vis spectroscopy and static light scattering,” Physical Chemistry Chemical Physics, vol. 2, no. 16, pp. 3687–3695, 2002, doi: 10.1039/b004172f.
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