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36 Publications
2015 | Journal Article | LibreCat-ID: 34307
Spura T, Elgabarty H, Kühne T. “On-the-fly” coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer. Physical Chemistry Chemical Physics. 2015;17(22):14355-14359. doi:10.1039/c4cp05192k
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2015 | Journal Article | LibreCat-ID: 41060
Atkins AJ, Bauer M, Jacob CR. High-resolution X-ray absorption spectroscopy of iron carbonyl complexes. Physical Chemistry Chemical Physics. 2015;17(21):13937-13948. doi:10.1039/c5cp01045d
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2015 | Journal Article | LibreCat-ID: 25940 | 
Weiss A, Reimer N, Stock N, Tiemann M, Wagner T. Surface-modified CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water uptake. Physical Chemistry Chemical Physics. Published online 2015:21634-21642. doi:10.1039/c5cp01988e
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2014 | Journal Article | LibreCat-ID: 7485
Wiebeler C, Bader CA, Meier C, Schumacher S. Optical spectrum, perceived color, refractive index, and non-adiabatic dynamics of the photochromic diarylethene CMTE. Phys Chem Chem Phys. 2014;16(28):14531-14538. doi:10.1039/c3cp55490b
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2014 | Journal Article | LibreCat-ID: 34311
Watermann T, Elgabarty H, Sebastiani D. Phycocyanobilin in solution – a solvent triggered molecular switch. Phys Chem Chem Phys. 2014;16(13):6146-6152. doi:10.1039/c3cp54307b
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2014 | Journal Article | LibreCat-ID: 41225
Bauer M. HERFD-XAS and valence-to-core-XES: new tools to push the limits in research with hard X-rays? Phys Chem Chem Phys. 2014;16(27):13827-13837. doi:10.1039/c4cp00904e
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2013 | Journal Article | LibreCat-ID: 34312
Elgabarty H, Wolff M, Glaubitz A, Hinderberger D, Sebastiani D. First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. Physical Chemistry Chemical Physics. 2013;15(38). doi:10.1039/c3cp51938d
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2013 | Journal Article | LibreCat-ID: 41235
Atkins AJ, Bauer M, Jacob CR. The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes. Physical Chemistry Chemical Physics. 2013;15(21). doi:10.1039/c3cp50999k
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2012 | Journal Article | LibreCat-ID: 15872
Montgomery NA, Hedley GJ, Ruseckas A, et al. Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules. Physical Chemistry Chemical Physics. 2012. doi:10.1039/c2cp24141b
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2011 | Journal Article | LibreCat-ID: 41987
Hikov T, Schröder CA, Cravillon J, Wiebcke M, Huber K. 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. 2011;14(2):511-521. doi:10.1039/c1cp22855b
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2011 | Journal Article | LibreCat-ID: 41991
Kunze C, Valtiner M, Michels R, Huber K, Grundmeier G. Self-localization of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces. Physical Chemistry Chemical Physics. 2011;13(28). doi:10.1039/c1cp20913b
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2010 | Journal Article | LibreCat-ID: 41266
Bauer M, Gastl C. X-Ray absorption in homogeneous catalysis research: the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional spectroscopy. Physical Chemistry Chemical Physics. 2010;12(21). doi:10.1039/b926385c
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2010 | Journal Article | LibreCat-ID: 41264
Ene AB, Bauer M, Archipov T, Roduner E. Adsorption of oxygen on copper in Cu/HZSM5 zeolites. Physical Chemistry Chemical Physics. 2010;12(24). doi:10.1039/c000750a
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2008 | Journal Article | LibreCat-ID: 41278
Akdogan Y, Vogt C, Bauer M, Bertagnolli H, Giurgiu L, Roduner E. Platinum species in the pores of NaX, NaY and NaA zeolites studied using EPR, XAS and FTIR spectroscopies. Physical Chemistry Chemical Physics. 2008;10(20). doi:10.1039/b718932j
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2005 | Journal Article | LibreCat-ID: 41287
Bauer M, Kauf T, Christoffers J, Bertagnolli H. Investigations into the metal species of the homogeneous iron(iii) catalyzed Michael addition reactions. Physical Chemistry Chemical Physics. 2005;7(13). doi:10.1039/b501204j
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2002 | Journal Article | LibreCat-ID: 42040
Neumann B, Huber K, Pollmann P. 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. 2002;2(16):3687-3695. doi:10.1039/b004172f
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