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36 Publications


2024 | Journal Article | LibreCat-ID: 51221
Dong, C.-D., Bauch, F., Hu, Y., & Schumacher, S. (2024). Charge transfer in superbase n-type doping of PCBM induced by deprotonation. Physical Chemistry Chemical Physics, 26(5), 4194–4199. https://doi.org/10.1039/d3cp05105f
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2023 | Journal Article | LibreCat-ID: 48639
Kamer, J., Schleier, D., Donker, M., Hemberger, P., Bodi, A., & Bouwman, J. (2023). Threshold photoelectron spectroscopy and dissociative photoionization of benzonitrile. Physical Chemistry Chemical Physics, 25(42), 29070–29079. https://doi.org/10.1039/d3cp03977c
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2022 | Journal Article | LibreCat-ID: 44231
Schleier, D., Gerlach, M., Schaffner, D., Mukhopadhyay, D. P., Hemberger, P., & Fischer, I. (2022). Threshold photoelectron spectroscopy of trimethylborane and its pyrolysis products. Physical Chemistry Chemical Physics, 25(6), 4511–4518. https://doi.org/10.1039/d2cp04513c
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2021 | Journal Article | LibreCat-ID: 30208
Do, H. T., Franke, P., Volpert, S., Klinksiek, M., Thome, M., & Held, C. (2021). Measurement and modelling solubility of amino acids and peptides in aqueous 2-propanol solutions. Physical Chemistry Chemical Physics, 23(18), 10852–10863. https://doi.org/10.1039/d1cp00005e
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2021 | Journal Article | LibreCat-ID: 35326
Keil, W., Zhao, K., Oswald, A., Bremser, W., Schmidt, C., & Hintze-Bruening, H. (2021). Thermostable water reservoirs in the interlayer space of a sodium hectorite clay through the intercalation of γ-aminopropyl(dimethyl)ethoxysilane in toluene. Physical Chemistry Chemical Physics, 24(1), 477–487. https://doi.org/10.1039/d1cp03321b
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2021 | Journal Article | LibreCat-ID: 32240
Chatwell, R. S., Guevara-Carrion, G., Gaponenko, Y., Shevtsova, V., & Vrabec, J. (2021). Diffusion of the carbon dioxide–ethanol mixture in the extended critical region. Physical Chemistry Chemical Physics, 23(4), 3106–3115. https://doi.org/10.1039/d0cp04985a
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2020 | Journal Article | LibreCat-ID: 18850
Poeplau, M., Ester, S., Henning, B., & Wagner, T. (2020). Recombination mechanisms of luminescence type gas sensors. Physical Chemistry Chemical Physics. https://doi.org/10.1039/d0cp02269a
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2020 | Journal Article | LibreCat-ID: 32246
Mirhosseini, H., Kormath Madam Raghupathy, R., Sahoo, S. K., Wiebeler, H., Chugh, M., & Kühne, T. D. (2020). In silico investigation of Cu(In,Ga)Se2-based solar cells. Physical Chemistry Chemical Physics, 22(46), 26682–26701. https://doi.org/10.1039/d0cp04712k
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2020 | Journal Article | LibreCat-ID: 34301
Elgabarty, H., & Kühne, T. (2020). Tumbling with a limp: local asymmetry in water’s hydrogen bond network and its consequences. Physical Chemistry Chemical Physics, 22(19), 10397–10411. https://doi.org/10.1039/c9cp06960g
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2020 | Journal Article | LibreCat-ID: 17070
Navickas, M., Giriūnas, L., Kalendra, V., Biktagirov, T., Gerstmann, U., Schmidt, W. G., Mączka, M., Pöppl, A., Banys, J., & Šimėnas, M. (2020). Electron paramagnetic resonance study of ferroelectric phase transition and dynamic effects in a Mn2+ doped [NH4][Zn(HCOO)3] hybrid formate framework. Physical Chemistry Chemical Physics, 22, 8513–8521. https://doi.org/10.1039/d0cp01612h
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2019 | Journal Article | LibreCat-ID: 32486
Stodt, M. F. B., Gonchikzhapov, M., Kasper, T., Fritsching, U., & Kiefer, J. (2019). Chemistry of iron nitrate-based precursor solutions for spray-flame synthesis. Physical Chemistry Chemical Physics, 21(44), 24793–24801. https://doi.org/10.1039/c9cp05007h
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2018 | Journal Article | LibreCat-ID: 13407
Naumova, M., Khakhulin, D., Rebarz, M., Rohrmüller, M., Dicke, B., Biednov, M., … Rübhausen, M. (2018). Structural dynamics upon photoexcitation-induced charge transfer in a dicopper(i)–disulfide complex. Physical Chemistry Chemical Physics, 6274–6286. https://doi.org/10.1039/c7cp04880g
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2017 | Journal Article | LibreCat-ID: 34304
Scarbath-Evers, L. K., Jähnigen, S., Elgabarty, H., Song, C., Narikawa, R., Matysik, J., & Sebastiani, D. (2017). Structural heterogeneity in a parent ground-state structure of AnPixJg2 revealed by theory and spectroscopy. Physical Chemistry Chemical Physics, 19(21), 13882–13894. https://doi.org/10.1039/c7cp01218g
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2017 | Journal Article | LibreCat-ID: 25916
Klawinski, D., Weinberger, C., Klaus, D., Smått, J.-H., Tiemann, M., & Wagner, T. (2017). Kinetics of ozone decomposition in porous In2O3 monoliths. Physical Chemistry Chemical Physics, 10326–10332. https://doi.org/10.1039/c6cp08874k
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2017 | Journal Article | LibreCat-ID: 22560
Wiesing, M., de los Arcos de Pedro, M. T., Gebhard, M., Devi, A., & Grundmeier, G. (2017). Analysis of dispersive interactions at polymer/TiAlN interfaces by means of dynamic force spectroscopy. Physical Chemistry Chemical Physics, 180–190. https://doi.org/10.1039/c7cp05373h
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2017 | Journal Article | LibreCat-ID: 40587
Posada, E., Lopez Salas, N., Jiménez Riobóo, R. J., Ferrer, M. L., Gutiérrez, M. C., & del Monte, F. (2017). Reline aqueous solutions behaving as liquid mixtures of H-bonded co-solvents: microphase segregation and formation of co-continuous structures as indicated by Brillouin and 1H NMR spectroscopies. Physical Chemistry Chemical Physics, 19(26), 17103–17110. https://doi.org/10.1039/c7cp02180a
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2016 | Journal Article | LibreCat-ID: 13459
Paulheim, A., Marquardt, C., Sokolowski, M., Hochheim, M., Bredow, T., Aldahhak, H., … Schmidt, W. G. (2016). Surface induced vibrational modes in the fluorescence spectra of PTCDA adsorbed on the KCl(100) and NaCl(100) surfaces. Physical Chemistry Chemical Physics, 18, 32891–32902. https://doi.org/10.1039/c6cp05661j
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2016 | Journal Article | LibreCat-ID: 13815
Paulheim, A., Marquardt, C., Sokolowski, M., Hochheim, M., Bredow, T., Aldahhak, H., … Schmidt, W. G. (2016). Surface induced vibrational modes in the fluorescence spectra of PTCDA adsorbed on the KCl(100) and NaCl(100) surfaces. Physical Chemistry Chemical Physics, 18, 32891–32902. https://doi.org/10.1039/c6cp05661j
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2015 | Journal Article | LibreCat-ID: 13503
Aldahhak, H., Matencio, S., Barrena, E., Ocal, C., Schmidt, W. G., & Rauls, E. (2015). Structure formation in diindenoperylene thin films on copper(111). Physical Chemistry Chemical Physics, 17, 8776–8783. https://doi.org/10.1039/c4cp05271d
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2015 | Journal Article | LibreCat-ID: 13505
Aldahhak, H., Matencio, S., Barrena, E., Ocal, C., Schmidt, W. G., & Rauls, E. (2015). Structure formation in diindenoperylene thin films on copper(111). Physical Chemistry Chemical Physics, 17, 8776–8783. https://doi.org/10.1039/c4cp05271d
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2015 | Journal Article | LibreCat-ID: 34307
Spura, T., Elgabarty, H., & Kühne, T. (2015). “On-the-fly” coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer. Physical Chemistry Chemical Physics, 17(22), 14355–14359. https://doi.org/10.1039/c4cp05192k
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2015 | Journal Article | LibreCat-ID: 41060
Atkins, A. J., Bauer, M., & Jacob, C. R. (2015). High-resolution X-ray absorption spectroscopy of iron carbonyl complexes. Physical Chemistry Chemical Physics, 17(21), 13937–13948. https://doi.org/10.1039/c5cp01045d
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2015 | Journal Article | LibreCat-ID: 25940 | OA
Weiss, A., Reimer, N., Stock, N., Tiemann, M., & Wagner, T. (2015). Surface-modified CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water uptake. Physical Chemistry Chemical Physics, 21634–21642. https://doi.org/10.1039/c5cp01988e
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2014 | Journal Article | LibreCat-ID: 7485
Wiebeler, C., Bader, C. A., Meier, C., & Schumacher, S. (2014). Optical spectrum, perceived color, refractive index, and non-adiabatic dynamics of the photochromic diarylethene CMTE. Phys. Chem. Chem. Phys., 16(28), 14531–14538. https://doi.org/10.1039/c3cp55490b
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2014 | Journal Article | LibreCat-ID: 34311
Watermann, T., Elgabarty, H., & Sebastiani, D. (2014). Phycocyanobilin in solution – a solvent triggered molecular switch. Phys. Chem. Chem. Phys., 16(13), 6146–6152. https://doi.org/10.1039/c3cp54307b
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2014 | Journal Article | LibreCat-ID: 41225
Bauer, M. (2014). HERFD-XAS and valence-to-core-XES: new tools to push the limits in research with hard X-rays? Phys. Chem. Chem. Phys., 16(27), 13827–13837. https://doi.org/10.1039/c4cp00904e
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2013 | Journal Article | LibreCat-ID: 34312
Elgabarty, H., Wolff, M., Glaubitz, A., Hinderberger, D., & Sebastiani, D. (2013). First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. Physical Chemistry Chemical Physics, 15(38), Article 16082. https://doi.org/10.1039/c3cp51938d
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2013 | Journal Article | LibreCat-ID: 41235
Atkins, A. J., Bauer, M., & Jacob, C. R. (2013). The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes. Physical Chemistry Chemical Physics, 15(21), Article 8095. https://doi.org/10.1039/c3cp50999k
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2012 | Journal Article | LibreCat-ID: 15872
Montgomery, N. A., Hedley, G. J., Ruseckas, A., Denis, J.-C., Schumacher, S., Kanibolotsky, A. L., … Samuel, I. D. W. (2012). Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules. Physical Chemistry Chemical Physics. https://doi.org/10.1039/c2cp24141b
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2011 | Journal Article | LibreCat-ID: 41987
Hikov, T., Schröder, C. A., Cravillon, J., Wiebcke, M., & Huber, K. (2011). 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., 14(2), 511–521. https://doi.org/10.1039/c1cp22855b
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2011 | Journal Article | LibreCat-ID: 41991
Kunze, C., Valtiner, M., Michels, R., Huber, K., & Grundmeier, G. (2011). Self-localization of polyacrylic acid molecules on polar ZnO(0001)–Zn surfaces. Physical Chemistry Chemical Physics, 13(28), Article 12959. https://doi.org/10.1039/c1cp20913b
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2010 | Journal Article | LibreCat-ID: 41266
Bauer, M., & Gastl, C. (2010). X-Ray absorption in homogeneous catalysis research: the iron-catalyzed Michael addition reaction by XAS, RIXS and multi-dimensional spectroscopy. Physical Chemistry Chemical Physics, 12(21), Article 5575. https://doi.org/10.1039/b926385c
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2010 | Journal Article | LibreCat-ID: 41264
Ene, A. B., Bauer, M., Archipov, T., & Roduner, E. (2010). Adsorption of oxygen on copper in Cu/HZSM5 zeolites. Physical Chemistry Chemical Physics, 12(24), Article 6520. https://doi.org/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. (2008). Platinum species in the pores of NaX, NaY and NaA zeolites studied using EPR, XAS and FTIR spectroscopies. Physical Chemistry Chemical Physics, 10(20), Article 2952. https://doi.org/10.1039/b718932j
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2005 | Journal Article | LibreCat-ID: 41287
Bauer, M., Kauf, T., Christoffers, J., & Bertagnolli, H. (2005). Investigations into the metal species of the homogeneous iron(iii) catalyzed Michael addition reactions. Physical Chemistry Chemical Physics, 7(13), Article 2664. https://doi.org/10.1039/b501204j
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2002 | Journal Article | LibreCat-ID: 42040
Neumann, B., Huber, K., & Pollmann, P. (2002). 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, 2(16), 3687–3695. https://doi.org/10.1039/b004172f
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