@article{41826,
  author       = {{Schmidt, Nico and Keuker‐Baumann, Susanne and Meyer, Jörg and Huber, Klaus}},
  issn         = {{0887-6266}},
  journal      = {{Journal of Polymer Science Part B: Polymer Physics}},
  keywords     = {{Materials Chemistry, Polymers and Plastics, Physical and Theoretical Chemistry, Condensed Matter Physics}},
  number       = {{22}},
  pages        = {{1483--1495}},
  publisher    = {{Wiley}},
  title        = {{{Phase Transformation Behavior of Polylactide Probed by Small Angle Light Scattering and Calorimetry}}},
  doi          = {{10.1002/polb.24892}},
  volume       = {{57}},
  year         = {{2019}},
}

@article{41822,
  author       = {{Carl, Nico and Müller, Wenke and Schweins, Ralf and Huber, Klaus}},
  issn         = {{0743-7463}},
  journal      = {{Langmuir}},
  keywords     = {{Electrochemistry, Spectroscopy, Surfaces and Interfaces, Condensed Matter Physics, General Materials Science}},
  number       = {{1}},
  pages        = {{223--231}},
  publisher    = {{American Chemical Society (ACS)}},
  title        = {{{Controlling Self-Assembly with Light and Temperature}}},
  doi          = {{10.1021/acs.langmuir.9b03040}},
  volume       = {{36}},
  year         = {{2019}},
}

@article{41823,
  author       = {{Gomez, David and Huber, Klaus and Klumpp, Stefan}},
  issn         = {{1948-7185}},
  journal      = {{The Journal of Physical Chemistry Letters}},
  keywords     = {{General Materials Science, Physical and Theoretical Chemistry}},
  number       = {{24}},
  pages        = {{7650--7656}},
  publisher    = {{American Chemical Society (ACS)}},
  title        = {{{On Protein Folding in Crowded Conditions}}},
  doi          = {{10.1021/acs.jpclett.9b02642}},
  volume       = {{10}},
  year         = {{2019}},
}

@article{41827,
  abstract     = {{<p>Selective binding of Ca<sup>2+</sup> cations to block copolyelectrolytes with two anionic blocks yields well-defined micelles.</p>}},
  author       = {{Carl, Nico and Prévost, Sylvain and Schweins, Ralf and Huber, Klaus}},
  issn         = {{1744-683X}},
  journal      = {{Soft Matter}},
  keywords     = {{Condensed Matter Physics, General Chemistry}},
  number       = {{41}},
  pages        = {{8266--8271}},
  publisher    = {{Royal Society of Chemistry (RSC)}},
  title        = {{{Ion-selective binding as a new trigger for micellization of block copolyelectrolytes with two anionic blocks}}},
  doi          = {{10.1039/c9sm01138b}},
  volume       = {{15}},
  year         = {{2019}},
}

@article{41828,
  author       = {{Hämisch, Benjamin and Büngeler, Anne and Kielar, Charlotte and Keller, Adrian and Strube, Oliver and Huber, Klaus}},
  issn         = {{0743-7463}},
  journal      = {{Langmuir}},
  keywords     = {{Electrochemistry, Spectroscopy, Surfaces and Interfaces, Condensed Matter Physics, General Materials Science}},
  number       = {{37}},
  pages        = {{12113--12122}},
  publisher    = {{American Chemical Society (ACS)}},
  title        = {{{Self-Assembly of Fibrinogen in Aqueous, Thrombin-Free Solutions of Variable Ionic Strengths}}},
  doi          = {{10.1021/acs.langmuir.9b01515}},
  volume       = {{35}},
  year         = {{2019}},
}

@article{25907,
  abstract     = {{<jats:p>The combined benefits of moisture-stable phosphonic acids and mesoporous silica materials (SBA-15 and MCM-41) as large-surface-area solid supports offer new opportunities for several applications, such as catalysis or drug delivery. We present a comprehensive study of a straightforward synthesis method via direct immobilization of several phosphonic acids and phosphoric acid esters on various mesoporous silicas in a Dean–Stark apparatus with toluene as the solvent. Due to the utilization of azeotropic distillation, there was no need to dry phosphonic acids, phosphoric acid esters, solvents, or silicas prior to synthesis. In addition to modeling phosphonic acids, immobilization of the important biomolecule adenosine monophosphate (AMP) on the porous supports was also investigated. Due to the high surface area of the mesoporous silicas, a possible catalytic application based on immobilization of an organocatalyst for an asymmetric aldol reaction is discussed.</jats:p>}},
  author       = {{Weinberger, Christian and Heckel, Tatjana and Schnippering, Patrick and Schmitz, Markus and Guo, Anpeng and Keil, Waldemar and Marsmann, Heinrich C. and Schmidt, Claudia and Tiemann, Michael and Wilhelm, René}},
  issn         = {{2079-4991}},
  journal      = {{Nanomaterials}},
  title        = {{{Straightforward Immobilization of Phosphonic Acids and Phosphoric Acid Esters on Mesoporous Silica and Their Application in an Asymmetric Aldol Reaction}}},
  doi          = {{10.3390/nano9020249}},
  year         = {{2019}},
}

@article{25904,
  abstract     = {{We examined the effect of CaCl2 and LiCl on ice melting in mesoporous silica (MCM-41 and SBA-15 silica). For that purpose, we determined the ice melting temperature in pores of various size (pore radii between 1.9 and 11.1 nm) in water and aqueous solutions up to high total solute molality (up to about 12 mol kg–1) using differential scanning calorimetry. We found that both electrolytes reduce the ice melting temperature within the pores. An exception is the melting of ice in the smallest pores, which does not seem to be affected by the presence of solutes, most likely owing to an exclusion of the ions from entering the pores. For all other pores, we observed that the ice melting temperature decreases as a function of pore size and electrolyte concentration. Using thermodynamic considerations as well as additional experimental data we developed a parametrization that can be used to predict the ice melting point as a function of pore size and total solute molality. For that purpose, we extended a formulation of the effective water activity of aqueous solutions under mechanical pressure toward its application in confinement and tested this new parametrization on literature data.}},
  author       = {{Jantsch, Evelyn and Weinberger, Christian and Tiemann, Michael and Koop, Thomas}},
  issn         = {{1932-7447}},
  journal      = {{The Journal of Physical Chemistry C}},
  pages        = {{24566--24574}},
  title        = {{{Phase Transitions of Ice in Aqueous Salt Solutions within Nanometer-Sized Pores}}},
  doi          = {{10.1021/acs.jpcc.9b06527}},
  year         = {{2019}},
}

@article{25905,
  abstract     = {{A nanocomposite material based on copper(II) oxide (CuO) and its utilization as a highly selective and stable gas-responsive electrical switch for hydrogen sulphide (H2S) detection is presented. The material can be applied as a sensitive layer for H2S monitoring, e.g., in biogas gas plants. CuO nanoparticles are embedded in a rigid, nanoporous silica (SiO2) matrix to form an electrical percolating network of low conducting CuO and, upon exposure to H2S, highly conducting copper(II) sulphide (CuS) particles. By steric hindrance due to the silica pore walls, the structure of the network is maintained even though the reversible reaction of CuO to CuS is accompanied by significant volume expansion. The conducting state of the percolating network can be controlled by a variety of parameters, such as temperature, electrode layout, and network topology of the porous silica matrix. The latter means that this new type of sensing material has a structure-encoded detection limit for H2S, which offers new application opportunities. The fabrication process of the mesoporous CuO@SiO2 composite as well as the sensor design and characteristics are described in detail. In addition, theoretical modeling of the percolation effect by Monte-Carlo simulations yields deeper insight into the underlying percolation mechanism and the observed response characteristics.}},
  author       = {{Paul, Andrej and Schwind, Bertram and Weinberger, Christian and Tiemann, Michael and Wagner, Thorsten}},
  issn         = {{1616-301X}},
  journal      = {{Advanced Functional Materials}},
  title        = {{{Gas Responsive Nanoswitch: Copper Oxide Composite for Highly Selective H2S Detection}}},
  doi          = {{10.1002/adfm.201904505}},
  year         = {{2019}},
}

@article{25908,
  abstract     = {{Herein we present a new proton-conducting iron(II) metal–organic framework (MOF) of an unusual structure formed by chains of alternating bistriazolate-p-benzoquinone anions and iron(II) cations with four axially coordinated water molecules. These chains assemble via π–π stacking between the aromatic units to form a three-dimensional grid-like network with channel pores filled with water molecules. The material was structurally characterized by single-crystal XRD analysis, and its water and thermal stability was investigated. The proton conductivity was studied by impedance measurements on needle-like single crystals. A simple but efficient measurement setup consisting of interdigital electrodes was used. The influence of the crystal orientation, temperature, and humidity was investigated. The iron(II)-MOF showed the highest proton conductivity of 3.3·10–3 S cm–1 at 22 °C and 94% relative humidity. Contrary to most known structures, the conductivity in this material is controlled by chemical properties of the pore system rather than by grain boundaries. The presented material is the starting point for further tailoring the proton-conducting properties, independent of morphological features which could find potential applications as membrane materials in proton-exchange membrane fuel cells.}},
  author       = {{Bunzen, Hana and Javed, Ali and Klawinski, Danielle and Lamp, Anton and Grzywa, Maciej and Kalytta-Mewes, Andreas and Tiemann, Michael and von Nidda, Hans-Albrecht Krug and Wagner, Thorsten and Volkmer, Dirk}},
  issn         = {{2574-0970}},
  journal      = {{ACS Applied Nano Materials}},
  pages        = {{291--298}},
  title        = {{{Anisotropic Water-Mediated Proton Conductivity in Large Iron(II) Metal–Organic Framework Single Crystals for Proton-Exchange Membrane Fuel Cells}}},
  doi          = {{10.1021/acsanm.8b01902}},
  year         = {{2019}},
}

@article{25906,
  abstract     = {{A composite material of copper oxide (CuO) dispersed in the nanopores of KIT-6 silica (SiO2) is used as a dosimetric sensor for the detection of hydrogen sulfide (H2S) gas in low parts per milion concentrations. The sensor principle is based on the reversible chemical conversion of CuO to CuS, which guarantees a high selectivity, and on the corresponding percolation-induced change in electronic conductance.}},
  author       = {{Paul, Andrej and Weinberger, Christian and Tiemann, Michael and Wagner, Thorsten}},
  issn         = {{2574-0970}},
  journal      = {{ACS Applied Nano Materials}},
  pages        = {{3335--3338}},
  title        = {{{Copper Oxide/Silica Nanocomposites for Selective and Stable H2S Gas Detection}}},
  doi          = {{10.1021/acsanm.9b01004}},
  year         = {{2019}},
}

@inproceedings{25641,
  abstract     = {{Langzeitfestigkeit von Schweißungen aus PP unter Berücksichtigung der Morphologie}},
  author       = {{Schöppner, Volker and Wübbeke, Andrea and Paul, Andre and Tiemann, Michael and Fitze, F. and Austermeier, Laura and Chen, M. and Jakob, F. and Heim, H.-P. and Wu, T. and Niendorf, T. and Röhricht, M-L. and Schmidt, M.}},
  booktitle    = {{Werkstoffwoche (2019)}},
  location     = {{Dresden (Deutschland)}},
  title        = {{{Langzeitfestigkeit von Schweißungen aus PP unter Berücksichtigung der Morphologie}}},
  year         = {{2019}},
}

@article{44992,
  author       = {{Brehm, Martin and Thomas, M.}},
  journal      = {{J. Chem. Theory Comput.}},
  pages        = {{3901--3905}},
  title        = {{{Computing Bulk Phase Resonance Raman Spectra from ab initio Molecular Dynamics and Real-Time TDDFT}}},
  doi          = {{10.1021/acs.jctc.9b00512}},
  volume       = {{15 (7)}},
  year         = {{2019}},
}

@article{44991,
  author       = {{Brehm, Martin and Pulst, M. and Kressler, J. and Sebastiani, D.}},
  journal      = {{J. Phys. Chem. B}},
  pages        = {{3994--4003}},
  title        = {{{Triazolium-Based Ionic Liquids – A Novel Class of Cellulose Solvents}}},
  doi          = {{10.1021/acs.jpcb.8b12082}},
  volume       = {{123 (18)}},
  year         = {{2019}},
}

@book{16795,
  author       = {{Striewe, Jan André and Tröster, Thomas and Kowatz, Jannik and Meschut, Gerson and Grothe, Richard and Grundmeier, Guido}},
  publisher    = {{Europäische Forschungsgesellschaft für Blechverarbeitung}},
  title        = {{{Analyse und Optimierung des Korrosions- und Alterungsverhaltens von hybriden Strukturen aus Metallen und CFK}}},
  year         = {{2019}},
}

@inproceedings{16028,
  author       = {{Grothe, R. and Striewe, Jan André and Kowatz, Jannik and Grundmeier, Guido and Tröster, Thomas and Meschut, Gerson}},
  location     = {{Bad Boll }},
  title        = {{{Analyse und Optimierung des Korrosions- und Alterungsverhaltens von hybriden Strukturen aus Metallen und CFK}}},
  year         = {{2019}},
}

@article{22541,
  abstract     = {{Monodisperse micron-sized silica particle monolayers deposited onto plasma-grown SiOx-ultra-thin films have been used as reference systems to investigate wetting, water adsorption and capillary bridge formation as a function of silica surface functionalization. 1H,1H, 2H,2H perfluorooctyltriethoxysil (FOTS) monolayers, have been deposited on the respective surfaces by means of chemical vapor deposition resulting in macroscopically low energy surfaces. X-ray photoelectron spectroscopy (XPS) and Fourier transform infrared (FTIR) reflection absorption spectroscopy confirmed the monolayer formation. Water adsorption isotherms were studied by a combination of in-situ FTIR reflection spectroscopy and quartz crystal microbalance (QCM) while macroscopic wetting was analysed by contact angle measurements. The comparative data evaluation indicates that the macroscopic wetting behaviour was changed as expected, however, that water nanodroplets formed both at intrinsic defects of the FOTS monolayer and at the FOTS/SiOx interface. Capillary bridges of liquid water are dominantly formed in the confined particle contact areas and between surface asperities on the particles. The comparison of wetting, adsorption and capillary bridge formation shows that the hydrophobization of porous materials by organosilane monolayers leads to the formation of morphology dependent nanoscopic defects that act as sites for preferential capillary bridge formation.}},
  author       = {{Giner, Ignacio and Torun, Boray and Han, Yan and Duderija, Belma and Meinderink, Dennis and Orive, Alejandro González and de los Arcos de Pedro, Maria Teresa and Weinberger, Christian and Tiemann, Michael and Schmid, Hans-Joachim and Grundmeier, Guido}},
  issn         = {{0169-4332}},
  journal      = {{Applied Surface Science}},
  pages        = {{873--879}},
  title        = {{{Water adsorption and capillary bridge formation on silica micro-particle layers modified with perfluorinated organosilane monolayers}}},
  doi          = {{10.1016/j.apsusc.2018.12.221}},
  year         = {{2019}},
}

@article{16312,
  author       = {{Steube, Jakob and Burkhardt, Lukas and Päpcke, Ayla and Moll, Johannes and Zimmer, Peter and Schoch, Roland and Wölper, Christoph and Heinze, Katja and Lochbrunner, Stefan and Bauer, Matthias}},
  issn         = {{0947-6539}},
  journal      = {{Chemistry – A European Journal}},
  pages        = {{11826--11830}},
  title        = {{{Excited‐State Kinetics of an Air‐Stable Cyclometalated Iron(II) Complex}}},
  doi          = {{10.1002/chem.201902488}},
  year         = {{2019}},
}

@article{21,
  abstract     = {{We address the general mathematical problem of computing the inverse p-th
root of a given matrix in an efficient way. A new method to construct iteration
functions that allow calculating arbitrary p-th roots and their inverses of
symmetric positive definite matrices is presented. We show that the order of
convergence is at least quadratic and that adaptively adjusting a parameter q
always leads to an even faster convergence. In this way, a better performance
than with previously known iteration schemes is achieved. The efficiency of the
iterative functions is demonstrated for various matrices with different
densities, condition numbers and spectral radii.}},
  author       = {{Richters, Dorothee and Lass, Michael and Walther, Andrea and Plessl, Christian and Kühne, Thomas}},
  journal      = {{Communications in Computational Physics}},
  number       = {{2}},
  pages        = {{564--585}},
  publisher    = {{Global Science Press}},
  title        = {{{A General Algorithm to Calculate the Inverse Principal p-th Root of Symmetric Positive Definite Matrices}}},
  doi          = {{10.4208/cicp.OA-2018-0053}},
  volume       = {{25}},
  year         = {{2019}},
}

@article{15739,
  author       = {{Azadi, Sam and Kühne, Thomas D.}},
  issn         = {{2469-9950}},
  journal      = {{Physical Review B}},
  number       = {{15}},
  pages        = {{155103--155109}},
  title        = {{{Unconventional phase III of high-pressure solid hydrogen}}},
  doi          = {{10.1103/physrevb.100.155103}},
  volume       = {{100}},
  year         = {{2019}},
}

@article{37958,
  author       = {{Longwitz, Lars and Spannenberg, Anke and Werner, Thomas}},
  issn         = {{2155-5435}},
  journal      = {{ACS Catalysis}},
  keywords     = {{T2, CSSD}},
  number       = {{10}},
  pages        = {{9237--9244}},
  publisher    = {{American Chemical Society (ACS)}},
  title        = {{{Phosphetane Oxides as Redox Cycling Catalysts in the Catalytic Wittig Reaction at Room Temperature}}},
  doi          = {{10.1021/acscatal.9b02456}},
  volume       = {{9}},
  year         = {{2019}},
}