TY - JOUR A1 - Emmerling, Franziska A1 - Orgzall, Ingo A1 - Reck, Günter A1 - Schulz, Burkhard W. A1 - Stockhause, Sabine A1 - Schulz, Burkhard T1 - Structures of substituted di-aryl-1, 3,4-oxadiazole derivatives: 2,5-bis(pyridyl)- and 2,5-bis(aminophenyl)-substitution JF - Journal of molecular structure N2 - Crystal structures of four different di-aryl-1,3,4-oxadiazole compounds (aryl = 2-pyridyl-, 3-pyridyl-, 2-aminophenyl-, 3-aminophenyl-) are determined. Crystallization of di(2-pyridyl)-1,3,4-oxadiazole yielded monoclinic and triclinic polymorphs. The structures are characterized by the occurrence of pi-pi interactions. Additionally, in case of the aminophenyl compounds intra- as well as intermolecular hydrogen bonds are found that influence the packing motif as well. Since these molecules are often used as ligands in metal-organic complexes similarities and differences of the molecular conformation between the molecules in the pure crystals and that of the ligands in the complexes are discussed. (c) 2006 Elsevier B.V. All rights reserved. KW - crystal structure KW - 1,3,4-oxadiazole KW - molecular conformation KW - hydrogen bonds Y1 - 2006 U6 - https://doi.org/10.1016/j.molstruc.2006.03.076 SN - 0022-2860 VL - 800 IS - 1-3 SP - 74 EP - 84 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Frübing, Peter A1 - Kremmer, Alexander A1 - Gerhard, Reimund A1 - Spanoudaki, Anna A1 - Pissis, Polycarpos T1 - Relaxation processes at the glass transition in polyamide 11: From rigidity to viscoelasticity JF - The journal of chemical physics : bridges a gap between journals of physics and journals of chemistr N2 - Relaxation processes associated with the glass transition in nonferroelectric and ferroelectric polyamide (PA) 11 are investigated by means of differential scanning calorimetry, dynamic mechanical analysis, and dielectric relaxation spectroscopy (DRS) in order to obtain information about the molecular mobility within the amorphous phase. In particular, the effects of melt quenching, cold drawing, and annealing just below the melting region are studied with respect to potential possibilities and limitations for improving the piezoelectric and pyroelectric properties of PA 11. A relaxation map is obtained from DRS that shows especially the crossover region where the cooperative alpha relaxation and the local beta relaxation merge into a single high-temperature process. No fundamental difference between quenched, cold-drawn, and annealed films is found, though in the cold-drawn (ferroelectric) film the alpha relaxation is suppressed and slowed down, but it is at least partly recovered by subsequent annealing. It is concluded that there exists an amorphous phase in all structures, even in the cold-drawn film. The amorphous phase can be more rigid or more viscoelastic depending on preparation. Cold drawing not only leads to crystallization in a ferroelectric form but also to higher rigidity of the remaining amorphous phase. Annealing just below the melting region after cold drawing causes a stronger phase separation between the crystalline phase and a more viscoelastic amorphous phase. Y1 - 2006 U6 - https://doi.org/10.1063/1.2360266 SN - 0021-9606 VL - 125 IS - 12 PB - American Institute of Physics CY - Melville ER - TY - JOUR A1 - Zhou, Changsong A1 - Zemanova, Lucia A1 - Zamora, Gorka A1 - Hilgetag, Claus C. A1 - Kurths, Jürgen T1 - Hierarchical organization unveiled by functional connectivity in complex brain networks JF - Physical review letters N2 - How do diverse dynamical patterns arise from the topology of complex networks? We study synchronization dynamics in the cortical brain network of the cat, which displays a hierarchically clustered organization, by modeling each node (cortical area) with a subnetwork of interacting excitable neurons. We find that in the biologically plausible regime the dynamics exhibits a hierarchical modular organization, in particular, revealing functional clusters coinciding with the anatomical communities at different scales. Our results provide insights into the relationship between network topology and functional organization of complex brain networks. Y1 - 2006 U6 - https://doi.org/10.1103/PhysRevLett.97.238103 SN - 0031-9007 SN - 1079-7114 VL - 97 PB - American Physical Society CY - College Park ER - TY - JOUR A1 - Fudickar, Werner A1 - Linker, Torsten T1 - Imaging by sensitized oxygenations of photochromic anthracene films BT - Examination of effects that improve performance and reversibility JF - Chemistry - a European journal N2 - The aliphatic anthracene compound 1 and the oligomeric anthracene 2 were synthesized. Thin films of 1 and 2 mixed with the sensitizers tetraphenylporphyrin (TPP) and methylene blue (MB) were irradiated with visible light in air. Upon formation of singlet oxygen, the anthracene units were converted quantitatively to the corresponding endoperoxides. Heating of the irradiated samples afforded the parent anthracenes with high yields. Here, we demonstrate that the kinetics and reversibility of this reaction strongly depend on the microenvironment of the anthracene groups in the two compounds. The photooxidation of thin films of I is accompanied by interesting changes in the morphology of the film and allows the first application of 1 as a nondestructive negative-tone photo-resist for lithography and as an oxidizing ink. The morphology of 2 remained unchanged after photooxidation as a result of the stabilizing oligomer backbone. This stabilizing effect significantly improves the photochromic performance of 2. The reversibility of the photooxidation is very high (> 90%) for oligomeric films of 2 after several cycles of irradiation and beating. Decomposition of the anthracene and a loss of the activity of the sensitizer diminish slightly the performance of the monomeric species. KW - anthracenes KW - lithography KW - photochromism KW - singlet oxygen KW - thin films Y1 - 2006 U6 - https://doi.org/10.1002/chem.200600387 SN - 0947-6539 VL - 12 SP - 9276 EP - 9283 PB - WILEY‐VCH CY - Weinheim ER - TY - JOUR A1 - Bordihn, Henning A1 - Fernau, Henning A1 - Holzer, Markus A1 - Manca, Vincenzo A1 - Martin-Vide, Carlos T1 - Iterated sequential transducers as language generating devices JF - Theoretical computer science N2 - Iterated finite state sequential transducers are considered as language generating devices. The hierarchy induced by the size of the state alphabet is proved to collapse to the fourth level. The corresponding language families are related to the families of languages generated by Lindenmayer systems and Chomsky grammars. Finally, some results on deterministic and extended iterated finite state transducers are established. KW - finite state sequential transducers KW - state complexity KW - Lindenmayer systems Y1 - 2006 U6 - https://doi.org/10.1016/j.tcs.2006.07.059 SN - 0304-3975 VL - 369 IS - 1 SP - 67 EP - 81 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Schröder, Boris A1 - Seppelt, Ralf T1 - Analysis of pattern-process interactions based on landscape models - Overview, general concepts, and methodological issues JF - Ecological modelling : international journal on ecological modelling and engineering and systems ecolog N2 - Pattern-process analysis is one of the main threads in landscape ecological research. It aims at understanding the complex relationships between ecological processes and landscape patterns, identifying the underlying mechanisms and deriving valid predictions for scenarios of landscape change and its consequences. Today, various studies cope with these tasks through so called "landscape modelling" approaches. They integrate different aspects of heterogeneous and dynamic landscapes and model different driving forces, often using both statistical and process-oriented techniques. We identify two main approaches to deal with the analysis of pattern-process interactions: the first starts with pattern detection, pattern description and pattern analysis, the second with process description, simulation and pattern generation. Focussing on the interplay between these two approaches, landscape analysis and landscape modelling will improve our understanding of pattern-process interactions. The comparison of simulated and observed pattern is a prerequisite for both approaches. Therefore, we identify a set of quantitative, robust, and reproducible methods for the analysis of spatiotemporal patterns that is a starting point for a standard toolbox for ecologists as major future challenge and suggest necessary further methodological developments. (c) 2006 Elsevier B.V. All rights reserved. KW - pattern-process interrelationship KW - landscape analysis KW - landscape modelling KW - simulation KW - inverse modelling KW - pattern description KW - wavelet analysis Y1 - 2006 U6 - https://doi.org/10.1016/j.ecolmodel.2006.05.036 SN - 0304-3800 VL - 199 IS - 4 SP - 505 EP - 516 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Tietjen, Britta A1 - Huth, Andreas T1 - Modelling dynamics of managed tropical rainforests - An aggregated approach JF - Ecological modelling : international journal on ecological modelling and engineering and systems ecolog N2 - The overuse of rainforests in the last century and its consequences necessitate a rethinking of logging policies. To this end models have been developed to simulate rainforest dynamics and to allow optional management strategies to be evaluated. Parameterisation of presently existing models for a certain site needs a lot of work, thus the parameterisation effort is too high to apply the models to a wide range of rainforests. Hence, in this paper we introduce the simplified model FORREG using the knowledge we have gained from a more complex model, FORMIX3-Q. The FORREG model uses differential equations to determine the volume growth of three successional species groups. Parameterisation is simplified by a genetic algorithm, which determines the required internal model parameters from characteristics of the forest dynamics. The new model is employed to assess the sustainability of various logging policies in terms of yield and damage. Results for three forests are discussed: (1) the tropical lowland rain forest in the Deramakot Forest Reserve, (2) the Lambir National Park in Malaysia and (3) a subtropical forest in Paraguay. Our model reproduces both undisturbed forest dynamics and dynamics of logged forests simulated with FORMIX3-Q very well. However, the resultant volumes of yield and damage differ slightly from those gained by FORMIX3-Q if short logging cycles are simulated. Choosing longer logging cycles leads to a good correspondence of both models. For the Deramakot Forest Reserve different logging cycles are compared and discussed. (c) 2006 Elsevier B.V. All rights reserved. KW - aggregation KW - differential equation KW - forest model KW - genetic algorithm KW - logging KW - tropical rainforest Y1 - 2006 U6 - https://doi.org/10.1016/j.ecolmodel.2005.11.045 SN - 0304-3800 VL - 199 IS - 4 SP - 421 EP - 432 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Hattermann, Fred A1 - Krysanova, Valentina A1 - Habeck, Anja A1 - Bronstert, Axel T1 - Integrating wetlands and riparian zones in river basin modelling JF - Ecological modelling : international journal on ecological modelling and engineering and systems ecolog N2 - Wetlands, and in particular riparian wetlands, represent an interface between the catchment area and the aquatic environment. They control the exchange of water and related chemical fluxes from the upper catchment area to surface waters like streams and lakes. Their influence on water and nutrient balances has been investigated mainly at the patch scale. In this study an attempt was made (a) to integrate riparian zones and wetlands into eco-hydrological river basin modelling, and (b) to quantify the impacts of riparian wetland processes on water and nutrient fluxes in a meso-scale catchment located in the northeastern German lowland. The investigation was performed by analysing hydro-chemical field data and applying the eco-hydrological model SWIM (Soil and Water Integrated Model), which was extended to reproduce the relevant water and nutrient flows and retention processes at the catchment scale in general, and in riparian zones and wetlands in particular. The main extensions introduced in the model were: (1) implementation of daily groundwater table dynamics at the hydrotope level, (2) implementation of water and nutrient uptake by plants from groundwater in riparian zones and wetlands, and (3) assessment of nutrient retention in groundwater and interflow. The simulation results indicate that wetlands, though they represent relatively small parts of the total catchment area, may have a significant impact on the overall water and nutrient balances of the catchment. The uncertainty of the simulation results is considerably high, with the main sources of uncertainty being the model parameters representing the geo-hydrology and the input data for land use management. (c) 2006 Elsevier B.V. All rights reserved. KW - riparian zones KW - wetlands KW - water quality KW - groundwater dynamics KW - nutrient retention KW - integrated river basin modelling Y1 - 2006 U6 - https://doi.org/10.1016/j.ecolmodel.2005.06.012 SN - 0304-3800 VL - 199 IS - 4 SP - 379 EP - 392 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Seppelt, Ralf A1 - Schröder, Boris T1 - Pattern and processes of dynamic mosaic landscapes JF - Ecological modelling : international journal on ecological modelling and engineering and systems ecolog Y1 - 2006 U6 - https://doi.org/10.1016/j.ecolmodel.2006.06.011 SN - 0304-3800 VL - 199 IS - 4 SP - 377 EP - 378 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Mechau, Norman A1 - Saphiannikova, Marina A1 - Neher, Dieter T1 - Molecular tracer diffusion in thin azobenzene polymer layers JF - Applied physics letters N2 - Translational diffusion of fluorescent tracer molecules in azobenzene polymer layers is studied at different temperatures and under illumination using the method of fluorescence recovery after photobleaching. Diffusion is clearly observed in the dark above the glass transition temperature, while homogeneous illumination at 488 nm and 100 mW/cm(2) does not cause any detectable diffusion of the dye molecules within azobenzene layers. This implies that the viscosity of azobenzene layers remains nearly unchanged under illumination with visible light in the absence of internal or external forces. (c) 2006 American Institute of Physics. Y1 - 2006 U6 - https://doi.org/10.1063/1.2405853 SN - 0003-6951 VL - 89 IS - 25 PB - Elsevier CY - Melville ER - TY - JOUR A1 - Gandhimathi, V. M. A1 - Rajasekar, S. A1 - Kurths, Jürgen T1 - Vibrational and stochastic resonances in two coupled overdamped anharmonic oscillators JF - Modern physics letters : A, Particles and fields, gravitation, cosmology, nuclear physics N2 - We study the overdamped version of two coupled anharmonic oscillators under the influence of both low- and high-frequency forces respectively and a Gaussian noise term added to one of the two state variables of the system. The dynamics of the system is first studied in the presence of both forces separately without noise. In the presence of only one of the forces, no resonance behaviour is observed, however, hysteresis happens there. Then the influence of the high-frequency force in the presence of a low-frequency, i.e. biharmonic forcing, is studied. Vibrational resonance is found to occur when the amplitude of the high-frequency force is varied. The resonance curve resembles a stochastic resonance-like curve. It is maximum at the value of g at which the orbit lies in one well during one half of the drive cycle of the low-frequency force and in the other for the remaining half cycle. Vibrational resonance is characterized using the response amplitude and mean residence time. We show the occurrence of stochastic resonance behaviour in the overdamped system by replacing the high-frequency force by Gaussian noise. Similarities and differences between both types of resonance are presented. (c) 2006 Elsevier B.V. All rights reserved. KW - vibrational resonance KW - low-frequency force KW - high-frequency force KW - stochastic resonance KW - noise KW - mean residence time Y1 - 2006 U6 - https://doi.org/10.1016/j.physleta.2006.08.051 SN - 0375-9601 VL - 360 IS - 2 SP - 279 EP - 286 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Andrianov, Ivan A1 - Saalfrank, Peter T1 - Free vibrational relaxation of H adsorbed on a Si(100) surface investigated with the multi-configurational time-dependent Hartree method JF - Chemical physics letters N2 - The results of a quantum-mechanical study of vibrational relaxation of hydrogen adsorbed on a Si(100) surface with the multi-configurational time-dependent Hartree (MCTDH) method are presented. A two-dimensional subsystem is coupled non-linearly to a bath of harmonic oscillators (phonons of the Si bulk), and the relaxation of subsystem vibrations proceeds primarily via a two-phonon process. Characteristic times of the system evolution agree well with our previous perturbation theory study. The vibrational population decay is non-exponential, exhibiting pronounced recurrences due to finite bath size. The dependence of the lifetimes of the vibrational levels on the bath size and on the coupling details is investigated. Y1 - 2006 U6 - https://doi.org/10.1016/j.cplett.2006.11.067 SN - 0009-2614 VL - 433 SP - 91 EP - 96 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Selting, Margret T1 - Prosody as an activity-type distinctive signalling cue in conversation : the case of so-called 'astonished questions' in repair-initiation Y1 - 2006 ER - TY - JOUR A1 - Couper-Kuhlen, Elizabeth A1 - Selting, Margret T1 - Towards an interactional perspective on prosody and a prosodic perspective on interaction Y1 - 2006 ER - TY - BOOK ED - Couper-Kuhlen, Elizabeth ED - Selting, Margret T1 - Prosody in Conversation : Interactional Studies T3 - Studies in international sociolinguistics Y1 - 2006 SN - 978-0-521-02410-5 VL - 12 PB - Cambridge Univ. Press CY - Cambridge ET - 1. publ., digitally printed 1. paperback version ER - TY - JOUR A1 - Romano, Maria Carmen A1 - Thiel, Marco A1 - Kurths, Jürgen A1 - Rolfs, Martin A1 - Engbert, Ralf A1 - Kliegl, Reinhold T1 - Synchronization Analysis and Recurrence in Complex Systems Y1 - 2006 SN - 978-3-527-40623-4 ER - TY - JOUR A1 - Kunow, Rüdiger T1 - Architect of the Cosmopolitan Dream : Salman Rushdie Y1 - 2006 ER - TY - JOUR A1 - Kunow, Rüdiger T1 - The Enigma of Arrival Y1 - 2006 SN - 978-3-32311-955-5 ER - TY - JOUR A1 - Eckstein, Lars T1 - Alder, E., Hauck, D., Music and Literature: Music in the Works of Anthony Burgess and E.M. Forster - An Interdisciplinary Study; Tübingen, Francke, 2005 BT - Music and Literature: Music in the Works of Anthony Burgess and E.M. Forster - An Interdisciplinary Study Y1 - 2006 ER - TY - JOUR A1 - Eckstein, Lars A1 - Reinfandt, Christoph T1 - On dancing about architecture : words and music between cultural practise and transcendence Y1 - 2006 ER -