The geomagnetic field shields our habitat against solar wind and radiation from space. Due to the geometry of the field, the shielding in general is weakest at high latitudes. It is also anomalously weak in a region around the south Atlantic known as South Atlantic Anomaly (SAA), and the global dipole moment has been decreasing by nearly 10 percent since direct measurements of field intensity became possible in 1832. Due to our limited understanding of the geodynamo processes in Earths core, it is impossible to reliably predict the future evolution of both dipole moment and SAA over the coming decades. However, lack of magnetic field shielding as would be a consequence of further weakening of dipole moment and SAA region field intensity would cause increasing problems for modern technology, in particular satellites, which are vulnerable to radiation damage. A better understanding of the underlying processes is required to estimate the future development of magnetic field characteristics. The study of the past evolution of such characteristics based on historical, archeo- and paleomagnetic data, on time-scales of centuries to millennia, is essential to detect any recurrences and periodicities and provide new insights in dynamo processes in comparison to or in combination with numerical dynamo simulations. We propose to develop two new global spherical harmonic geomagnetic field models, spanning 1 and 10 kyrs, respectively, and designed in particular to study how long the uninterrupted decay of the dipole moment has been going on prior to 1832, and if the SAA is a recurring structure of the field.We will combine for the first time all available historical and archeomagnetic data, both directions and intensities, in a spherical harmonic model spanning the past 1000 years. Existing modelling methods will be adapted accordingly, and existing data bases will be complemented with newly published data. We will further acquire some new archeomagnetic data from the Cape Verde islands from historical times to better constrain the early evolution of the present-day SAA. In order to study the long-term field evolution and possible recurrences of similar weak field structures in this region, we will produce new paleomagnetic records from available marine sediment cores off the coasts of West Africa, Brazil and Chile. This region is weakly constrained in previous millennial scale models. Apart from our main aim to gain better insights into the previous evolution of dipole moment and SAA, the models will be used to study relations between dipole and non-dipole field contributions, hemispheric symmetries and large-scale flux patterns at the core-mantle boundary. These observational findings will provide new insights into geodynamo processes when compared with numerical dynamo simulation results.Moreover, the models can be used to estimate past geomagnetic shielding above Earths surface against solar wind and for nuclide production from galactic cosmic rays.
The development of sustainable and efficient energy conversion processes at interfaces is at the center of the rapidly growing field of basic energy science. How successful this challenge can be addressed will ultimately depend on the acquired degree of molecular-level understanding. In this respect, the severe knowledge gap in electro- or photocatalytic conversions compared to corresponding thermal processes in heterogeneous catalysis is staggering. This discrepancy is most blatant in the present status of predictive-quality, viz. first-principles based modelling in the two fields, which largely owes to multifactorial methodological issues connected with the treatment of the electrochemical environment and the description of the surface redox chemistry driven by the photo-excited charges or external potentials.Successfully tackling these complexities will advance modelling methodology in (photo)electrocatalysis to a similar level as already established in heterogeneous catalysis, with an impact that likely even supersedes the one seen there in the last decade. A corresponding method development is the core objective of the present proposal, with particular emphasis on numerically efficient approaches that will ultimately allow to reach comprehensive microkinetic formulations. Synergistically combining the methodological expertise of the two participating groups we specifically aim to implement and advance implicit and mixed implicit/explicit solvation models, as well as QM/MM approaches to describe energy-related processes at solid-liquid interfaces. With the clear objective to develop general-purpose methodology we will illustrate their use with applications to hydrogen generation through water splitting. Disentangling the electro- resp. photocatalytic effect with respect to the corresponding dark reaction, this concerns both the hydrogen evolution reaction at metal electrodes like Pt and direct water splitting at oxide photocatalysts like TiO2. Through this we expect to arrive at a detailed mechanistic understanding that will culminate in the formulation of comprehensive microkinetic models of the light- or potential-driven redox process. Evaluating these models with kinetic Monte Carlo simulations will unambiguously identify the rate-determining and overpotential-creating steps and therewith provide the basis for a rational optimization of the overall process. As such our study will provide a key example of how systematic method development in computational approaches to basic energy sciences leads to breakthrough progress and serves both fundamental understanding and cutting-edge application.
Teilprojekt A1 konzentriert sich auf zwei Makroregionen in Afrika: Äthiopien und Ägypten. Während in den letzten Jahren geoarchäologische Arbeiten an zwei Fundplätzen (Mochena Borago in Äthiopien, Sodmein Cave in Ägypten) im Vordergrund der Untersuchungen standen, ist es das Ziel im beantragten Forschungsvorhaben zu einem umfassenden Verständnis vergangener Umwelt- und Bevölkerungsdynamiken in diesen beiden Makro-Regionen zu gelangen. Dies soll durch die Integration von Daten aus verschiedenen archäologischen Fundstellen und geologischen Archiven erreicht werden. Dies erfolgt in enger Zusammenarbeit insbesondere mit den Teilprojekten A3, F6 und Z2.
In Teilprojekt A3 werden Modelle zur Beschreibung der Chlor- und Schwefelchemie bei der Oxyfuel-Verbrennung entwickelt, mit denen die Bildung Cl- und S-haltiger Minoritätenspezies vorhergesagt werden kann, um so die Rückwirkung von Cl- und S-haltigen Spezies auf die Verbrennung zu berücksichtigen. Experimentellen Untersuchungen hierzu erfolgen in einem Flugstromreaktor sowie mittels thermogravimetrischer Analyse. Eine extraktive Messtechnik mit Massenspektrometer für hochreaktive S- und Cl-Spezies wird entwickelt und erprobt.
Zur nachhaltigen Sicherung der Energie- und Stromversorgung wird zukünftig neben Kernenergie und regenerativer Energiebereitstellung weiterhin der Rückgriff auf fossile Brennstoffe, wie Kohle, Öl und Erdgas, unverzichtbar bleiben. Bei konventionellen Kraftwerkstechnologien werden jedoch Treibhausgase freigesetzt, während gleichzeitig deren Reduzierung weltweit hohe Priorität hat. Zur Lösung dieses Zielkonflikts werden 'Carbon Capture and Storage' (CCS)-Methoden diskutiert, wobei die Oxyfuel-Verbrennung eine der vielversprechendsten Technologien zur CO2-Abscheidung darstellt. Bei diesem Verfahren wird der Brennstoff anstelle von Luft mit einem Gemisch aus Sauerstoff und rezirkuliertem Rauchgas verbrannt, um so ein hoch CO2-haltiges Abgas zu erzeugen, das nach weiteren sekundären Reinigungsschritten abgetrennt werden kann. Der Ersatz des Stickstoffanteils der Luft durch CO2 und H2O führt zu einem völlig neuen Verbrennungsverhalten, das auch zu Instabilitäten sowie zum örtlichen Verlöschen der Flamme führen kann. Die korrekte Beschreibung dieses Verbrennungsverhaltens erfordert entsprechende physikalisch und chemisch motivierte Modelle für diese spezielle Gasatmosphäre. Deshalb sollen bis zum Projektende des Sonderforschungsbereichs/Transregio die folgenden Erkenntnisse, Daten und Modelle zur Verfügung stehen: (1) Belastbare Modelle durch grundlegendes Verständnis der beteiligten Prozesse und deren Abhängigkeit von den jeweiligen Einflussparametern, von der Mikroskala bis hin zur skalenübergreifenden Interaktion, (2) Basisdaten zur Vorhersage der Wärmeübertragung von der Flamme an die Wände und Einbauten in Kraftwerkskesseln mit Oxyfuel-Atmosphäre, (3) Verlässliche Berechnungsgrundlagen für die Entwicklung und Auslegung von Brennern und Feuerräumen für Oxyfuel-Kraftwerke mit Feststoffverbrennung. Im Sonderforschungsbereich/Transregio arbeiten Wissenschaftlerinnen und Wissenschaftler der RWTH Aachen, Ruhr-Universität Bochum und TU Darmstadt zusammen.
In Teilprojekt A5 soll geklärt werden, ob die mineralischen Bestandteile, wie Na, K, Mg, Ca, Al oder Fe, der Kohle katalytisch aktiv sind und somit Einfluss auf den Oxyfuel-Verbrennungsprozess nehmen. Neben dem Verbrennungsprozess in O2 werden die beschleunigte Einstellung des Boudouard-Gleichgewichts und die Kohlevergasung mit H2O berücksichtigt, die durch Volumenvergrößerung erheblichen Einfluss auf das Strömungsfeld in Flammen nehmen können. Es sollen reale Kohlen aber insbesondere auch synthetische Modellkohlenstoffe untersucht werden, was eine schrittweise Steigerung der Komplexität der untersuchten Systeme erlaubt.
Atmospheric CO2 concentrations present a repetitive pattern of gradual decline and rapid increase during the last climate cycles, closely related to temperature and sea level change. During the Last Glacial Maximum (LGM; 23-19 kyr BP), when sea level was ca. 120 m below present, the ocean must have stored additionally about 750 Gt carbon. There is consensus that the Southern Ocean represents a key area governing past and present CO2 change. The latter is not only of high scientific but also of socio-economic and political concern since the Southern Ocean provides the potential for an efficient sink of anthropogenic carbon. However, the sensitivity of this carbon sink to climate-change induced reorganizations in wind patterns, ocean circulation, stratification, sea ice extent and biological production remains under debate. Models were not yet able to reproduce the necessary mechanisms involved, potentially due to a lack of the dynamic representation/resolution of atmospheric and oceanic circulation as well as missing carbon cycling. Data on past Southern Ocean hydrography and productivity are mainly from the Atlantic sector, thus do not adequately document conditions in the Pacific sector. This sector is not only the largest part of the Southern Ocean, but it also represents the main drainage area of the marine-based West Antarctic Ice Sheet (WAIS). In the proposed study we aim to generate paleo-data sets with a newly established proxy method from sediment core transects across the Pacific Southern Ocean. This will enhance the baselines for the understanding and modeling of the Southern Ocean's role in carbon cyling, i.e. ocean/atmosphere CO2 exchange and carbon sequestration. It will also allow insight into the response of the WAIS to past warmer than present conditions. Paired isotope measurements (oxygen, silicon) will be made on purified diatoms and radiolarians to describe glacial/interglacial contrasts in physical and nutrient properties at surface and subsurface water depth. This will be used to test (i) the impact of yet unconsidered dust-borne micronutrient deposition on the glacial South Pacific on shifts of primary productivity, Si-uptake rates and carbon export, (ii) the 'silicic-acid leakage' hypothesis (SALH) and (iii) the formation and extent of surface water stratification. Diatom and radiolarian oxygen isotopes will provide information on the timing of surface ocean salinity anomalies resulting from WAIS melt water. Climate model simulations using a complex coupled atmosphere ocean general circulation model (AOGCM) in combination with a sophisticated ocean biogeochemical model including Si-isotopes will be used for comparison with the paleo records. The analysis will cover spatial as well as temporal variability patterns of Southern Ocean hydrography, nutrient cycling and air-sea CO2-exchange. With the help of the climate model we aim to better separate and statistically analyse the individual impacts of ocean circulation and bio
The relevance of biogeochemical gradients for turnover of organic matter and contaminants is yet poorly understood. This study aims at the identification and quantification of the interaction of different redox processes along gradients. The interaction of iron-, and sulfate reduction and methanogenesis will be studied in controlled batch and column experiments. Factors constraining the accessibility and the energy yield from the use of these electron acceptors will be evaluated, such as passivation of iron oxides, re-oxidation of hydrogen sulfide on iron oxides. The impact of these constraints on the competitiveness of the particular process will then be described. Special focus will be put on the evolution of methanogenic conditions in systems formerly characterized by iron and sulfate reducing condition. As methanogenic conditions mostly evolve from micro-niches, methods to study the existence, evolution and stability of such micro-niches will be established. To this end, a combination of Gibbs free energy calculations, isotope fractionation and tracer measurements, and mass balances of metabolic intermediates (small pool sizes) and end products (large pool sizes) will be used. Measurements of these parameters on different scales using microelectrodes (mm scale), micro sampling devices for solutes and gases (cm scale) and mass flow balancing (column/reactor scale) will be compared to characterize unit volumes for organic matter degradation pathways and electron flow. Of particular interest will be the impact of redox active humic substances on the competitiveness of involved terminal electron accepting processes, either acting as electron shuttles or directly providing electron accepting capacity. This will be studied using fluorescence spectroscopy and parallel factor analysis (PARAFAC) of the gained spectra. We expect that the results will provide a basis for improving reactive transport models of anaerobic processes in aquifers and sediments.
Cherry leaf roll virus (CLRV) is a plant pathogen of economic and ecologic importance. It is globally distributed in a wide range of forest, fruit, and ornamental trees and shrubs. In several areas of cherry and walnut production CLRV causes severe losses in yield and quality. With current reference to the rapid dissemination and strong symptom expression in Finnish birches and the Germany-wide distribution of CLRV in birches and elderberry, we continuously investigate and gradually reveal CLRV transmission pathways as by pollen, seeds or water. However, modes and interactions responsible for the wide intergeneric host transmission as well as for the exceptional CLRV epidemic in Fennoscandia still remain unknown. In this project systematic studies shall investigate biological vectors as a causal agent to finally derive control mechanisms and strategies to avoid new epidemics in different hosts and geographic regions. Detailed monitoring of the invertebrate fauna of birch stands/forests and elderberry plantations in Germany and Finland shall reveal potential vectors to subsequently study them in detail by approved virus detection methods and transmission experiments. Molecular analyses of the CLRV coat protein shall prove its role as a viral determinant for a virus/vector interaction. Consequently, this project essentially will contribute important answers on the CLRV epidemiology, and this will be a key element within the first network of research on plant viral pathogens in forest trees.
Das Ziel des Projektes ist die skalenabhängige Evaluierung von Niederschlagsprognosen der DWD-Modellkette (LM/GME) bezüglich dynamischer Parameter und Wolkeneigenschaften. Ein neu entwickelter dynamischer Zustandsindex (DSI), die mit der spezifischen Feuchte gewichtete Divergenz sowie Wolkentyp, Bedeckung und Höhe der Wolkenobergrenze sind die Evaluierungsparamater. Der DSI wurde aus den ursprünglichen Gleichungen abgeleitet und beschreibt die Abweichungen von einem verallgemeinerten dynamischen Gleichgewicht, verursacht durch Instationarität und diabatische Prozesse. Die Evaluierung konzentriert sich auf die Wechselwirkungen zwischen der synoptischen und konvektiven Skala, die häufig die Ursache für extreme Niederschlagsereignisse sind. Sie untersucht die Beziehung zwischen den synoptisch-skaligen Prozessen und der konvektiven Parameterisierung. Eine Voraussetzung der Evaluierung ist eine vom Modell unabhängige feldmäßige Analyse des täglichen Niederschlages und der Wolkenparameter in der Gitterauflösung des LM/GME. Ein schon existierendes Analyseschema der synoptischen Beobachtungen wird weiter verbessert und erweitert durch Satellitendaten. Diese liefern kontinuierliche Wolkendaten und Niederschlagsraten. Die Genauigkeit der analysierten Felder wird mit Hilfe moderner statistischer Methoden abgeschätzt. In einem weiteren Schritt werden die getesteten dynamischen Parameter zu einer quasi-prognostischen Niederschlagsvorhersage oder als Prediktoren für einen MOS-Ansatz verwendet.
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