On characterizing the temporal dominance patterns of model parameters and processes

Diagnostic analyses of hydrological models intend to improve the understanding of how processes and their dynamics are represented in models. Temporal patterns of parameter dominance could be precisely characterized with a temporally resolved parameter sensitivity analysis. In this way, the discharge conditions are characterized, that lead to a parameter dominance in the model. To achieve this, the analysis of temporal dynamics in parameter sensitivity is enhanced by including additional information in a three‐tiered framework on different aggregation levels. Firstly, temporal dynamics of parameter sensitivity provide daily time series of their sensitivities to detect variations in the dominance of model parameters. Secondly, the daily sensitivities are related to the flow duration curve (FDC) to emphasize high sensitivities of model parameters in relation to specific discharge magnitudes. Thirdly, parameter sensitivities are monthly averaged separately for five segments of the FDC to detect typical patterns of parameter dominances for different discharge magnitudes. The three methodical steps are applied on two contrasting catchments (upland and lowland catchment) to demonstrate how the temporal patterns of parameter dynamics represent different hydrological regimes. The discharge dynamic in the lowland catchment is controlled by groundwater parameters for all discharge magnitudes. In contrast, different processes are relevant in the upland catchment, because the dominances of parameters from fast and slow runoff components in the upland catchment are changing over the year for the different discharge magnitudes. The joined interpretation of these three diagnostic steps provides deeper insights of how model parameters represent hydrological dynamics in models for different discharge magnitudes. Thus, this diagnostic framework leads to a better characterization of model parameters and their temporal dynamics and helps to understand the process behaviour in hydrological models. Copyright © 2015 John Wiley & Sons, Ltd.     

Exsolution in augite from the Skaergaard Intrusion

The exsolution phenomena of augite from Ferrogabbro 4430 of the Skaergaard Intrusion were examined in detail by single crystal X-ray diffraction and heating experiments to study the stepwise exsolution process. In the augite crystals, five different phases were detected: pigeonite (001), pigeonite (100), orthopyroxene (a), orthopyroxene (p) and a small amount of clinoamphibole. The two different pigeonites nearly share the corresponding (001) and (100) planes with the host. Orthopyroxene (a) and orthopyroxene (p) have (100) in common with the host and with exsolved pigeonite (001), respectively. Clinoamphibole was observed in the form of rather weak reflections in many crystals. It has (010) in common with the host.A large number of augite crystals exhibited a pigeonite (001) phase with curved, rotated reflections and diffuse streaks along the a* direction in (h0l) precession photographs. It appears that these streaks are related to orthopyroxene (p). Orthopyroxene (p) seems to be crystallized from pigeonite (001) by nucleation at (100) stacking fault planes (inverted pigeonite). Pigeonite (100) may be formed at growth ledges between augite host and exsolved orthopyroxene (a) at a later stage of exsolution to stabilize the boundaries.From the X-ray diffraction profiles and the results of the heating experiments, a possible exsolution sequence is suggested. Clinoamphibole appears to be a product of alteration at the latest stage of the exsolution process. It seems to be related to particular conditions of partial water pressure.     

Perthite microstructure in magmatic alkali feldspar with oscillatory zoning; Weinsberg Granite, Upper Austria

Feldspar megacrysts from the Weinsberg granite (Moldanubian Zone) show oscillatory zoning with respect to the albite- and orthoclase components. All growth zones show perthitic exsolutions which take the form of bleb- and lens shaped albite-rich precipitates in an orthoclase-rich host. The average sizes and shapes of the precipitates show systematic variation with the integrated bulk compositions of the respective growth zones. The precipitates are abundant and relatively small in growth zones with intermediate bulk composition (Or50Ab41An09 - Or80Ab18An02), and they are less abundant and larger in more orthoclase-rich zones (Or88Ab11An01). Small precipitates have a relatively high aspect ratio, whereas the large precipitates in the potassium-rich zones are more spherical. The relation between microstructure and integrated bulk composition suggests that exsolution and subsequent growth and coarsening occurred by different mechanisms in the respective growth zones. Numerical modeling shows that rapid growth of precipitates over extended periods of time and attainment of relatively large final size is favored, if only few nuclei are formed in an oversaturated host. In contrast, precipitates can grow rapidly only over limited time intervals and remain relatively small, if abundant nuclei are present. During cooling of the oscillatorily zoned alkali-feldspar, exsolution started at relatively high temperatures in growth zones of intermediate integrated bulk composition as compared to exsolution in the more orthoclase-rich growth zones. Irrespective of whether exsolution occurred by spinodal decomposition or by nucleation at relatively high temperatures in the growth zones of intermediate integrated bulk composition, it produced abundant nuclei and resulted in relatively small precipitates. In contrast, comparatively few nuclei were formed in the orthoclase-rich growth zones resulting in large precipitates. The Na/K partitioning between precipitates and the host is independent of the integrated bulk composition of the respective growth zone reflecting re-equilibration during cooling down to relatively low temperatures (<?400°C). The shape of the precipitates probably has evolved from an initially lamellar or spindle-like geometry with high aspect ratio to more isometric, spheroidal shapes during precipitate growth and coarsening. Host/precipitate interfaces served as fluid pathways during late stage deuteric alteration.     

Constraints on the application of the MBT/CBT palaeothermometer at high latitude environments (Svalbard,Norway)

Branched glycerol dialkyl glycerol tetraethers (GDGTs) are membrane lipids of unknown bacteria that are ubiquitous in soil and peat. Two indices based on the distribution of these lipids in soils, the Cyclization of Branched Tetraethers (CBT) and the Methylation of Branched Tetraethers (MBT) indices have been shown to correlate with soil pH, and mean annual air temperature (MAT) and soil pH, respectively, and can be used to reconstruct MAT in palaeoenvironments. To verify the extent to which branched GDGTs in marine sediments reflect the distribution pattern on land and whether these proxies are applicable for palaeoclimate reconstruction in high latitude environments with a MAT of <0 °C, we compared the branched GDGT distribution in Svalbard soils and nearby fjord sediments. Although branched GDGT concentrations in the soil are relatively low (0.02–0.95 μg/g dry weight (dw)) because of the cold climate and the short growing season, reconstructed MATs based on the MBT/CBT proxy are ca. ?4 °C, close to the measured MAT (ca. ?6 °C). Concentrations of branched GDGTs (0.01–0.20 μg/g dw) in fjord sediments increased towards the open ocean and the distribution was strikingly different from that in soil, i.e. dominated by GDGTs with one cyclopentane moiety. This resulted in MBT/CBT-reconstructed MAT values of 11–19 °C, well above measured MAT. The results suggest that at least part of the branched GDGTs in marine sediments in settings with a low soil organic matter (OM) input may be produced in situ. In these cases, the application of the MBT/CBT palaeothermometer will generate unrealistic MAT reconstructions. The MBT/CBT proxy should therefore only be used at sites with a substantial input of soil OM relative to the amount of marine OM, i.e. at sites close to the mouth of rivers with a catchment area where sufficient soil formation takes place and the soil thus contains substantial amounts of branched GDGTs.     

Rigid unit modes in the molecular dynamics simulation of quartz and the incommensurate phase transition

A molecular dynamics simulation of quartz at different temperatures both in the a and in the phase has been conducted. The - phase transition could be observed. A phonon analysis of the -phase confirms and rounds out in a quantitative way the origin of the incommensurate (ic) modulated phase. In particular it traces the optic soft mode at becoming (to a good approximation) a so-called rigid unit mode (RUM) at q0, and elucidates its coupling to the transverse acoustic mode which precipitates the incommensurate transition. This success underpins and illuminates the concept of RUMs and their role in structural phase transitions.     

Hydrochemical variation in the springs water between Jerusalem–Ramallah Mountains and Jericho Fault,Palestine

The spatial and temporal changes of the composition of the groundwater from the springs along the Wadi Qilt stream running from the Jerusalem–Ramallah Mountains towards the Jericho Plain is studied during the hydrological year 2006/2007. The residence time and the intensity of recharge play an important role in controlling the chemical composition of spring water which mainly depends on distance from the main recharge area. A very important factor is the oxidation of organics derived from sewage and garbage resulting in variable dissolved CO₂ and associated HCO₃ ⁻ concentration. High CO₂ yields lower pH values and thus under-saturation with respect to calcite and dolomite. Low CO₂ concentrations result in over-saturation. Only at the beginning and at the end of the rainy season calcite saturation is achieved. The degradation of dissolved organic matter is a major source for increasing water hardness. Besides dissolution of carbonates dissolved species such as nitrate, chloride, and sulfate are leached from soil and aquifer rocks together with only small amounts of Mg. Mg not only originates from carbonates but also from Mg–Cl waters are leached from aquifer rocks. Leaching of Mg–Cl brines is particularly high at the beginning of the winter season and lowest at its end. Two zones of recharge are distinguishable. Zone 1 represented by Ein Fara and Ein Qilt is fed directly through the infiltration of meteoric water and surface runoff from the mountains along the eastern mountain slopes with little groundwater residence time and high flow rate. The second zone is near the western border of Jericho at the foothills, which is mainly fed by the under-groundwater flow from the eastern slopes with low surface infiltration rate. This zone shows higher groundwater residence time and slower flow rate than zone 1. Groundwater residence time and the flow rate within the aquifer systems are controlled by the geological structure of the aquifer, the amount of active recharge to the aquifer, and the recharge mechanism. The results of this study may be useful in increasing the efficiency of freshwater exploitation in the region. Some precautions, however, should be taken in future plans of artificial recharge of the aquifers or surface-water harvesting in the Wadi. Because of evaporation and associated groundwater deterioration, the runoff water should be artificially infiltrated in zones of Wadis with high storage capacity of aquifers. Natural infiltration along the Wadis lead to evaporation losses and less quality of groundwater.     

Decision-support systems for groundwater protection: innovative tools for resource management

Governmental authorities are forced by law to make decisions within the framework of European, national and regional directives in the fields of spatial planning, groundwater and environmental protection. These tasks can be supported by a decision-support system, which integrates data from various sources and helps to make decision processes more effective and transparent. Basic work for such a decision support system has been done in a transnational and interdisciplinary project (Interreg II C: KATER), including metadata definition, metadata system, cartographic tools and GIS tools. The direct integration of these tools and information in the decision process will be implemented in the next few years (project KATER II).