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GTS Bulletin: ISND01 EDZW - Observational data (Binary coded) - BUFR (details are described in the abstract)

The ISND01 TTAAii Data Designators decode as: T1 (I): Observational data (Binary coded) - BUFR T1T2 (IS): Surface/sea level T1T2A1 (ISN): Synoptic observations from fixed land stations at non-standard time (i.e. 01, 02, 04, 05, ... UTC) A2 (D): 90°E - 0° northern hemisphere (The bulletin collects reports from stations: 10004;UFS TW Ems;10015;Helgoland;10020;List auf Sylt;10035;Schleswig;10055;Fehmarn;10147;Hamburg-Fuhlsbüttel;10162;Schwerin;10184;Greifswald;10200;Emden;10224;Bremen;10270;Neuruppin;10338;Hannover;10361;Magdeburg;10393;Lindenberg;10400;Düsseldorf;10469;Leipzig/Halle;10488;Dresden-Klotzsche;10506;Nürburg-Barweiler;10548;Meiningen;10637;Frankfurt/Main;10685;Hof;10738;Stuttgart-Echterdingen;10763;Nürnberg;10788;Straubing;10852;Augsburg;10946;Kempten;) (Remarks from Volume-C: SYNOP)

Multibeam bathymetry raw data (Atlas Hydrosweep DS 3 echo sounder entire dataset) of RV POLARSTERN during cruise PS151

Multibeam data were collected with RV Polarstern along the route of cruise PS151 and data acquisition was almost continuously monitored during the survey. Multibeam sonar system was Teledyne/Atlas Hydrosweep DS3. SVPs were retrieved from CTD data and synthetic profiles from World Ocean Atlas 23. SVPs were processed with HydrOffice SoundSpeedManager (https://www.hydroffice.org/soundspeed/main) and extended with World Ocean Atlas 23 (https://www.ncei.noaa.gov/archive/accession/NCEI-WOA23). SVP data were applied during acquisition. Multibeam data are unprocessed and may contain outliers and blunders and should not be used for grid calculations and charting projects without further editing. The raw multibeam sonar data in Teledyne Reson multibeam processing format (.s7k) were recorded with Teledyne PDS software. Raw data files can be processed using software packages like CARIS HIPS/SIPS. For updated vessel configuration files check further details.

GTS Bulletin: SMVX22 EDZW - Surface data (details are described in the abstract)

The SMVX22 TTAAii Data Designators decode as: T1 (S): Surface data T1T2 (SM): Main synoptic hour (Remarks from Volume-C: SHIP)

GTS Bulletin: ISND71 AMDW - Observational data (Binary coded) - BUFR (details are described in the abstract)

The ISND71 TTAAii Data Designators decode as: T1 (I): Observational data (Binary coded) - BUFR T1T2 (IS): Surface/sea level T1T2A1 (ISN): Synoptic observations from fixed land stations at non-standard time (i.e. 01, 02, 04, 05, ... UTC) A2 (D): 90°E - 0° northern hemisphere (Remarks from Volume-C: NATIONAL AUTOMATIC SYNOP)

GTS Bulletin: SNAA21 EDZW - Surface data (details are described in the abstract)

The SNAA21 TTAAii Data Designators decode as: T1 (S): Surface data T1T2 (SN): Non-standard synoptic hour A1A2 (AA): Antarctic(The bulletin collects reports from stations: 89011;89047;)

GTS Bulletin: ISND09 EDZW - Observational data (Binary coded) - BUFR (details are described in the abstract)

The ISND09 TTAAii Data Designators decode as: T1 (I): Observational data (Binary coded) - BUFR T1T2 (IS): Surface/sea level T1T2A1 (ISN): Synoptic observations from fixed land stations at non-standard time (i.e. 0100, 0200, 0400, 0500, ... UTC) A2 (D): 90°E - 0° northern hemisphere(The bulletin collects reports from stations: 10756;Feuchtwangen-Heilbronn;10761;Weißenburg;10765;Roth;10771;Kümmersbruck;10777;Gelbelsee;10782;Waldmünchen;10796;Zwiesel;10803;Freiburg;10818;Klippeneck;10827;Meßstetten;10837;Laupheim;10840;Ulm-Mähringen;10850;Harburg;10853;Neuburg/Donau (Flugplatz);10856;Lechfeld;10857;Landsberg (Flugplatz);10860;Ingolstadt (Flugplatz);10863;Weihenstephan-Dürnast;10865;München-Stadt;10872;Gottfrieding;10875;Mühldorf;10945;Leutkirch-Herlazhofen;10954;Altenstadt;10963;Garmisch-Partenkirchen;10970;Bichl;10982;Chieming;) (Remarks from Volume-C: SYNOP)

GTS Bulletin: ISMD01 EDZW - Observational data (Binary coded) - BUFR (details are described in the abstract)

The ISMD01 TTAAii Data Designators decode as: T1 (I): Observational data (Binary coded) - BUFR T1T2 (IS): Surface/sea level T1T2A1 (ISM): Main synoptic observations from fixed land stations A2 (D): 90°E - 0° northern hemisphere(The bulletin collects reports from stations: 10004;UFS TW Ems;10015;Helgoland;10020;List auf Sylt;10035;Schleswig;10055;Fehmarn;10147;Hamburg-Fuhlsbüttel;10162;Schwerin;10184;Greifswald;10200;Emden;10224;Bremen;10270;Neuruppin;10338;Hannover;10361;Magdeburg;10393;Lindenberg;10400;Düsseldorf;10469;Leipzig/Halle;10488;Dresden-Klotzsche;10506;Nürburg-Barweiler;10548;Meiningen;10637;Frankfurt/Main;10685;Hof;10738;Stuttgart-Echterdingen;10763;Nürnberg;10788;Straubing;10852;Augsburg;10946;Kempten;) (Remarks from Volume-C: SYNOP)

Schwerpunktprogramm (SPP) 1158: Antarctic Research with Comparable Investigations in Arctic Sea Ice Areas; Bereich Infrastruktur - Antarktisforschung mit vergleichenden Untersuchungen in arktischen Eisgebieten, Biogene Opalisotope - neue Proxies zur Untersuchung vergangener Nährstoffkreisläufe und hydrographischer Strukturen im Südpazifik in Beziehung zu der Entwicklung des Klimas und der antarktischen Kryosphäre

Der Verlauf der atmosphärischen CO2-Konzentrationen während der vergangenen Klimazyklen ist durch ein Sägezahnmuster mit Maxima in Warmzeiten und Minima in Kaltzeiten geprägt. Es besteht derzeit Konsens, dass insbesondere der Süd Ozean (SO) eine Schlüsselfunktion bei der Steuerung der CO2-Entwicklung einnimmt. Allerdings sind die dabei wirksamen Mechanismen, die in Zusammenhang mit Änderungen der Windmuster, Ozeanzirkulation, Stratifizierung der Wassersäule, Meereisausdehnung und biologischer Produktion stehen, noch nicht ausreichend bekannt. Daten zur Wirkung dieser Prozesse im Wechsel von Warm- und Kaltzeiten beziehen sich bislang fast ausschließlich auf den atlantischen SO. Um ein umfassendes Bild der Klimasteuerung durch den SO zu erhalten muss geklärt werden, wie weit sich die aus dem atlantischen SO bekannten Prozesswirkungen auf den pazifischen SO übertragen lassen. Dies ist deshalb von Bedeutung, da der pazifische SO den größten Teil des SO einnimmt. Darüber hinaus stellt er das hauptsächliche Abflussgebiet des Westantarktischen Eisschildes (WAIS) in den SO dar. Im Rahmen des Projektes sollen mit einer neu entwickelten Proxy-Methode Paläoumwelt-Zeitreihen an ausgewählten Sedimentkernen von latitudinalen Schnitten über den pazifischen SO hinweg gewonnen werden. Dabei handelt es sich um kombinierte Sauerstoff- und Siliziumisotopenmessungen an gereinigten Diatomeen und Radiolarien. Es sollen erstmalig die physikalischen Eigenschaften und Nährstoffbedingungen in verschiedenen Stockwerken des Oberflächenwassers aus verschiedenen Ablagerungsräumen und während unterschiedlicher Klimabedingungen beschrieben werden. Dies umfasst Bedingungen von kälter als heute (z.B. Letztes Glaziales Maximum) bis zu wärmer als heute (z.B. Marines Isotopen Stadium, MIS 5.5). Die Untersuchungen geben Hinweise zur (1) Sensitivität des antarktischen Ökosystems auf den Eintrag von Mikronährstoffen (Eisendüngung), (2) Oberflächenwasserstratifizierung und (3) 'Silicic-Acid leakage'-Hypothese, und tragen damit zur Überprüfung verschiedener Hypothesen zur Klimawirksamkeit von SO-Prozessen bei. Die neuen Proxies bilden überdies Oberflächen-Salzgehaltsanomalien ab, die Hinweise zur Stabilität des WAIS unter verschiedenen Klimabedingungen geben. Darüber hinaus kann die Hypothese getestet werden, nach der der WAIS während MIS 5.5 vollständig abgebaut war. Die Projektergebnisse sollen mit Simulationen mit einem kombinierten biogeochemischen (Si-Isotope beinhaltenden) Atmosphäre-Ozean-Zirkulations-Modell aus einem laufenden SPP1158-DFG Projekt an der CAU Kiel (PI B. Schneider) verglichen werden. Damit sollen die jeweiligen Beiträge der Ozeanzirkulation und der biologischen Produktion zum CO2-Austausch zwischen Ozean und Atmosphäre getrennt und statistisch analysiert werden. Informationen zu Staubeintrag, biogenen Flussraten, physikalischen Ozeanparametern und zur Erstellung von Altersmodellen stehen durch Zusammenarbeit mit anderen (inter)nationalen Projekten zur Verfügung.

First-principles kinetic modeling for solar hydrogen production

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.

Multibeam bathymetry processed data (EM 1002 echosounder entire dataset) of RV MARIA S. MERIAN during cruise MSM51/1

Swath sonar bathymetry data used for that dataset was recorded during RV MARIA S. MERIAN cruise MSM51/1 using Kongsberg EM1002 multibeam echosounder. The cruise took place between 01.02.2016 and 27.02.2016 in the Baltic Sea. The cruise aimed to perform seismo- and hydroacoustic surveys, sampling of Holocene sediments and to investigate the water column wintertime mixing close to sea-ice limits. These surveys improved the understanding of variations in the ventilation of the deeper Baltic, considering not only external climate forcing but also the effects of postglacial sealevel rise and isostatic uplift [CSR]. CI Citation: Paul Wintersteller (seafloor-imaging@marum.de) as responsible party for bathymetry raw data ingest and approval. During the MSM51-1 cruise, the moonpooled KONGSBERG EM1002 multibeam echosounder (MBES) was utilized to perform bathymetric mapping in shallow depths. 111 beams are formed for each ping while the seafloor is detected using amplitude and phase information for each beam sounding. For further information on the system, consult https://www.km.kongsberg.com/. Postprocessing and products were conducted by the Seafloor-Imaging & Mapping group of MARUM/FB5, responsible person Paul Wintersteller (seafloor-imaging@marum.de). The open source software MB-System (Caress, D. W., and D. N. Chayes, MB-System: Mapping the Seafloor, https://www.mbari.org/products/research-software/mb-system, 2017) was utilized for this purpose. A sound velocity correction profile was applied to the MSM51-1 data; there were no further corrections for roll, pitch and heave applied during postprocessing. A tide correction was applied, based on the Oregon State University (OSU) tidal prediction software (OTPS) that is retrievable through MB-System. CTD measurements during the cruise were sufficient to represent the changes in the sound velocity throughout the study area. Using Mbeditviz, artefacts were cleaned manually. NetCDF (GMT) grids of the edited data as well as statistics were created with mbgrid. The published bathymetric EM1002 grid of the cruise MSM51-1 has a resolution of 15 m. No total propagated uncertainty (TPU) has been calculated to gather vertical or horizontal accuracy. A higher resolution is, at least partly, achievable. The grid extended with _num represents a raster dataset with the statistical number of beams/depths taken into account to create the depth of the cell. The extended _sd -grid contains the standard deviation for each cell. The DTMs projections are given in Geographic coordinate system Lat/Lon; Geodetic Datum: WGS84.

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