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ANT 2011/12: AWI airborne Accumulation Radar data over western DML around EDML, eastern DML over the Sør Rondane Mountains, and over Atka Bay (GEA and WEGAS Projects)

This dataset contains airborne radar data acquired using the AWI Accumulation Radar (ACCU) system during the Antarctic season of 2011/12. The profiles cover western Dronning Maud Land around EDML, eastern Dronning Maud Land over the Sør Rondane Mountains, and over Atka Bay. The data are available as netCDF files (including waveforms and metadata), KML files of the profile line locations, and quicklook images of the radargrams.

Ökologische Untersuchungen an Gefäßpflanzen in einem amazonischen Tieflandregenwald im Süden Venezuelas (Surumoni-Projekt)

Das bereits seit dem Jahre 1993 laufende Forschungsprojekt beruht auf der neuartigen Möglichkeit, die Baumkronen des Regenwalds ohne weitere Störungen beobachten zu können (Kranbeobachtungsstation). Das Projekt wird in Zusammenarbeit mit der Österreichischen Akademie der Wissenschaften und den Universitäten Bonn, Mannheim, Graz und dem UFZ durchgeführt. Inhaltlich geht es um die Aufklärung der komplexen ökologischen Zusammenhänge innerhalb des Regenwaldes, wo besonders Interaktionen zwischen Tieren und Pflanzen von Bedeutung sind. Wichtige Fragestellungen sind dabei Ameisenpflanzensysteme, blütenökologische Aspekte, Fruchtverbreitung, Schadinsekten und die Regeneration sekundärer Flächen. Um die Themen sinnvoll eingrenzen zu können und um entsprechende Hypothesen zu erstellen, wird vorerst das phänologische und fruchtökologische Spektrum von mehr als tausend Bäumen erarbeitet. In Ergänzung zu den Freilandarbeiten werden in den Labors die angefallenen Fragestellungen durch moderne Methoden weiter aufgearbeitet. Zentrale Themen sind dabei Ultrastrukturen der Oberflächen, genetische Variabilität, chromosomale Differenzierung und Wachstumstumsverhalten während der Keimung. Die Ergebnisse sollen neue Einblicke in das Evolutionsgeschehen tropischer Regenwälder geben und das Verständnis über die Funktion des Regenwaldes und die Entstehung und Erhaltung der Biodiversität erweitern.

Annotated and filtered molecular formulas associated with dissolved organic matter molecular composition data of exemplary water masses resolved by online LC-FT-Orbitrap-MS

The unique chromatographic behaviour of DOM was investigated on three exemplary water samples representing coastal DOM, oceanic surface DOM and oceanic refractory DOM. Weddell Sea surface (30 m depth, oceanic surface DOM) and deep water (1356 m depth, refractory DOM) was sampled with a rosette sampler on RV Polarstern during ANT XXII/2 (station PS67/006-130, latitude -67.5633, longitude -55.3448) and are described elsewhere (El Naggar et al., 2007; Koch et al., 2008). Coastal DOM is routinely extracted from southern North Sea (latitude 54.1447, longitude 7.8711) and used as an in-house laboratory standard. Mass spectra were obtained with liquid chromatography coupled to a Fourier-transform Orbitrap mass spectrometer (LC-FT-Orbitrap-MS) with negative electrospray ionisation. A Q-Exactive Plus (Thermo Fisher Scientific, Bremen, Germany) was coupled to an ultra-performance liquid chromatography system (UPLC, Vanquish, Thermo Fisher Scientific, Bremen, Germany).Reversed phase chromatography was done with a C18 column (Waters AQUITY 2 x 100 mm, 1.7 µm) column at 0.3 mL min 1 and a linear gradient: A (ultrapure water, 4 mmol L 1 ammonium formate) 2 min: 99 %, 11 min: 0 %, 14.9 min: 99 %; B (MeOH, 4 mmol L 1 ammonium formate) 2 min: 1 %, 11 min: 100 %, 14.5 min 100 %, 14.9 min 1 %. The exact mass lists and intensities of the 1.1 min binned scans were exported with the Xcalibur software package (Thermo Electron Corporation). Scans were calibrated with an in-house script. Molecular formulas were assigned with the following elemental composition: 12C≤∞1H≤∞16O≤∞14N≤232S≤1 within 0.8 ppm mass deviation, and filtered with the Ultra Mass Explorer (UME, www.awi.de/en/ume, (Leefmann et al., 2019)).

Dissolved organic matter molecular composition data of exemplary marine water masses resolved by online LC-MS

The unique chromatographic behaviour of DOM was investigated on three exemplary water samples representing coastal DOM, oceanic surface DOM and oceanic refractory DOM. Weddell Sea surface (30 m depth, oceanic surface DOM) and deep water (1356 m depth, refractory DOM) was sampled with a rosette sampler on RV Polarstern during ANT XXII/2 (station PS67/006-130, latitude -67.5633, longitude -55.3448) and are described elsewhere (El Naggar et al., 2007; Koch et al., 2008). 160 L sea water was filtered with 0.2 µm filter cartridges, acidified to pH 2 and pumped through 60 mL solid phase extraction cartridges (PPL, 5 g). DOM was eluted with 40 mL MeOH and stored at -18 °C. Coastal DOM is routinely extracted from southern North Sea (latitude 54.1447, longitude 7.8711) and used as an in-house laboratory standard. Sea water was filtered over 0.2 µm PTFE (Whatman), acidified to pH 2 and extracted with PPL cartridges. After elution with methanol, extracts are stored at -18 °C until measurement to minimize esterification (Flerus et al., 2011). The molecular composition was obtained by two mass spectrometric platforms with negative electrospray ionisation: 1) Fourier Transform Orbitrap mass spectrometer (FT-Orbitrap-MS; Q-Exactive Plus, Thermo Fisher Scientific, Bremen, Germany) coupled to ultra-high performance liquid chromatography (UPLC, Vanquish, Thermo Fisher Scientific, Bremen, Germany); 2) Fourier-transform ion cyclotron resonance mass spectrometry (FT-ICR-MS; 7 Tesla scimaX MRMS system, Bruker Daltonics GmbH & Co. KG, Bremen, Germany) coupled to UPLC (Elute LC, Bruker Daltonics GmbH & Co. KG, Bremen, Germany). Reversed phase chromatography was done with a C18 column (Waters AQUITY 2 x 100 mm, 1.7 µm) column at 0.3 mL min 1 and a linear gradient: A (ultrapure water, 4 mmol L 1 ammonium formate) 2 min: 99 %, 11 min: 0 %, 14.9 min: 99 %; B (MeOH, 4 mmol L 1 ammonium formate) 2 min: 1 %, 11 min: 100 %, 14.5 min 100 %, 14.9 min 1 %.

Raw mass spectrometric data to dissolved organic matter molecular composition data of exemplary water masses resolved by online LC-FT-ICR-MS

The unique chromatographic behaviour of DOM was investigated on three exemplary water samples representing coastal DOM, oceanic surface DOM and oceanic refractory DOM. Weddell Sea surface (30 m depth, oceanic surface DOM) and deep water (1356 m depth, refractory DOM) was sampled with a rosette sampler on RV Polarstern during ANT XXII/2 (station PS67/006-130, latitude -67.5633, longitude -55.3448) and are described elsewhere (El Naggar et al., 2007; Koch et al., 2008). Coastal DOM is routinely extracted from southern North Sea (latitude 54.1447, longitude 7.8711) and used as an in-house laboratory standard. Mass spectra were obtained with liquid chromatography coupled to a Fourier-transform ion cyclotron resonance mass spectrometer (LC-FT-ICR-MS) with negative electrospray ionisation. A 7 Tesla scimaX MRMS system (Bruker Daltonics GmbH & Co. KG, Bremen, Germany) was coupled to an ultra-performance liquid chromatography system (UPLC, Elute LC, Bruker Daltonics GmbH & Co. KG, Bremen, Germany). Reversed phase chromatography was done with a C18 column (Waters AQUITY 2 x 100 mm, 1.7 µm) column at 0.3 mL min 1 and a linear gradient: A (ultrapure water, 4 mmol L 1 ammonium formate) 2 min: 99 %, 11 min: 0 %, 14.9 min: 99 %; B (MeOH, 4 mmol L 1 ammonium formate) 2 min: 1 %, 11 min: 100 %, 14.5 min 100 %, 14.9 min 1 %. The exact mass lists and intensities of the 1.1 min binned scans were exported with the DataAnalysis 5.3 software package (Bruker Daltonics GmbH & Co. KG, Bremen, Germany).

Supporting metadata for multiple oceanographic cruises with RV SONNE (SO254, SO245, SO248) and RV POLARSTERN (PS79), Bermuda Atlantic Time-series Study and Hawaii Ocean Time-series

The data presented here include the metadata (cruise, station number, geographic coordinates, water depth, temperature, salinity and solid-phase extracted dissolved organic carbon concentrations (SPE-DOC)) for multiple oceanographic cruises in the Atlantic, Pacific and Southern oceans (HOTS, BATS, SO254, SO245, SO248, ANT 28-II, ANT 28-IV, and 28-V) between 2009 and 2017. These metadata were used in conjunction with the accompanying dataset to assess the role of deep ocean mixing in the molecular composition of dissolved organic matter was compiled from the CTD bottle data of multiple cruises, some of which are available on PANGAEA at the following links: SO248: https://doi.org/10.1594/PANGAEA.864673, SO245: https://doi.org/10.1594/PANGAEA.890394, SO254: https://doi.org/10.1594/PANGAEA.890453.

Identifizierung von Lockstoffen bei Borkenkaefern, fluechtige Inhaltsstoffe von holzzerstoerenden Pilzen, Koniferen, Laubbaeumen, Ameisen

Die Kenntnis artspezifischer Lockstoffe oder Abwehrstoffe ermoeglicht die Manipulation von Insektenpopulationen unter weitgehender Vermeidung der Anwendung von Bioziden; solche Substanzen koennen sowohl in den Insekten selbst als auch in ihren Wirtspflanzen vorkommen und koennen zur Chemotaxonomie dienen.

Annotated and filtered molecular formulas associated with dissolved organic matter molecular composition data of exemplary water masses resolved by online LC-FT-ICR-MS

The unique chromatographic behaviour of DOM was investigated on three exemplary water samples representing coastal DOM, oceanic surface DOM and oceanic refractory DOM. Weddell Sea surface (30 m depth, oceanic surface DOM) and deep water (1356 m depth, refractory DOM) was sampled with a rosette sampler on RV Polarstern during ANT XXII/2 (station PS67/006-130, latitude -67.5633, longitude -55.3448) and are described elsewhere (El Naggar et al., 2007; Koch et al., 2008). Coastal DOM is routinely extracted from southern North Sea (latitude 54.1447, longitude 7.8711) and used as an in-house laboratory standard. Mass spectra were obtained with liquid chromatography coupled to a Fourier-transform ion cyclotron resonance mass spectrometer (LC-FT-ICR-MS) with negative electrospray ionisation. A 7 Tesla scimaX MRMS system (Bruker Daltonics GmbH & Co. KG, Bremen, Germany) was coupled to an ultra-performance liquid chromatography system (UPLC, Elute LC, Bruker Daltonics GmbH & Co. KG, Bremen, Germany). Reversed phase chromatography was done with a C18 column (Waters AQUITY 2 x 100 mm, 1.7 µm) column at 0.3 mL min 1 and a linear gradient: A (ultrapure water, 4 mmol L 1 ammonium formate) 2 min: 99 %, 11 min: 0 %, 14.9 min: 99 %; B (MeOH, 4 mmol L 1 ammonium formate) 2 min: 1 %, 11 min: 100 %, 14.5 min 100 %, 14.9 min 1 %. The exact mass lists and intensities of the 1.1 min binned scans were exported with the DataAnalysis 5.3 software package (Bruker Daltonics GmbH & Co. KG, Bremen, Germany). Scans were calibrated with an in-house script. Molecular formulas were assigned with the following elemental composition: 12C≤∞1H≤∞16O≤∞14N≤232S≤1 within 0.3 ppm mass deviation, and filtered with the Ultra Mass Explorer (UME, www.awi.de/en/ume, (Leefmann et al., 2019)).

Verbesserung der Prozesseffizienz des werkstofflichen Recyclings von Post-Consumer Kunststoff-Verpackungsabfällen durch intelligentes Stoffstrommanagement, Teilvorhaben 1: Sensorbasierte Stoffstromcharakterisierung & Nutzerperspektiven

Dissolved organic matter molecular composition data for multiple oceanographic cruises with RV SONNE (SO254, SO245, SO248) and RV POLARSTERN (PS79), Bermuda Atlantic Time-series Study and Hawaii Ocean Time-series

This data includes the dissolved organic matter (DOM) molecular composition data obtained via Fourier-transform ion cyclotron resonance mass spectrometry for multiple oceanographic cruises collected in the Atlantic, Pacific and Southern oceans (HOTS, BATS, SO254, SO245, SO248, ANT 28-II, ANT 28-IV, and 28-V) between 2009 and 2017. This analysis was conducted to assess the molecular composition of DOM in the context of ocean mixing. DOM was extracted and desalted using the solid phase extraction method as described in Dittmar et al. 2008. The extracts were stored frozen in methanol until analysis in 2019, when aliquots of the extracts were mixed with 50% ultrapure water (50:50 v/v) and diluted to a final carbon concentration of 2.5 ppm. DOM composition was determined on a SolariX XR FT-ICR-MS (Bruker Daltonik GmbH, Bremen, Germany) equipped with a 15 Tesla superconducting magnet and an electrospray ionization source (ESI; Bruker Apollo II ion source) in negative ion mode, as described in (Bercovici, Dittmar, and Niggemann 2022). Subsequent data processing and molecular formula assignment was conducted in ICBM-OCEAN, as described in (Merder et al. 2020).

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