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Hydrogeochemical dataset for characterization of the deep Aalenian Sandstone aquifer (Middle Jurassic) in Potsdam, Germany

This dataset is part of a research collaboration between Energie und Wasser Potsdam (EWP) and the GFZ Helmholtz Centre for Geosciences. The main objective of this research collaboration was to evaluate the suitability of the subsurface in the Potsdam area for deep geothermal energy. EWP is currently constructing a geothermal power plant using the aquifer of the here exploited Jurassic sandstones. From December 2022 to May 2023, two deep wells were drilled in the center of the city Potsdam, Germany, targeting the Jurassic Aalenian Sandstone at depths between 983 and 1180 m below surface. Hydraulic tests were performed immediately after completion of each well. More than 15,000 m3 of formation water was produced. Geochemical analysis were performed on the produced formation water with the objective of characterizing the fluid properties in terms of geothermal usage, e.g. corrosion and scaling potential. The results of the analysis of physicochemical on-site monitoring and performed on-site tests, inorganics, organics, gas composition, heat capacity and naturally occurring radioactive materials are presented in this data publication.

Database for characterization of potential sites for CO2 storage in Northern Germany

The database help assess the technical feasibility questions for CO2 underground storage in North German Basin and the German North Sea region serving as a reference for “direct air capture and storage for reaching CO2 neutrality” project. The main purpose for this database was to gather uniform geological data information for characterizing depleted hydrocarbon fields and deep saline aquifers, supporting strategic decision making for pilot project to establish a direct air capture and storage demonstrator in Germany. All data collected for the database comes from public domains and therefore making it suitable for preliminary site screening and selection. However, detailed site characterization and further investigation are required for more comprehensive evaluation. For each of the identified storage sites found from previous publication and projects (Höding et al., 2009;Hystories, 2022; Poulsen et al., 2013), 9 parameters were selected for geological characterization for CO2 storage assessment, which are depth and thickness of storage formation, porosity and permeability, estimated storage capacity, caprock thickness, and reservoir integrity, as well as geothermal gradient. The determination of this parameters were generally following the instructions of International Organization for Standardization (2017), the ISO 27914:2017 standard outlines the requirements for carbon dioxide capture, transportation, and geological storage and other publications for site screening and selection instructions (Callas et al., 2022, 2023; Kim et al., 2022; Raza et al., 2016; Uliasz-Misiak et al., 2021), and further carved considering sound scientific approaches, best practice methodologies, availability of high-quality data, and in-situ storage conditions. The geological coordinates have been converted to WGS 84 / UTM zone 33N with QGIS authority projection number as European Petroleum Survey Group (32633). Most geological parameters were extracted based on TUNB model(BGR, LAGB, LBEG, LBGR, LLUR, & LUNG, 2022), additional petrophysical information were mainly collected from Müller & Reinhold, (2011), Reinhold et al., (2011) and Petroleum Geological Atlas of the Southern Permian Basin Area, (2010) projects. Additionally, this database can also serve as a valuable resource for other types of underground storage characterization.

Global Heat Flow Database Data Template

Since 1963, the International Heat Flow Commission (IHFC | www.ihfc-iugg.org) has been dedicated to providing standards for heat flow measurements and maintaining the Global Heat Flow Database (GHFDB) — a collection of heat flow data from around the world. The first quality framework for heat-flow-density data was proposed by Jessop et al. (1976), reflecting the state of knowledge, measurement techniques, and technical developments at that time. In 2019, the IHFC initiated a major revision of the GHFDB to develop an authenticated and quality-assessed database. This initiative involved multinational working groups and led to a comprehensive update of key parameters affecting heat-flow calculations. These updates included measurement methods for both temperature and thermal conductivity, as well as metadata structures. The new standard for a revised GHFDB structure was developed through a collaborative community approach and published in 2021 (Fuchs et al., 2021). This standard reflected changes in database technology and scientific documentation and served as a template for users submitting data to the GHFDB. It was further developed into the currently valid data and metadata standard in 2023, which also introduced an enhanced quality evaluation framework (Fuchs et al., 2023). The ongoing assessment work and the latest release of the GHFDB (Global Heat Flow Database Assessment Group et al., 2024), along with its frequent use, revealed the need for additional refinements. These refinements were particularly necessary in aspects related to metadata consistency, measurement techniques, and classification criteria. Consequently, further updates were implemented to improve the reliability and applicability of the dataset, ensuring a more robust evaluation of global heat-flow data. Here, we present the 2026.03 version of the GHFDB Data Template. The previous template introduced by Fuchs et al. (2023) has been improved based on the latest data ass6ssment process. The current version of the template incorporates the advancements in data collection methodologies, the IHFC quality evaluation framework, and metadata management, ensuring that data submitted to the GHFDB follows the IHFC standards for the GHFDB. A changelog is available and a summary of changes is also provided in the data descripton file (PDF). To promote open access, the template is also hosted on the official GitHub repository of the IHFC: https://github.com/ihfc-iugg. Users can download both the original version from 2023 and the revised templates. Version 2025.06 is also available in the previous-versions folder of this data publication. Maintaining the GHFDB Data Template in a version-controlled environment ensures transparency regarding changes over time and fosters a documentation style that sets high standards to support the reproducibility of research results. Moreover, it supports a smooth and fast integration of data from the research community into the Global Heat Flow Database of the IHFC.

Heat Flow Quality Analysis Toolbox (hfqa_tool)

Heat Flow Quality Analysis Toolbox hfqa_tool is a Python package containing tools for validating and evaluating the quality of heat flow data. It is designed for researchers and professionals. hfqa_tool simplifies heat flow data analysis by providing standardized and reproducible quality checks. This is developed in compliance with the paper by Fuchs et al. (2023) titled "Quality-assurance of heat-flow data: The new structure and evaluation scheme of the IHFC Global Heat Flow Database," published in Tectonophysics 863: 229976. Also revised for the newer release 2024. There are mainly 2 functions defined in this tool with description as follows: vocabulary_check(): This set of code has been developed to check whether all the values entered in a Heatflow database adhere to a controlled vocabulary and proper structure described in the aforementioned scientific paper. It generates an error message for each entry where the value entered is out of bounds and does not meet the assigned criteria. The code also enables checking the vocabulary for multiple values entered in a single column for a particular Heatflow data entry. It's a recommended prerequisite before calculating 'Quality Scores' for a given Heatflow dataset. quality_scores(): This code has been developed to assess the quality of the Heatflow database in terms of U-score (Uncertainty quantification), M-Score (Methodological quality), and P-Flags (Perturbation effects) adhering to the data structure described in the aforementioned scientific paper.

Viscosity of pure and mixed NaCl and CaCl2 aqueous solutions at 293 K to 353 K and 0.1 MPa

This project has been funded by the German Federal Ministry for the Environment, Nature Conservation, Nuclear Safety and Consumer Protection (BMUV, grant agreement No. 0325217), the European Union's Horizon 2020 Research and Innovation Programme (grant agreement No. 850626) and the Helmholtz Association. In the context of the German national geoscientific large-scale infrastructure project GeoLaB (https://www.geolab.kit.edu/english/index.php). This data publication presents newly acquired viscosity data for synthetic aqueous solutions of sodium chloride (NaCl) and calcium chloride (CaCl₂), which have been prepared in a single salt and mixed form. The solutions covered a wide range of concentrations and mixing ratios representative of those encountered in geothermal settings. The data presented here span temperatures between 293 K and 353 K at ambient pressure. The measured data were obtained at the Laboratory for Fluid physics at GFZ German Research Centre for Geosciences.

Density of pure and mixed NaCl and CaCl2 aqueous solutions at 293 K to 353 K and 0.1 MPa

This study, which has been funded by the German Federal Ministry for the Environment, Nature Conservation, Nuclear Safety and Consumer Protection (BMUV, grant agreement No. 0325217), the European Union's Horizon 2020 Research and Innovation Programme (grant agreement No. 850626) and the Helmholtz Association in the framework of the national German geoscientific large-scale infrastructure project GeoLaB (https://www.geolab.kit.edu/english/index.php), reports on newly acquired density data of synthetic aqueous solutions of sodium chloride (NaCl) and calcium chloride (CaCl₂), which have been prepared in a single salt and mixed form. The solutions span a wide range of concentrations and mixing ratios that are geothermally encountered. The data presented here cover temperatures between 293 K and 353 K at ambient pressure. The measured data were obtained at the Laboratory for Fluid Physics at the GFZ German Research Centre for Geosciences.

Hydrochemichal analysis thermal water Bad Blumau, Austria

The main objective of the work package 2 of the REFLECT project is to characterise relevant fluid properties and their reactions for saline fluids (type C). One of the specific goals was to collect fluid samples from several saline fluids from geothermal sites across Europe, determine their properties, and thus contribute to the Fluid Atlas (WP3). Additionally, the REFLECT team will compare those field data with data from lab experiments performed at near natural conditions. Samples of type C fluids were taken from several sites in Germany, Austria, Belgium and the Netherlands. The samples were analysed for major and minor ions, dissolved gases and isotopes. At the geothermal site Blumau in Austria five thermal water samples were taken by Hydroisotop at the production and injection well, as well as after the heat exchanger on 29th of June 2020. Besides the hydrochemical composition, dissolved gases, the heavy metal content, DOC and stable isotopes (18O, 2H, 13C-DIC) were analysed. Additionally, three thermal water samples were taken by the operator on 09th of March 2021 and sent to Hydroisotop for DOC measurements. The dataset contains analysis results associated with the research project reflect. It is a comma separated file (csv) containing the following columns: Location,Country,Description,Laboratory,Lab No.,Sampling date,Temperature at sampling (degC),Spec. electr. conductivity (25 degC) at sampling,Spec. electr. conductivity (25 degC) Lab. (muS/cm),pH value at sampling,pH value Lab.,Temperature Lab. (degC),Dissolved oxygen content (mg/l),Redox potential (mV),Alkalinity (pH 4.3) Lab. (mmol/l),Sodium (mg/l),Potassium (mg/l),Calcium (mg/l),Magnesium (mg/l),Ammonium (mg/l),Hydrogen carbonate (mg/l),Chloride (mg/l),Sulphate (mg/l),Nitrate (mg/l),Nitrite (mg/l),Antimony (mg/l),Barium (mg/l),Boron (mg/l),Bromide (mg/l),Fluoride (mg/l),Iodide (mg/l),Molybdenum (mg/l),Ortho-phosphate (mg/l),Selenium (mg/l),Strontium (mg/l),Sulphide total (mg/l),Aluminium (mg/l),Arsenic (mg/l),Lead (mg/l),Cadmium (mg/l),Chromium total (mg/l),Cobalt (mg/l),Iron total (mg/l),Copper (mg/l),Nickel (mg/l),Mercury (mg/l),Zinc (mg/l),Tin (mg/l),DOC (mg/l),Hydrogen (Nml/kg),Oxygen (Nml/kg),Nitrogen (Nml/kg),Carbon dioxide (Nml/kg),Methane (Nml/kg),Ethane (Nml/kg),Propane (Nml/kg),Butane (Nml/kg),Pentane (Nml/kg),Ethene (Nml/kg),Propene (Nml/kg),Helium (Nml/kg),Argon (Nml/kg),Sum Gases (Nml/kg),Oxygen-18 d18O-H2O (per mille VSMOW),Deuterium d2H-H2O (per mille VSMOW),Deuterium-excess (per mille VSMOW),Carbon-13 d13C-DIC (per mille VPDB) Methods are described in the accompanying deliverable Fluid data of geothermal sites (type C).

Hydrochemical analysis thermal water Neustadt-Glewe, Germany

The main objective of the work package 2 of the REFLECT project is to characterise relevant fluid properties and their reactions for saline fluids (type C). One of the specific goals was to collect fluid samples from several saline fluids from geothermal sites across Europe, determine their properties, and thus contribute to the Fluid Atlas (WP3). Additionally, the REFLECT team will compare those field data with data from lab experiments performed at near natural conditions. Samples of type C fluids were taken from several sites in Germany, Austria, Belgium and the Netherlands. The samples were analysed for major and minor ions, dissolved gases and isotopes. At Neustadt-Glewe one thermal water sample was taken by GFZ on June 02, 2021 and sent to Hydroisotop for analysis of main cations, anions, heavy metals, DOC, gases and isotopes (18O, 2H, 18O-SO4, 2H, 13C-DIC, 13C-CO2, 13C-CH4, 13C-CxHy, 2H-CH4, 34S-SO4, 34S-H2S, 2H-CH4). There was too little H2S in sample 363469 to conduct the 34S-H2S measurement. The dataset contains analysis results associated with the research project REFLECT. It is a comma separated file (csv) containing the following columns: Location,Country,Description,Laboratory (Lab.),Lab. No.,Sampling date,Spec. electr. conductivity (25 degC) Lab.,pH value Lab.,Temperature Lab. (degC),Alkalinity (pH 4.3) Lab. (mmol/l),Sodium (mg/l),Potassium (mg/l),Calcium (mg/l),Magnesium (mg/l),Ammonium (mg/l),Hydrogen carbonate (mg/l),Chloride (mg/l),Sulphate (mg/l),Nitrate (mg/l),Antimony (mg/l),Barium (mg/l),Fluoride (mg/l),Iodide (mg/l),Lithium (mg/l),Silicon (mg/l),Strontium (mg/l),Aluminium (mg/l),Arsenic (mg/l),Lead (mg/l),Chromium total (mg/l),Iron total (mg/l),Copper (mg/l),Manganese total (mg/l),Nickel (mg/l),Uranium (mg/l),Zinc (mg/l),DOC (mg/l),Hydrogen (Nml/kg),Oxygen (Nml/kg),Nitrogen (Nml/kg),Carbon dioxide (Nml/kg),Methane (Nml/kg),Ethane (Nml/kg),Propane (Nml/kg),Butane (Nml/kg),Pentane (Nml/kg),Helium (Nml/kg),Argon (Nml/kg),Sum Gases (Nml/kg),Oxygen-18 d18O-H2O (per mille VSMOW),Deuterium d2H-H2O (per mille VSMOW),Deuterium-excess (per mille VSMOW),Carbon-13 d13C-DIC (per mille VPDB),Sulphur-34 d34S-SO4 (per mille V-CDT),Oxygen-18 d18O-SO4 (per mille VSMOW),Carbon-13 d13C-CO2 (per mille VPDB),Carbon-13 d13C-CH4 (per mille VPDB),Deuterium d2H-CH4 (per mille VSMPW),Carbon-13 d13C-C2H6 (per mille VPDB),Carbon-13 d13C-C3H8 (per mille VPDB),Carbon-13 d13C-i-C4H10 (per mille VPDB),Carbon-13 d13C-n-C4H10 (per mille VPDB) Methods are described in the accompanying deliverable Fluid data of geothermal sites (type C) .

Hydrochemichal analysis thermal water Gross Schoenebeck, Germany

The main objective of the work package 2 of the REFLECT project is to characterise relevant fluid properties and their reactions for saline fluids (type C). One of the specific goals was to collect fluid samples from several saline fluids from geothermal sites across Europe, determine their properties, and thus contribute to the Fluid Atlas (WP3). Additionally, the REFLECT team will compare those field data with data from lab experiments performed at near natural conditions. Samples of type C fluids were taken from several sites in Germany, Austria, Belgium and the Netherlands. The samples were analysed for major and minor ions, dissolved gases and isotopes. In order to gain information about the increased methane content (about 65 vol-%) in the gas samples of the Groß Schönebeck production well (GrSk05/05) collected in February 2021 as compared to previous samples in 2010-2018 (10-14 vol-%), three gas samples were sampled by GFZ on 02 March 2021 at the valve at the wellhead when releasing the pressure from the wellhead. Main gas composition was measured by GFZ indicating again predominantly CH4 (63,9-64,2 Vol-%) followed by N2 (30,9 – 31,2 vol.-%) with minor amounts of H2 (3,4 vol-%) and CO2 (0,01-0,04 vol-%). Potential reasons for the increased methane content could be either microbial activity or contribution of fluid / gas from a different source within the reservoir. To determine the origin of methane, therefore, isotope analyses were performed. The samples arrived at Hydroisotop on March 13th 2021 for the analysis of higher hydrocarbons (C2-C5) and their isotopic composition (13C-CO2, 13C -CH4, 13C-CxHy and 2H-CH4). Together with the measured high amounts of higher hydrocarbons (ethane, propane etc.) they indicate a rather thermogenic source of the hydrocarbons. To better clarify the question of the source of methane, additionally, two downhole water samples from two different depths (1500 and 4000 m) were taken by GFZ on 09th and 10th of June 2021 and sent to Hydroisotop for analysis of main cations and anions, heavy metals, trace elements and isotopes (13C-CH4) in July 2021. The water sample composition resembles those of earlier measurements of samples collected in Groß Schönebeck (e.g. Regenspurg et al., 2010). However, since the well had not been in operation for a while a depth differentiation between the sample from 4000 m and the one from 1500 m is obvious. This was already visible by the black precipitate observed in the 4000 m sample, whereas the sample at 1500 m showed da reddish precipitate of presumably iron oxides. It should be noted that the nitrate content of the water samples is unusually high since reducing conditions are expected. This could have been caused by air contact of the sample and subsequent oxidation. Furthermore, a reduced silicon content shows in sample 365871 compared to sample 365870. Given the high temperature of the well, the higher silicon content is more plausible. The dataset contains analysis results associated with the research project REFLECT. It is a comma separated file (csv) containing the following columns: Location,Country,Description,Laboratory (Lab.),Lab. No.,Sampling date,Sodium (mg/l),Potassium (mg/l),Calcium (mg/l),Magnesium (mg/l),Chloride (mg/l),Sulphate (mg/l),Nitrate (mg/l),Antimony (mg/l),Barium (mg/l),Bromide (mg/l),Fluoride (mg/l),Iodide (mg/l),Lithium (mg/l),Silicon (mg/l),Strontium (mg/l),Aluminium (mg/l),Arsenic (mg/l),Lead (mg/l),Copper (mg/l),Manganese total (mg/l),Nickel (mg/l),Uranium (mg/l),Zinc (mg/l),Ethane (vpm),Propane (vpm),i-Butane (vpm),n-Butane (vpm),i-Pentane (vpm),n-Pentane (vpm),Ethene (vpm),Propene (vpm),1-Butene (vpm),Carbon-13 d13C-CO2 (per mille VPDB),Carbon-13 d13C-CH4 (per mille VPDB),Deuterium d2H-CH4 (per mille VPDB),Carbon-13 d13C-C2H6 (per mille VPDB),Carbon-13 d13C-C3H8 (per mille VPDB),Carbon-13 d13C-i-C4H10 (per mille VPDB),Carbon-13 d13C-n-C4H10 (per mille VPDB) Methods are described in the accompanying deliverable Fluid data of geothermal sites (type C).

Hydrochemical analysis thermal water Wildbad-Einoed, Austria

The main objective of the work package 2 of the REFLECT project is to characterise relevant fluid properties and their reactions for saline fluids (type C). One of the specific goals was to collect fluid samples from several saline fluids from geothermal sites across Europe, determine their properties, and thus contribute to the Fluid Atlas (WP3). Additionally, the REFLECT team will compare those field data with data from lab experiments performed at near natural conditions. Samples of type C fluids were taken from several sites in Germany, Austria, Belgium and the Netherlands. The samples were analysed for major and minor ions, dissolved gases and isotopes. On 29th and 30th of April 2021 five thermal water samples were taken by Hydroisotop from five different springs/wells located at Wildbad-Einöd. The samples were analysed for hydrochemical composition, heavy metals and dissolved organic carbon (DOC) content. It can be noted that the bromide content of sample 361625 is much lower than the bromide content in the other four springs. Since the chloride content in all springs is the same order of magnitude and Cl/Br ratios are expected to be similar in the same The dataset contains analysis results associated with the research project REFLECT. It is a comma separated file (csv) containing the following columns: Location,Country,Description,Laboratory (Lab.),Lab. No.,Sampling date,Temperature at sampling (degC),Spec. electr. conductivity (25 degC) at sampling (muS/cm),Spec. electr. conductivity (25 degC) Lab. (muS/cm),pH value at sampling,pH value Lab.,Temperature Lab. (degC),Dissolved oxygen content (mg/l),Redox potential (mV),Base capacity (pH 8.2) (mmol/l),Alkalinity (pH 4.3) on site (mmol/l),Alkalinity (pH 4.3) Lab. (mmol/l),Sodium (mg/l),Potassium (mg/l),Calcium (mg/l),Magnesium (mg/l),Ammonium (mg/l),Hydrogen carbonate (mg/l),Chloride (mg/l),Sulphate (mg/l),Nitrate (mg/l),Nitrite (mg/l),Bromide (mg/l),Fluoride (mg/l),Iodide (mg/l),Lithium (mg/l),Silicon (mg/l),Strontium (mg/l),Iron total (mg/l),Manganese total (mg/l),DOC (mg/l) Methods are described in the accompanying deliverable Fluid data of geothermal sites (type C)

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