<?xml version="1.0" encoding="UTF-8"?><!--*** Generated from internal PANGAEA metadata schema by dif.xslt ***--><DIF xsi:schemaLocation="http://gcmd.gsfc.nasa.gov/Aboutus/xml/dif/ http://gcmd.gsfc.nasa.gov/Aboutus/xml/dif/dif_v9.4.xsd" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns="http://gcmd.gsfc.nasa.gov/Aboutus/xml/dif/">
<Entry_ID>PANGAEA_995632</Entry_ID>
<Entry_Title>Seawater carbonate chemistry and boron isotope ratios in marine bivalve shells</Entry_Title>
<Data_Set_Citation>
<Dataset_Creator>Thatcher, Diana L; Stewart, Joseph A; LaVigne, M; Williams, Branwen; Whitney, Nina M; Giss, Maya; McMahon, Teagan; Jellison, Brittany M; Guay, Katherine; Franklin, Heidi; Wanamaker, Alan D</Dataset_Creator>
<Dataset_Title>Seawater carbonate chemistry and boron isotope ratios in marine bivalve shells</Dataset_Title>
<Dataset_Release_Date>2026-06-22</Dataset_Release_Date>
<Dataset_Publisher>PANGAEA</Dataset_Publisher>
<Data_Presentation_Form>Dataset</Data_Presentation_Form>
<Online_Resource>https://doi.pangaea.de/10.1594/PANGAEA.995632</Online_Resource>
</Data_Set_Citation>
<Personnel>
<Role>Investigator</Role>
<First_Name>Diana L</First_Name>
<Last_Name>Thatcher</Last_Name>
<Email>thatcher@iastate.edu</Email>
</Personnel>
<Personnel>
<Role>Investigator</Role>
<First_Name>Yan</First_Name>
<Last_Name>Yang</Last_Name>
<Email>yangyan@xmu.edu.cn</Email>
</Personnel>
<Discipline>
<Discipline_Name>Earth Science</Discipline_Name>
</Discipline>
<Parameters>
<Detailed_Variable>Event label</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Type of study</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Sample ID</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Species, unique identification</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Species, unique identification (URI)</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Species, unique identification (Semantic URI)</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Sample comment</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Temperature, water</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>pH, total scale</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Salinity</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>δ11B</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Boron/Calcium ratio</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>pH, difference</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Carbon, inorganic, dissolved</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Carbon, inorganic, dissolved, standard deviation</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Alkalinity, total</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Alkalinity, total, standard deviation</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Aragonite saturation state</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Aragonite saturation state, standard deviation</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Calcite saturation state</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Calcite saturation state, standard deviation</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Partial pressure of carbon dioxide (water) at sea surface temperature (wet air)</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Carbonate system computation flag</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Carbon dioxide</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Fugacity of carbon dioxide (water) at sea surface temperature (wet air)</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Partial pressure of carbon dioxide (water) at sea surface temperature (wet air)</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Bicarbonate ion</Detailed_Variable>
</Parameters>
<Parameters>
<Detailed_Variable>Carbonate ion</Detailed_Variable>
</Parameters>
<ISO_Topic_Category>geoscientificInformation</ISO_Topic_Category>
<Keyword>Acid-base regulation</Keyword>
<Keyword>Animalia</Keyword>
<Keyword>Arctica islandica</Keyword>
<Keyword>Benthic animals</Keyword>
<Keyword>Benthos</Keyword>
<Keyword>Coast and continental shelf</Keyword>
<Keyword>Jonesport</Keyword>
<Keyword>Laboratory experiment</Keyword>
<Keyword>Mercenaria mercenaria</Keyword>
<Keyword>Mollusca</Keyword>
<Keyword>Mya arenaria</Keyword>
<Keyword>North Atlantic</Keyword>
<Keyword>Ocean acidification</Keyword>
<Keyword>Placopecten magellanicus</Keyword>
<Keyword>Single species</Keyword>
<Keyword>Temperate</Keyword>
<Keyword>Temperature</Keyword>
<Sensor_Name>
<Long_Name>Calculated with seacarb package in R</Long_Name>
</Sensor_Name>
<Sensor_Name>
<Long_Name>Calculated using seacarb after Nisumaa et al. (2010)</Long_Name>
</Sensor_Name>
<Temporal_Coverage>
<Start_Date>2021-09-01</Start_Date>
<Stop_Date>2021-09-30</Stop_Date>
</Temporal_Coverage>
<Data_Set_Progress>Complete</Data_Set_Progress>
<Spatial_Coverage>
<Southernmost_Latitude>44.5541</Southernmost_Latitude>
<Northernmost_Latitude>44.5541</Northernmost_Latitude>
<Westernmost_Longitude>-67.2697</Westernmost_Longitude>
<Easternmost_Longitude>-67.2697</Easternmost_Longitude>
</Spatial_Coverage>
<Project>
<Short_Name>OA-ICC</Short_Name>
<Long_Name>Ocean Acidification International Coordination Centre</Long_Name>
</Project>
<Access_Constraints>unrestricted</Access_Constraints>
<Use_Constraints>CC-BY-4.0: Creative Commons Attribution 4.0 International</Use_Constraints>
<Data_Set_Language>English</Data_Set_Language>
<Data_Center>
<Data_Center_Name>
<Short_Name>PANGAEA</Short_Name>
<Long_Name>Data Publisher for Earth &amp; Environmental Science</Long_Name>
</Data_Center_Name>
<Data_Center_URL>https://www.pangaea.de/</Data_Center_URL>
<Personnel>
<Role>Data Center Contact</Role>
<First_Name>Michael</First_Name>
<Last_Name>Diepenbroek</Last_Name>
<Email>info@pangaea.de</Email>
<Contact_Address>
<Address>Leobener Str.</Address>
<City>Bremen</City>
<Province_or_State>Bremen</Province_or_State>
<Postal_Code>28359</Postal_Code>
<Country>Germany</Country>
</Contact_Address>
</Personnel>
</Data_Center>
<Distribution>
<Distribution_Media>online</Distribution_Media>
<Distribution_Size>3101 data points</Distribution_Size>
<Distribution_Format>text/tab-separated-values</Distribution_Format>
</Distribution>
<Reference>Thatcher, Diana L; Stewart, Joseph A; LaVigne, M; Williams, Branwen; Whitney, Nina M; Giss, Maya; McMahon, Teagan; Jellison, Brittany M; Guay, Katherine; Franklin, Heidi; Wanamaker, Alan D (2026): Controls on boron isotope ratios in marine bivalve shells: Insights from a controlled experiment across pH and temperature gradients. Geochimica et Cosmochimica Acta, S0016703726002619, https://doi.org/10.1016/j.gca.2026.04.035</Reference>
<Reference>Thatcher, Diana L; LaVigne, Michele; Wanamaker, Alan D; Williams, Branwen; Jellison, Brittany M; McMahon, Teagan; Whitney, Nina M; Stewart, Joseph A (2026): Boron isotope data from bivalves from 2022 tank experiment in the Gulf of Maine, USA [dataset]. Biological and Chemical Oceanography Data Management Office (BCO-DMO), https://www.bco-dmo.org/dataset/995690</Reference>
<Reference>Nisumaa, Anne-Marin; Pesant, Stephane; Bellerby, Richard G J; Delille, Bruno; Middelburg, Jack J; Orr, James C; Riebesell, Ulf; Tyrrell, Toby; Wolf-Gladrow, Dieter A; Gattuso, Jean-Pierre (2010): EPOCA/EUR-OCEANS data compilation on the biological and biogeochemical responses to ocean acidification. Earth System Science Data, 2(2), 167-175, https://doi.org/10.5194/essd-2-167-2010</Reference>
<Reference>Yang, Yan; Brockmann, Patrick; Galdino, Carolina; Schindler, Uwe; Gazeau, Frédéric (2024): An update of data compilation on the biological response to ocean acidification and overview of the OA-ICC data portal. Earth System Science Data, 16(8), 3771-3780, https://doi.org/10.5194/essd-16-3771-2024</Reference>
<Reference>Yang, Yan; Hansson, L; Gattuso, Jean-Pierre (2016): Data compilation on the biological response to ocean acidification: an update. Earth System Science Data, 8(1), 79-87, https://doi.org/10.5194/essd-8-79-2016</Reference>
<Reference>Gattuso, Jean-Pierre; Epitalon, Jean-Marie; Lavigne, Héloïse; Orr, James; Gentili, Bernard; Hagens, Mathilde; Hofmann, Andreas; Mueller, Jens-Daniel; Proye, Aurélien; Rae, James; Soetaert, Karline (2024): seacarb: seawater carbonate chemistry with R. R package version 3.3.3. https://cran.r-project.org/web/packages/seacarb/index.html</Reference>
<Summary>A 20.5-week flowthrough tank experiment was conducted in which four species of commercially important bivalves from the northwest Atlantic Ocean were grown in tanks with controlled pHT (pH 7.4 to 8.0) and temperature conditions (6 to 12 °C). A total of 106 shell samples from 99 individuals of adult and juvenile Arctica islandica (ocean quahog), juvenile Mercenaria mercenaria (northern quahog or hard clam), juvenile Mya arenaria (soft-shell clam), and juvenile Placopecten magellanicus (Atlantic sea scallop) were analyzed from this controlled experiment to assess the seawater pH, temperature, and growth rate controls on shell δ11Bc. 
This dataset is included in the OA-ICC data compilation maintained in the framework of the IAEA Ocean Acidification International Coordination Centre (see https://oa-icc.ipsl.fr). Original data were downloaded from Biological and Chemical Oceanography Data Management Office (BCO-DMO) (see Source) by the OA-ICC data curator. In order to allow full comparability with other ocean acidification data sets, the R package seacarb (Gattuso et al, 2024) was used to compute a complete and consistent set of carbonate system variables, as described by Nisumaa et al. (2010). In this dataset the original values were archived in addition with the recalculated parameters (see related PI). The date of carbonate chemistry calculation by seacarb is 2026-06-23. ** For all details see the full metadata description at "https://doi.pangaea.de/10.1594/PANGAEA.995632"!</Summary>
<Related_URL>
<URL>http://mel.xmu.edu.cn/en/</URL>
</Related_URL>
<Related_URL>
<URL>https://cran.r-project.org/web/packages/seacarb/index.html</URL>
<Description>seacarb: seawater carbonate chemistry with R. R package version 3.3.3</Description>
</Related_URL>
<Related_URL>
<URL>https://doi.org/10.1016/j.gca.2026.04.035</URL>
<Description>Controls on boron isotope ratios in marine bivalve shells: Insights from a controlled experiment across pH and temperature gradients</Description>
</Related_URL>
<Related_URL>
<URL>https://doi.org/10.5194/essd-16-3771-2024</URL>
<Description>An update of data compilation on the biological response to ocean acidification and overview of the OA-ICC data portal</Description>
</Related_URL>
<Related_URL>
<URL>https://doi.org/10.5194/essd-2-167-2010</URL>
<Description>Calculated using seacarb after Nisumaa et al. (2010)</Description>
</Related_URL>
<Related_URL>
<URL>https://doi.org/10.5194/essd-2-167-2010</URL>
<Description>EPOCA/EUR-OCEANS data compilation on the biological and biogeochemical responses to ocean acidification</Description>
</Related_URL>
<Related_URL>
<URL>https://doi.org/10.5194/essd-8-79-2016</URL>
<Description>Data compilation on the biological response to ocean acidification: an update</Description>
</Related_URL>
<Related_URL>
<URL>https://www.bco-dmo.org/dataset/995690</URL>
<Description>Boron isotope data from bivalves from 2022 tank experiment in the Gulf of Maine, USA</Description>
</Related_URL>
<Related_URL>
<URL>https://www.iaea.org/services/oa-icc/science-and-collaboration/data-access-and-management</URL>
<Description>OA-ICC</Description>
</Related_URL>
<Metadata_Name>DIF</Metadata_Name>
<Metadata_Version>9.4</Metadata_Version>
<DIF_Creation_Date>2026-06-22</DIF_Creation_Date>
<Last_DIF_Revision_Date>2026-07-22</Last_DIF_Revision_Date>
</DIF>
