Effects of Improved 17O Correction on Interlaboratory Agreement in Clumped Isotope Calibrations, Estimates of Mineral-Specific Offsets, and Temperature Dependence of Acid Digestion Fractionation

Petersen, S. V.; Defliese, W. F.; Saenger, C.; Daëron, M.; Huntington, K. W.; John, C. M.; Kelson, J. R.; Bernasconi, S. M.; Colman, A. S.; Kluge, T.; Olack, G. A.; Schauer, A. J.; Bajnai, D.; Bonifacie, M.; Breitenbach, S. F.  M.; Fiebig, J.; Fernandez, A. B.; Henkes, G. A.; Hodell, D.; Katz, A.; Kele, S.; Lohmann, K. C.; Passey, B. H.; Peral, M. Y.; Petrizzo, D. A.; Rosenheim, B. E.; Tripati, A.; Venturelli, R.; Young, E. D.; Winkelstern, I. Z.

doi:10.1029/2018gc008127

Title: Effects of Improved ¹⁷O Correction on Interlaboratory Agreement in Clumped Isotope Calibrations, Estimates of Mineral-Specific Offsets, and Temperature Dependence of Acid Digestion Fractionation

Journal Article · Fri May 31 00:00:00 EDT 2019 · Geochemistry, Geophysics, Geosystems

DOI:https://doi.org/10.1029/2018gc008127· OSTI ID:1611378

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Univ. of Michigan, Ann Arbor, MI (United States)
Texas A & M Univ., College Station, TX (United States); Univ. of California, Los Angeles, CA (United States)
Univ. of Washington, Seattle, WA (United States)
Lab. des Sciences du Climat et de l'Environnement, Gif‐sur‐Yvette (France)
Imperial College, London (United Kingdom)
ETH‐Zurich (Switzerland)
Univ. of Chicago, IL (United States)
Heidelberg Univ. (Germany)
Goethe‐Univ., Frankfurt am Main (Germany)
Inst. de Physique du Globe, Paris (France)
Ruhr‐Univ., Bochum (Germany); Cambridge Univ. (United Kingdom)
Stony Brook Univ., NY (United States)
Cambridge Univ. (United Kingdom)
Hungarian Academy of Sciences, Budapest (Hungary)
Jet Propulsion Lab., Pasadena, CA (United States)
Univ. of South Florida, St. Petersburg, FL (United States)
Univ. of California, Los Angeles, CA (United States)
Grand Valley State Univ., Allendale, MI (United States)

The clumped isotopic composition of carbonate-CO₂ (denoted Δ₄₇) is a function of carbonate formation temperature and in natural samples can act as a recorder of paleoclimate, burial, or diagenetic conditions. The absolute abundance of heavy isotopes in the universal standards VPDB and VSMOW (defined by four parameters: R ¹³_VPDB, R¹⁷_VSMOW, R ¹⁸_VSMOW, and λ) impact calculated Δ₄₇ values. In this work, we investigate whether use of updated and more accurate values for these parameters can remove observed interlaboratory differences in the measured T-Δ₄₇ relationship. Using the updated parameters, we reprocess 14 published calibration data sets measured in 11 different laboratories, representing many mineralogies, bulk compositions, sample types, reaction temperatures, and sample preparation and analysis methods. Exploiting this large composite data set (n = 1,253 sample replicates), we investigate the possibility for a “universal” clumped isotope calibration. We find that applying updated parameters improves the T-Δ₄₇ relationship (reduces residuals) within most labs and improves overall agreement but does not eliminate all interlaboratory differences. We reaffirm earlier findings that different mineralogies do not require different calibration equations and that cleaning procedures, method of pressure baseline correction, and mass spectrometer type do not affect interlaboratory agreement. We also present new estimates of the temperature dependence of the acid digestion fractionation for Δ₄₇ (Δ*_25-X), based on combining reprocessed data from four studies, and new theoretical equilibrium values to be used in calculation of the empirical transfer function. Overall, we have ruled out a number of possible causes of interlaboratory disagreement in the T-Δ₄₇ relationship, but many more remain to be investigated.

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Research Organization:: Univ. of California, Los Angeles, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences, and Biosciences Division; National Science Foundation (NSF)

Grant/Contract Number:: SC0010288; EAR-1156134; 1713275; 093831

OSTI ID:: 1611378

Alternate ID(s):: OSTI ID: 1543367

Journal Information:: Geochemistry, Geophysics, Geosystems, Vol. 20, Issue 7; ISSN 1525-2027

Publisher:: American Geophysical UnionCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 124 works

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Quantifying kinetic fractionation in Bunker Cave speleothems using Δ47 Kluge, Tobias; Affek, Hagit P. Quaternary Science Reviews, Vol. 49 https://doi.org/10.1016/j.quascirev.2012.06.013	journal	August 2012
Defining an absolute reference frame for ‘clumped’ isotope studies of CO2 Dennis, Kate J.; Affek, Hagit P.; Passey, Benjamin H. Geochimica et Cosmochimica Acta, Vol. 75, Issue 22 https://doi.org/10.1016/j.gca.2011.09.025	journal	November 2011
Equilibrium and nonequilibrium oxygen isotope effects in synthetic carbonates Kim, Sang-Tae; O'Neil, James R. Geochimica et Cosmochimica Acta, Vol. 61, Issue 16 https://doi.org/10.1016/S0016-7037(97)00169-5	journal	August 1997
Clumped Isotope Calibration Data from Winkelstern et al. 2016, reprocessed as part of a community calibration effort Petersen, Sierra; Winkelstern, Ian; Lohmann, Kyger Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111317	dataset	January 2019
Clumped Isotope Calibration Data from Defliese et al. 2015, reprocessed as part of a community calibration effort Petersen, Sierra; Defliese, William; Lohmann, Kyger Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111318	dataset	January 2019
Clumped Isotope Calibration Data from Kluge et al. 2015, reprocessed as part of a community calibration effort Petersen, Sierra; John, Cedric; Kluge, Tobias Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111319	dataset	January 2019
Clumped Isotope Calibration Data from Garcia de Real et al. 2016, reprocessed as part of a community calibration effort Petersen, Sierra; John, Cedric Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111320	dataset	January 2019
Clumped Isotope Calibration Data from Kelson et al. 2017, reprocessed as part of a community calibration effort Petersen, Sierra; Kelson, Julia; Huntington, Katharine Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111321	dataset	January 2019
Clumped Isotope Calibration Data from Tang et al. 2014, reprocessed as part of a community calibration effort Petersen, Sierra; Rosenheim, Brad; Venturelli, Ryan Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111322	dataset	January 2019
Clumped Isotope Calibration Data from Fernandez et al. 2014, reprocessed as part of a community calibration effort Petersen, Sierra; Fernandez, Alvaro; Rosenheim, Brad Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111323	dataset	January 2019
Clumped Isotope Calibration Data from Passey and Henkes 2012, reprocessed as part of a community calibration effort Petersen, Sierra; Passey, Benjamin; Henkes, Gregory Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111324	dataset	January 2019
Clumped Isotope Calibration Data from Henkes et al. 2013, reprocessed as part of a community calibration effort Petersen, Sierra; Henkes, Gregory; Passey, Benjamin Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111325	dataset	January 2019
Clumped Isotope Calibration Data from Peral et al. 2018, reprocessed as part of a community calibration effort Petersen, Sierra; Peral, Marion; Daeron, Mathieu Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111326	dataset	January 2019
Clumped Isotope Calibration Data from Wacker et al. 2014, reprocessed as part of a community calibration effort Petersen, Sierra; Fiebig, Jens; Bajnai, David Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111327	dataset	January 2019
Clumped Isotope Calibration Data from Petrizzo et al. 2014, reprocessed as part of a community calibration effort Petersen, Sierra; Petrizzo, Daniel; Young, Edward Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111328	dataset	January 2019
Clumped Isotope Calibration Data from Katz et al. 2017, reprocessed as part of a community calibration effort Petersen, Sierra; Katz, Amandine; Bonifacie, Magalie Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111329	dataset	January 2019
Clumped Isotope Calibration Data from Breitenbach et al. 2018, reprocessed as part of a community calibration effort Petersen, Sierra; Breitenbach, Sebastian; Hodell, David Interdisciplinary Earth Data Alliance (IEDA) https://doi.org/10.1594/ieda/111330	dataset	January 2019

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Exploring the Temperature Dependence of Clumped Isotopes in Modern Porites Corals Guo, Yangrui; Deng, Wenfeng; Wei, Gangjian Journal of Geophysical Research: Biogeosciences, Vol. 125, Issue 1 https://doi.org/10.1029/2019jg005402	journal	January 2020
Southern high-latitude warmth during the Jurassic–Cretaceous: New evidence from clumped isotope thermometry Vickers, Madeleine L.; Bajnai, David; Price, Gregory D. Geology, Vol. 47, Issue 8 https://doi.org/10.1130/g46263.1	journal	May 2019
The DeepMIP contribution to PMIP4: methodologies for selection, compilation and analysis of latest Paleocene and early Eocene climate proxy data, incorporating version 0.1 of the DeepMIP database Hollis, Christopher J.; Dunkley Jones, Tom; Anagnostou, Eleni Geoscientific Model Development, Vol. 12, Issue 7 https://doi.org/10.5194/gmd-12-3149-2019	journal	January 2019

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