Equilibrium mass-dependent fractionation relationships for triple oxygen isotopes
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The coordination environment of carbonate ions has limited importance in determining κ.
“These are in fact quite close to estimates for CO3 2- (g) from both Cao and Liu (2011) and the present study, suggesting that the coordination environment of carbonate ions has limited importance in determining κ .”
From Theoretical constraints on the effects of added cations on clumped, oxygen, and carbon isotope signatures of dissolved inorganic carbon species and minerals (2020) · cites this paper as Cao and Liu (2011)
At 25°C our value of κ for CO3 2-(g) of 0.52880 is not resolvable from the result of Cao and Liu (2011).
“At 25 ° C our value of κ for CO3 2(g) of 0.52880 is not resolvable from their result.”
From Theoretical constraints on the effects of added cations on clumped, oxygen, and carbon isotope signatures of dissolved inorganic carbon species and minerals (2020) · cites this paper as Cao and Liu (2011)
At 0, 50, 100, and 500°C our κ for CO2(g) (0.52784, 0.52810, 0.52835, and 0.52959) are within ~2x10^-5 of Cao and Liu (2011) results, and our results agree with Guo and Zhou (2019) in seeing very little difference between CO3 2-(aq), HCO3-(aq), and H2CO3(aq).
“At 0, 50, 100, and 500 ° C our κ for CO2(g) (0.52784, 0.52810, 0.52835, and 0.52959) (Table 4) are likewise within ~2x10 -5 of Cao and Liu (2011) results, and our results agree with Guo and Zhou (2019) in seeing very little difference between CO3 2- (aq), HCO3 - (aq), and H2CO3(aq).”
From Theoretical constraints on the effects of added cations on clumped, oxygen, and carbon isotope signatures of dissolved inorganic carbon species and minerals (2020) · cites this paper as Cao and Liu (2011)
Our κ values for CO2(g) and CO3 2-(g) using the B3LYP/6-311++G(2d,2p) method agree very closely with those of Cao and Liu (2011) and Guo and Zhou (2019).
“Our κ values for CO2(g) and CO3 2- (g) using the B3LYP/6-311++G(2d,2p) agree very closely with those of Cao and Liu (2011) and Guo and Zhou (2019), which is not surprising since both studies use very similar electronic structure methods.”
From Theoretical constraints on the effects of added cations on clumped, oxygen, and carbon isotope signatures of dissolved inorganic carbon species and minerals (2020) · cites this paper as Cao and Liu (2011)
Cites
Density-functional thermochemistry. III. The role of exact exchange
Becke, A. D. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464913 · Cited by 103,767 · see citing works
Lee, C., Yang, W., & Parr, R. G. (1988) · Physical Review B · doi:10.1103/physrevb.37.785 · Cited by 100,874 · see citing works
Scott, A. P., & Radom, L. (1996) · The Journal of Physical Chemistry · doi:10.1021/jp960976r · Cited by 6,738 · see citing works
On the Isotopic Chemistry of Carbonates and a Paleotemperature Scale
McCrea, J. M. (1950) · The Journal of Chemical Physics · doi:10.1063/1.1747785 · Cited by 3,742 · see citing works
An Evaluation of Harmonic Vibrational Frequency Scale Factors
Merrick, J. P., Moran, D., & Radom, L. (2007) · The Journal of Physical Chemistry A · doi:10.1021/jp073974n · Cited by 2,735 · see citing works
Oxygen Isotope Fractionation in Divalent Metal Carbonates
O'Neil, J. R., Clayton, R. N., & Mayeda, T. K. (1969) · The Journal of Chemical Physics · doi:10.1063/1.1671982 · Cited by 2,549 · see citing works
The thermodynamic properties of isotopic substances
Urey, H. C. (1947) · Journal of the Chemical Society (Resumed) · doi:10.1039/jr9470000562 · Cited by 2,544 · see citing works
The Energy Levels of a Rotating Vibrator
Dunham, J. L. (1932) · Physical Review · doi:10.1103/physrev.41.721 · Cited by 1,919 · see citing works
Calculation of Equilibrium Constants for Isotopic Exchange Reactions
Bigeleisen, J., & Mayer, M. G. (1947) · The Journal of Chemical Physics · doi:10.1063/1.1746492 · Cited by 1,893 · see citing works
Andersson, M., & Uvdal, P. (2005) · The Journal of Physical Chemistry A · doi:10.1021/jp045733a · Cited by 1,669 · see citing works
Young, E., Galy, Α., & Nagahara, H. (2002) · Geochimica et Cosmochimica Acta · doi:10.1016/s0016-7037(01)00832-8 · Cited by 964 · see citing works
Raman study of CeO2 : Second-order scattering, lattice dynamics, and particle-size effects
Weber, W. H., Hass, K. C., & McBride, J. R. (1993) · Physical review. B, Condensed matter · doi:10.1103/physrevb.48.178 · Cited by 943 · see citing works
Horita, J., & Wesolowski, D. J. (1994) · Geochimica et Cosmochimica Acta · doi:10.1016/0016-7037(94)90096-5 · Cited by 940 · see citing works
Applying Stable Isotope Fractionation Theory to New Systems
Schauble, E. A. (2004) · Reviews in Mineralogy and Geochemistry · doi:10.2138/gsrmg.55.1.65 · Cited by 827 · see citing works
Principles of Stable Isotope Distribution
Criss, R. E. (1999) · doi:10.1093/oso/9780195117752.001.0001 · Cited by 820 · see citing works
Kunkel, J. M., & Machleder, H. I. (1989) · PubMed · Cited by 804 · see citing works
A Component of Primitive Nuclear Composition in Carbonaceous Meteorites
Clayton, R. N., Grossman, L., & Mayeda, T. K. (1973) · Science · doi:10.1126/science.182.4111.485 · Cited by 798 · see citing works
“Clumped-isotope” geochemistry—The study of naturally-occurring, multiply-substituted isotopologues
Eiler, J. M. (2007) · Earth and Planetary Science Letters · doi:10.1016/j.epsl.2007.08.020 · Cited by 774 · see citing works
Richet, P., Bottinga, Y., & Javoy, M. (1977) · Annual Review of Earth and Planetary Sciences · doi:10.1146/annurev.ea.05.050177.000433 · Cited by 773 · see citing works
Thiemens, M. H., & Heidenreich, J. E. (1983) · Science · doi:10.1126/science.219.4588.1073 · Cited by 643 · see citing works
Bottinga, Y. (1968) · The Journal of Physical Chemistry · doi:10.1021/j100849a008 · Cited by 550 · see citing works
High precision measurements of 17 O/ 16 O and 18 O/ 16 O ratios in H 2 O
Barkan, E., & Luz, B. (2005) · Rapid Communications in Mass Spectrometry · doi:10.1002/rcm.2250 · Cited by 493 · see citing works
Schauble, E. A., Ghosh, P., & Eiler, J. M. (2006) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2006.02.011 · Cited by 483 · see citing works
Equilibrium Oxygen, Hydrogen and Carbon Isotope Fractionation Factors Applicable to Geologic Systems
Chacko, T., Cole, D. R., & Horita, J. (2001) · Reviews in Mineralogy and Geochemistry · doi:10.2138/gsrmg.43.1.1 · Cited by 462 · see citing works
Mechanisms of hydrothermal crystallization of quartz at 250°C and 15 kbar
Matsuhisa, Y., Goldsmith, J. R., & Clayton, R. N. (1978) · Geochimica et Cosmochimica Acta · doi:10.1016/0016-7037(78)90130-8 · Cited by 389 · see citing works
Oxygen and carbon isotope fractionations between CO2 and calcite
Chacko, T., Mayeda, T. K., Clayton, R. N., & Goldsmith, J. R. (1991) · Geochimica et Cosmochimica Acta · doi:10.1016/0016-7037(91)90452-b · Cited by 387 · see citing works
Variations of 17O/16O and 18O/16O in meteoric waters
Luz, B., & Barkan, E. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.08.016 · Cited by 355 · see citing works
Triple-isotope composition of atmospheric oxygen as a tracer of biosphere productivity
Luz, B., Barkan, E., Bender, M. L., Thiemens, M. H., & Boering, K. A. (1999) · Nature · doi:10.1038/22987 · Cited by 340 · see citing works
Equilibrium thermodynamics of multiply substituted isotopologues of molecular gases
Wang, Z., Schauble, E. A., & Eiler, J. M. (2004) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2004.05.039 · Cited by 338 · see citing works
The Dole Effect and its variations during the last 130,000 years as measured in the Vostok Ice Core
Bender, M. L., Sowers, T., & Labeyrie, L. D. (1994) · Global Biogeochemical Cycles · doi:10.1029/94gb00724 · Cited by 312 · see citing works
Kieffer, S. W. (1979) · Reviews of Geophysics · doi:10.1029/rg017i001p00001 · Cited by 294 · see citing works
Triple oxygen isotope evidence for elevated CO2 levels after a Neoproterozoic glaciation
Bao, H., Lyons, J. R., & Zhou, C. (2008) · Nature · doi:10.1038/nature06959 · Cited by 286 · see citing works
Schauble, E. A. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.09.044 · Cited by 282 · see citing works
Theoretical estimates of equilibrium Fe-isotope fractionations from vibrational spectroscopy
Schauble, E. A., Rossman, G. R., & Taylor, H. P. (2001) · Geochimica et Cosmochimica Acta · doi:10.1016/s0016-7037(01)00600-7 · Cited by 261 · see citing works
Diffusivity fractionations of HO/HO and HO/HO in air and their implications for isotope hydrology
Barkan, E., & Luz, B. (2007) · Rapid Communications in Mass Spectrometry · doi:10.1002/rcm.3180 · Cited by 256 · see citing works
Farquhar, J., Johnston, D. T., Wing, B. A., Habicht, K. S., Canfield, D. E., Airieau, S., & Thiemens, M. H. (2003) · Geobiology · doi:10.1046/j.1472-4669.2003.00007.x · Cited by 256 · see citing works
Luz, B., & Barkan, E. (2005) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2004.09.001 · Cited by 237 · see citing works
The Use of Electrolysis for Accurate δ17O and δ18O Isotope Measurements in Water
Meijer, H. A. J., & Li, W. J. (1998) · Isotopes in Environmental and Health Studies · doi:10.1080/10256019808234072 · Cited by 226 · see citing works
Isotopic fractionation of Mg2+(aq), Ca2+(aq), and Fe2+(aq) with carbonate minerals
Rustad, J. R., Casey, W. H., Yin, Q., Bylaska, E. J., Felmy, A. R., Bogatko, S. A., Jackson, V. E., & Dixon, D. A. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.08.018 · Cited by 215 · see citing works
Méheut, M., Lazzeri, M., Balan, E., & Mauri, F. (2007) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2007.04.012 · Cited by 213 · see citing works
Record of δ18O and 17O‐excess in ice from Vostok Antarctica during the last 150,000 years
Landais, A., Barkan, E., & Luz, B. (2008) · Geophysical Research Letters · doi:10.1029/2007gl032096 · Cited by 195 · see citing works
High-precision measurements of 17O/16O and 18O/16O ratios in CO2.
Barkan, E., & Luz, B. (2012) · Rapid Communications in Mass Spectrometry · doi:10.1002/rcm.6400 · Cited by 187 · see citing works
Ab initio molecular orbital calculations for boron isotope fractionations on boric acids and borates
Liu, Y., & TOSSELL, J. A. (2005) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2005.04.009 · Cited by 180 · see citing works
Self-citationBigeleisen, J. (1955) · The Journal of Chemical Physics · doi:10.1063/1.1740735 · Cited by 179 · see citing works
The triple isotopic composition of oxygen in leaf water
Landais, A., Barkan, E., Yakir, D., & Luz, B. (2006) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2006.06.1545 · Cited by 177 · see citing works
Theoretical calculation of oxygen isotope fractionation factors in carbonate systems
Chacko, T., & Deines, P. (2008) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2008.06.001 · Cited by 164 · cited 3× · see citing works
“, Richet et al. (1977)) and our calculated jCO2 values.”
BackgroundMethodMéheut, M., Lazzeri, M., Balan, E., & Mauri, F. (2008) · Chemical Geology · doi:10.1016/j.chemgeo.2008.06.051 · Cited by 161 · see citing works
Kinetic 17O effects in the hydrologic cycle: Indirect evidence and implications
Angert, A., Cappa, C. D., & DePaolo, D. J. (2004) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2004.02.010 · Cited by 137 · see citing works
Landais, A., Risi, C., Bony, S., Vimeux, F., Descroix, L., Falourd, S., & Bouygues, A. (2010) · Earth and Planetary Science Letters · doi:10.1016/j.epsl.2010.07.033 · Cited by 136 · see citing works
Angert, A., Rachmilevitch, S., Barkan, E., & Luz, B. (2003) · Global Biogeochemical Cycles · doi:10.1029/2002gb001933 · Cited by 118 · see citing works
A new value for the stable oxygen isotope fractionation between dissolved sulfate ion and water
Zeebe, R. E. (2009) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2009.10.034 · Cited by 114 · see citing works
Anomalous or Mass-Independent Isotope Effects
Weston, R. E. (1999) · Chemical Reviews · doi:10.1021/cr9800154 · Cited by 108 · see citing works
Liu, Q., Tossell, J. A., & Liu, Y. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.09.014 · Cited by 105 · see citing works
Self-citationYung, Y. L., Lee, A., Irion, F. W., et al. (1997) · Journal of Geophysical Research Atmospheres · doi:10.1029/97jd00528 · Cited by 103 · see citing works
Carbon isotope effects in carbonate systems
Deines, P. (2004) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2003.12.002 · Cited by 100 · cited 1× · see citing works
“The b values for carbonates are calculated here using the Einstein–Debye model, which has been used for isotope fractionation calculation since 1950s (e.g., McCrea, 1950; Bottinga, 1968; O’Neil et al., 1969; Kawabe, 1978; Chacko et al., 1991; Deines, 2004; Chacko and Deines, 2008).”
MethodRumble, D., III, Miller, M. F., Franchi, I. A., & Greenwood, R. C. (2007) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2007.05.011 · Cited by 95 · see citing works
Ab initio calculations for equilibrium fractionations in multiple sulfur isotope systems
Otake, T., Lasaga, A. C., & Ohmoto, H. (2008) · Chemical Geology · doi:10.1016/j.chemgeo.2008.01.020 · Cited by 95 · see citing works
Li, X., Zhao, H., Tang, M., & Liu, Y. (2009) · Earth and Planetary Science Letters · doi:10.1016/j.epsl.2009.07.027 · Cited by 90 · see citing works
Self-citationUncertainties in scaling factors forab initiovibrational zero-point energies
Irikura, K. K., Johnson, R. D., Kacker, R. N., & Kessel, R. (2009) · The Journal of Chemical Physics · doi:10.1063/1.3086931 · Cited by 87 · see citing works
Understanding the 17O excess glacial‐interglacial variations in Vostok precipitation
Risi, C., Landais, A., Bony, S., Jouzel, J., Masson‐Delmotte, V., & Vimeux, F. (2010) · Journal of Geophysical Research Atmospheres · doi:10.1029/2008jd011535 · Cited by 86 · see citing works
Kohl, I. E., & Bao, H. (2011) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2011.01.003 · Cited by 85 · see citing works
Multi‐isotope study of the O( 1 D ) + CO 2 exchange and stratospheric consequences
Wen, J., & Thiemens, M. H. (1993) · Journal of Geophysical Research Atmospheres · doi:10.1029/93jd00565 · Cited by 81 · see citing works
Kawabe, I. (1978) · Geochimica et Cosmochimica Acta · doi:10.1016/0016-7037(78)90006-6 · Cited by 81 · see citing works
Calculation of boron-isotope fractionation between B(OH)3(aq) and
Rustad, J. R., Bylaska, E. J., Jackson, V. E., & Dixon, D. A. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.02.032 · Cited by 62 · see citing works
Equilibrium Se isotope fractionation parameters: A first-principles study
Li, X., & Liu, Y. (2011) · Earth and Planetary Science Letters · doi:10.1016/j.epsl.2011.01.022 · Cited by 62 · see citing works
Self-citationLi, X. F., & Liu, Y. (2010) · Chemical Geology · doi:10.1016/j.chemgeo.2010.05.008 · Cited by 55 · see citing works
Self-citationAssonov, S. S., & Brenninkmeijer, C. A. M. (2001) · Rapid Communications in Mass Spectrometry · doi:10.1002/rcm.529 · Cited by 51 · see citing works
Iron isotope fractionation in the Earth’s lower mantle
Rustad, J. R., & Yin, Q. (2009) · Nature Geoscience · doi:10.1038/ngeo546 · Cited by 47 · see citing works
Massive volcanic SO2 oxidation and sulphate aerosol deposition in Cenozoic North America
Bao, H., Yu, S., & Tong, D. (2010) · Nature · doi:10.1038/nature09100 · Cited by 46 · see citing works
Driesner, T., Ha, T., & Seward, T. M. (2000) · Geochimica et Cosmochimica Acta · doi:10.1016/s0016-7037(00)00407-5 · Cited by 45 · see citing works
Technique for High-Precision Analysis of Triple Oxygen Isotope Ratios in Carbon Dioxide
Hofmann, M. E. G., & Pack, A. (2010) · Analytical Chemistry · doi:10.1021/ac902731m · Cited by 45 · see citing works
Zeebe, R. E. (2009) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2009.06.013 · Cited by 41 · see citing works
Gaseous, liquid, and supercritical fluid H2O and CO2: Oxygen isotope fractionation behavior
Rosenbaum, J. M. (1997) · Geochimica et Cosmochimica Acta · doi:10.1016/s0016-7037(97)00362-1 · Cited by 35 · see citing works
Shaheen, R., Abramian, A., Horn, J., Dominguez, G., Sullivan, R., & Thiemens, M. H. (2010) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1014399107 · Cited by 35 · see citing works
Landais, A., Masson‐Delmotte, V., Combourieu‐Nebout, N., et al. (2007) · Earth and Planetary Science Letters · doi:10.1016/j.epsl.2007.03.027 · Cited by 33 · see citing works
Calculation of site-specific carbon-isotope fractionation in pedogenic oxide minerals
Rustad, J. R., & Zarzycki, P. (2008) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.0801571105 · Cited by 30 · see citing works
Oxygen Isotopes in the Early Solar System -- A Historical Perspective
Clayton, R. N. (2008) · Reviews in Mineralogy and Geochemistry · doi:10.2138/rmg.2008.68.2 · Cited by 22 · see citing works
Uemura, R., Abe, O., & Motoyama, H. (2010) · Geochimica et Cosmochimica Acta · doi:10.1016/j.gca.2010.05.007 · Cited by 13 · see citing works
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- Authors
- Cao, X., & Liu, Y.
- Affiliations
- Chinese Academy of Sciences (CN)
- Corresponding author
- Liu, Yun
- ORCID
- Venue
- Geochimica et Cosmochimica Acta
- Publisher
- Elsevier BV
- Published
- 2011-12
- Volume
- 75
- Issue
- 23
- Pages
- 7435-7445
- ISSN
- 0016-7037 (ISSN-L)
- OpenAlex
- W2098488652
- Cited by
- 152
- References
- 78
- Citations by year
- 2026: 3 · 2025: 14 · 2024: 9 · 2023: 8 · 2022: 11 · 2021: 31 · 2020: 17 · 2019: 13 · 2018: 9 · 2017: 9 · 2016: 14 · 2015: 4 · 2014: 6 · 2013: 2 · 2012: 2
- FWCI
- 2.86
- Type
- journal article
- Language
- en
- Open access
- closed
- Locations
- Geochimica et Cosmochimica Acta (publishedVersion)
- Topics
- Physical Sciences › Earth and Planetary Sciences › Geophysics › Geological and Geochemical Analysis
- Physical Sciences › Earth and Planetary Sciences › Geochemistry and Petrology › Groundwater and Isotope Geochemistry
- Physical Sciences › Earth and Planetary Sciences › Paleontology › Paleontology and Stratigraphy of Fossils
- Keywords
- triple oxygen isotopes, mass-dependent fractionation, kappa parameter, carbonates
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