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Title: Quantifying uncertainty in stable isotope mixing models

Journal Article · · Journal of Geophysical Research. Biogeosciences
DOI:https://doi.org/10.1002/2014JG002839· OSTI ID:1221608
 [1];  [1];  [2];  [2];  [2];  [2];  [2];  [3]
  1. EnviroLogic Inc., Durango, CO (United States)
  2. Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
  3. Univ. of California, Santa Barbara, CA (United States)

Mixing models are powerful tools for identifying biogeochemical sources and determining mixing fractions in a sample. However, identification of actual source contributors is often not simple, and source compositions typically vary or even overlap, significantly increasing model uncertainty in calculated mixing fractions. This study compares three probabilistic methods, SIAR [Parnell et al., 2010] a pure Monte Carlo technique (PMC), and Stable Isotope Reference Source (SIRS) mixing model, a new technique that estimates mixing in systems with more than three sources and/or uncertain source compositions. In this paper, we use nitrate stable isotope examples (δ15N and δ18O) but all methods tested are applicable to other tracers. In Phase I of a three-phase blind test, we compared methods for a set of six-source nitrate problems. PMC was unable to find solutions for two of the target water samples. The Bayesian method, SIAR, experienced anchoring problems, and SIRS calculated mixing fractions that most closely approximated the known mixing fractions. For that reason, SIRS was the only approach used in the next phase of testing. In Phase II, the problem was broadened where any subset of the six sources could be a possible solution to the mixing problem. Results showed a high rate of Type I errors where solutions included sources that were not contributing to the sample. In Phase III some sources were eliminated based on assumed site knowledge and assumed nitrate concentrations, substantially reduced mixing fraction uncertainties and lowered the Type I error rate. These results demonstrate that valuable insights into stable isotope mixing problems result from probabilistic mixing model approaches like SIRS. The results also emphasize the importance of identifying a minimal set of potential sources and quantifying uncertainties in source isotopic composition as well as demonstrating the value of additional information in reducing the uncertainty in calculated mixing fractions.

Research Organization:
Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)
Sponsoring Organization:
USDOE
Grant/Contract Number:
AC52-06NA25396
OSTI ID:
1221608
Report Number(s):
LA-UR-15-23883
Journal Information:
Journal of Geophysical Research. Biogeosciences, Vol. 120, Issue 5; ISSN 2169-8953
Publisher:
American Geophysical UnionCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 42 works
Citation information provided by
Web of Science

References (65)

A Test of Goodness of Fit journal December 1954
O 2 and H 2 O are each the source of one O in NO 2 produced from NH 3 by Nitrosomonas : 15 N-NMR evidence journal December 1983
Isotopic Apportionment of Atmospheric and Sewage Nitrogen Sources in Two Connecticut Rivers journal September 2007
Land-use controls on sources and processing of nitrate in small watersheds: insights from dual isotopic analysis journal October 2010
Resource polygon geometry predicts Bayesian stable isotope mixing model bias journal November 2014
The Distribution of Nutrients in the Costa rica dome in the Eastern Tropical Pacific Ocean journal April 1965
Analysis of δ 15 N and δ 18 O to differentiate NO 3 sources in runoff at two watersheds in the Catskill Mountains of New York : DUAL-ISOTOPE ANALYSIS journal May 2002
Measurement of the Oxygen Isotopic Composition of Nitrate in Seawater and Freshwater Using the Denitrifier Method journal October 2002
Oxygen Isotopes in Nitrite:  Analysis, Calibration, and Equilibration journal March 2007
Nitrate sources and watershed denitrification inferred from nitrate dual isotopes in the Beijiang River, south China journal April 2009
Evaluation of contamination sources of groundwater NO3 − using nitrogen isotope data: A review journal March 2003
Long-Term Impacts of Agriculture on soil Carbon and Nitrogen in new England Forests journal August 2000
Influence of diet on the distribution of nitrogen isotopes in animals journal March 1981
Variations in the δ15N and δ18O values of nitrate in drainage water of two fertilized fields in Mecklenburg-Vorpommern (Germany) journal May 2005
Minmax solutions for underdetermined isotope mixing problems: Reply to Semmens et al. (2013) journal September 2013
Alternative approaches for solving underdetermined isotope mixing problems journal January 2013
Dissolved Solids-Discharge Relationships: 1. Mixing Models journal June 1970
Mass balance and isotope effects during nitrogen transport through septic tank systems with packed-bed (sand) filters journal December 2008
Source of the oxygen atoms of nitrate in the oxidation of nitrite by Nitrobacter agilis and evidence against a PON anhydride mechanism in oxidative phosphorylation journal September 1984
Modelling streamwater chemistry as a mixture of soilwater end-members — An application to the Panola Mountain catchment, Georgia, U.S.A. journal August 1990
Infiltration mechanisms related to agricultural waste transport through the soil mantle to karst aquifers of southern Indiana, USA journal January 1995
Identification of nitrate and sulfate sources in groundwater using dual stable isotope approaches for an agricultural area with different land use (Chuncheon, mid-eastern Korea) journal August 2009
Atmospheric Oxygen: Isotopic Composition and Solubility Fractionation journal January 1972
New Approaches to Water-Resources Investigations in Upstate New Yorkaa journal October 1967
Assessment of the Sources of Nitrate in the Changjiang River, China Using a Nitrogen and Oxygen Isotopic Approach journal March 2010
The oxygen isotope composition of nitrate generated by nitrification in acid forest floors journal August 2001
Chemical Conversion of Nitrate and Nitrite to Nitrous Oxide for Nitrogen and Oxygen Isotopic Analysis in Freshwater and Seawater journal September 2005
Regional Patterns in the Isotopic Composition of Natural and Anthropogenic Nitrate in Groundwater, High Plains, U.S.A. journal May 2006
Limitations of Using δ 18 O for the Source Identification of Nitrate in Agricultural Soils journal May 2001
Nitrate contamination of alluvial groundwaters in the Nakdong River basin, Korea journal March 2002
Evaluating the utility of 15N and 18O isotope abundance analyses to identify nitrate sources: A soil zone study journal August 2012
Incorporating uncertainty and prior information into stable isotope mixing models journal May 2008
Evaluating Regional Patterns in Nitrate Sources to Watersheds in National Parks of the Rocky Mountains using Nitrate Isotopes journal September 2008
Spatial distribution of nitrate sources of rivers in the Lake Biwa watershed, Japan: Controlling factors revealed by nitrogen and oxygen isotope values: NITRATE SOURCES OF RIVERS IN THE LAKE BIWA WATERSHED journal July 2010
Isotopic Evidence of Nitrate Sources and Denitrification in the Mississippi River, Illinois journal March 2006
Sources and fate of nitrate in the Illinois River Basin, Illinois journal September 2008
Source Partitioning Using Stable Isotopes: Coping with Too Much Variation journal March 2010
Uncertainty in source partitioning using stable isotopes journal April 2001
Source partitioning using stable isotopes: coping with too many sources journal July 2003
Incorporating concentration dependence in stable isotope mixing models journal January 2002
Combining sources in stable isotope mixing models: alternative methods journal February 2005
Best practices for use of stable isotope mixing models in food-web studies journal October 2014
Determination of the ground-water component of peak discharge from the chemistry of total runoff journal April 1969
Perchlorate in Pleistocene and Holocene Groundwater in North-Central New Mexico journal March 2006
Comparison of hydrochemical tracers to estimate source contributions to peak flow in a small, forested, headwater catchment journal July 1998
Nitrogen-15 and Oxygen-18 Natural Abundance of Potassium Chloride Extractable Soil Nitrate Using the Denitrifier Method journal March 2007
Combined use of 15N and 18O of nitrate and 11B to evaluate nitrate contamination in groundwater journal September 2005
A Bacterial Method for the Nitrogen Isotopic Analysis of Nitrate in Seawater and Freshwater journal September 2001
A new method for collection of nitrate from fresh water and the analysis of nitrogen and oxygen isotope ratios journal February 2000
Tracking Sources of Unsaturated Zone and Groundwater Nitrate Contamination Using Nitrogen and Oxygen Stable Isotopes at the Hanford Site, Washington journal May 2005
To fit or not to fit: evaluating stable isotope mixing models using simulated mixing polygons journal April 2013
Stable Oxygen Isotope Ratios of Nitrate Produced from Nitrification: 18 O-Labeled Water Incubations of Agricultural and Temperate Forest Soils journal July 2010
Identifying and assessing uncertainty in hydrological pathways: a novel approach to end member mixing in a Scottish agricultural catchment journal April 2003
Tracing the Sources of Exported Nitrate in the Turkey Lakes Watershed Using 15 N/ 14 N and 18 O/ 16 O isotopic ratios journal September 2001
The isotopic composition of nitrate produced from nitrification in a hardwood forest floor journal August 2007
A user's guide to Sandia's latin hypercube sampling software : LHS UNIX library/standalone version. report July 2004
Judgment under Uncertainty: Heuristics and Biases journal September 1974
Sources of nitrate and ammonium contamination in groundwater under developing Asian megacities journal October 2008
Fertilizer Characterization:  Isotopic Data (N, S, O, C, and Sr) journal June 2004
Source identification of nitrate by means of isotopic tracers in the Baltic Sea catchments journal January 2006
Including Source Uncertainty and Prior Information in the Analysis of Stable Isotope Mixing Models journal June 2010
Evaluation of the origin and fate of nitrate in the Abbotsford Aquifer using the isotopes of15N and18O in NO3− journal July 1995
Tracking the Sources of Nitrate in Groundwater Using Coupled Nitrogen and Boron Isotopes:  A Synthesis journal January 2005
18O isotopic separation of stream nitrate sources in mid-Appalachian forested watersheds journal October 2001
Present limitations and future prospects of stable isotope methods for nitrate source identification in surface- and groundwater journal March 2009

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