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Recognizing and Validating Structural Processes in Geochemical Data: Examples from a Diamondiferous Kimberlite and a Regional Lake Sediment Geochemical Survey

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Compositional Data Analysis (CoDaWork 2015)

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Abstract

Geochemical data are compositional in nature and are subject to the problems typically associated with data that are restricted in real positive number space, the simplex. Geochemistry is a proxy for mineralogy, and minerals are comprised of atomically ordered structures that define the placement and abundance of elements in the mineral lattice structure. The arrangement of elements within one or more minerals that comprise rocks, soils, and surficial sediments define a linear model in the Euclidean geometry of real space in terms of their geochemical expression. When methods such as principal component analysis are applied to multielement geochemical data, the dominant components generally reflect features related to mineralogy and describe geologic processes that are both independent and partially codependent. The dominant principal components can be used as a filter to eliminate noise or under-sampled processes in the data. These dominant components can be used to create predictive geological maps, or maps displaying recognizable geochemical processes. Using these techniques, we demonstrate that stoichiometrically controlled geochemical processes can be “discovered” and “validated” from two sets of data, one derived from drill-hole lithogeochemistry of a series of kimberlite eruptions and a second from a suite of granitic, metamorphic, volcanic, and sedimentary rocks.

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Acknowledgments

The authors would like to thank the organizers of the CoDaWork15 meeting for inviting this contribution. In particular the authors wish to thank Santi Thió-Henestrosa and Josep Antoni Martín Fernández of the University of Girona for their support and guidance. Also, discussions and valuable advice from Vera Pawlowsky-Glahn (University of Girona) and Juan Jose Egozcue (Polytechnical University of Catalonia) is gratefully acknowledged. We thank Vera Pawlowsky-Glahn and an anonymous reviewer for their helpful comments, which improved the manuscript.

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Correspondence to E. C. Grunsky .

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Appendix A: Summary of the First Seven Principal Components Derived from the Logcentered Lake Sediment Geochemistry

Appendix A: Summary of the First Seven Principal Components Derived from the Logcentered Lake Sediment Geochemistry

Eigenvalues

PC1

PC2

PC3

PC4

PC5

PC6

PC7

\(\uplambda \)

10.63

8.21

4.21

3.17

2.87

2.07

1.58

\(\uplambda \% \)

23.63

18.25

9.36

7.05

6.38

4.60

3.51

\(\Sigma \uplambda \%\)

23.63

41.89

51.25

58.29

64.67

69.28

72.79

figure b
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Grunsky, E.C., Kjarsgaard, B.A. (2016). Recognizing and Validating Structural Processes in Geochemical Data: Examples from a Diamondiferous Kimberlite and a Regional Lake Sediment Geochemical Survey. In: Martín-Fernández, J., Thió-Henestrosa, S. (eds) Compositional Data Analysis. CoDaWork 2015. Springer Proceedings in Mathematics & Statistics, vol 187. Springer, Cham. https://doi.org/10.1007/978-3-319-44811-4_7

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