Skip to main content

Multivariate Data

  • Chapter
  • First Online:
Book cover Road from Geochemistry to Geochemometrics
  • 604 Accesses

Abstract

Each object of multivariate data distributed in a multidimensional space is characterised by a set of measurements corresponding to each variable. Obviously, as we have already seen (Chap. 9), if we are dealing with bivariate data corresponding to two variables, a plot on a piece of paper or computer screen can show their behaviour. Their graphical representation becomes difficult and, in fact, impossible when we want to visualise four or more dimensions. Therefore, we must learn alternate techniques for the handling of multivariate data. We describe the dimension-reducing multivariate technique of linear discriminant analysis (LDA) and illustrate it from agricultural chemistry data. One surprising result was that the isometric log-ratio transformation did not provide any improvement with respect to the use of concentration data. The chapter ends with the description of multiple linear regression exemplified from UV absorbance data.

This is a preview of subscription content, log in via an institution to check access.

Access this chapter

Chapter
USD 29.95
Price excludes VAT (USA)
  • Available as PDF
  • Read on any device
  • Instant download
  • Own it forever
eBook
USD 84.99
Price excludes VAT (USA)
  • Available as EPUB and PDF
  • Read on any device
  • Instant download
  • Own it forever
Softcover Book
USD 109.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info
Hardcover Book
USD 159.99
Price excludes VAT (USA)
  • Durable hardcover edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info

Tax calculation will be finalised at checkout

Purchases are for personal use only

Institutional subscriptions

References

  • Agrawal, S., Guevara, M., & Verma, S. P. (2008). Tectonic discrimination of basic and ultrabasic rocks through log-transformed ratios of immobile trace elements. International Geology Review, 50, 1057–1079.

    Article  Google Scholar 

  • Aitchison, J. (1986). The statistical analysis of compositional data. London, UK: Chapman and Hall.

    Book  Google Scholar 

  • Barnett, V., & Lewis, T. (1994). Outliers in statistical data. Chichester: Wiley.

    Google Scholar 

  • Egozcue, J. J., Pawlowsky-Glahn, V., Mateu-Figueras, G., & Barceló-Vidal, C. (2003). Isometric logratio transformations for compositional data analysis. Mathematical Geology, 35, 279–300.

    Article  Google Scholar 

  • Miller, J. N., & Miller, J. C. (2005). Statistics and chemometrics for analytical chemistry (5th ed.). Essex, England: Pearson Prentice Hall.

    Google Scholar 

  • Morrison, D. F. (1990). Multivariate statistical methods. New York: McGraw-Hill Publishing Co.

    Google Scholar 

  • Phuong, T. D., Chuong, P. V., Khiem, D. T., & Kokot, S. (1999). Elemental content of Vietnamese rice. Part 1. Sampling, analysis and comparison with previous studies. Analyst, 124, 553–560.

    Article  Google Scholar 

  • Reyment, R. A., & Savazzi, E. (1999). Aspects of multivariate statistical analysis in geology. Amsterdam: Elsevier.

    Google Scholar 

  • Verma, S. P. (2012). Geochemometrics. Revista Mexicana de Ciencias Geológicas, 29, 276–298.

    Google Scholar 

  • Verma, S. P. (2015). Monte Carlo comparison of conventional ternary diagrams with new log-ratio bivariate diagrams and an example of tectonic discrimination. Geochemical Journal, 49, 393–412.

    Article  Google Scholar 

  • Verma, S. P., & Agrawal, S. (2011). New tectonic discrimination diagrams for basic and ultrabasic volcanic rocks through log-transformed ratios of high field strength elements and implications for petrogenetic processes. Revista Mexicana de Ciencias Geológicas, 28, 24–44.

    Google Scholar 

  • Verma, S. P., & Armstrong-Altrin, J. S. (2013). New multi-dimensional diagrams for tectonic discrimination of siliciclastic sediments and their application to Precambrian basins. Chemical Geology, 355, 117–133.

    Article  Google Scholar 

  • Verma, S. P., & Díaz-González, L. (2012). Application of the discordant outlier detection and separation system in the geosciences. International Geology Review, 54, 593–614.

    Article  Google Scholar 

  • Verma, S. P., & Rivera-Gómez, M. A. (2017). Transformed major element based multidimensional classification of altered volcanic rocks. Episodes, 40, 295–303.

    Article  Google Scholar 

  • Verma, S. P., Verma, S. K., & Oliveira, E. P. (2015). Application of 55 multi-dimensional tectonomagmatic discrimination diagrams to Precambrian belts. International Geology Review, 57, 1365–1388.

    Article  Google Scholar 

  • Verma, S. P., Rivera-Gómez, M. A., Díaz-González, L., & Quiroz-Ruiz, A. (2016). Log-ratio transformed major-element based multidimensional classification for altered high-Mg igneous rocks. Geochemistry, Geophysics, Geosystems, 17, 4955–4972.

    Article  Google Scholar 

  • Verma, S. P., Verma, S. K., Rivera-Gómez, M. A., Torres-Sánchez, D., Díaz-González, L., Amezcua-Valdez, A., et al. (2018). Statistically coherent calibration of X-ray fluorescence spectrometry for major elements in rocks and minerals. Journal of Spectroscopy, 2018, 13, Article ID 5837214. https://doi.org/10.1155/2018/5837214.

    Article  Google Scholar 

  • Verma, S. P., Rosales-Rivera, M., Rivera-Gómez, M. A., & Verma, S. K. (2019). Comparison of matrix-effect corrections for ordinary and uncertainty weighted linear regressions and determination of major element mean concentrations and total uncertainties of 62 international geochemical reference materials from wavelength-dispersive X-ray fluorescence spectrometry. In Colloquium Spectroscopicum Internationale XLI (CSI XLI) and I Latin-American Meeting on Laser Induced Breakdown Spectroscopy (I LAMLIBS). Mexico City.

    Google Scholar 

Download references

Author information

Authors and Affiliations

Authors

Corresponding author

Correspondence to Surendra P. Verma .

Rights and permissions

Reprints and permissions

Copyright information

© 2020 Springer Nature Singapore Pte Ltd.

About this chapter

Check for updates. Verify currency and authenticity via CrossMark

Cite this chapter

Verma, S.P. (2020). Multivariate Data. In: Road from Geochemistry to Geochemometrics. Springer, Singapore. https://doi.org/10.1007/978-981-13-9278-8_10

Download citation

Publish with us

Policies and ethics