Spectral libraries for quantitative analyses of tropical Brazilian soils: Comparing vis–NIR and mid-IR reflectance data

Reflectance spectroscopy has great potential to monitor and evaluate soils at large scale; however, its effectiveness in predicting properties from tropical soils still needs to be tested since their mineralogy, organic matter levels, and charge and ion adsorption dynamics are different from temperate soils. Also, it is important to assess the most appropriate spectral range for quantification of specific soil property. Therefore, this study aimed to predict physical, chemical, and mineralogical soil properties using vis–NIR (350–2500 nm) and mid-IR (4000–400 cm− 1) spectral libraries and statistically compare their modeling performances. We used 1259 soil samples distributed along four Brazilian States. Soil particle size, chemical analyses including macro and micronutrients, and oxides from sulfuric acid digestion were performed. Vis–NIR reflectance data were obtained by the FieldSpec Pro sensor while mid-IR data were collected using the Nicolet 6700 FT-IR sensor. Support Vector Machine was used as multiple regression algorithm and modeling performance was evaluated by R2, RMSE and RPIQ. This research presented a complete prediction analysis of soil properties important for survey, classification, and fertility management. Models fit very well (0.76 ≤ R2 ≤ 0.90 and 2.81 ≤ RPIQ ≤ 5.62) for sand, clay, Al3+, H + Al3+, CEC, clay activity, Fe2O3, and TiO2 predictions, and showed reasonable performance (0.50 ≤ R2 ≤ 0.73 and 1.83 ≤ RPIQ ≤ 3.78) for OC, Ca, Mg, SB, V%, m%, pH in H2O, oxides (Si, Al, and Mn), and Cu and Mn (micronutrients). Phosphorus, potassium and some micronutrients (Fe and B) were not reliably quantified (R2 ≤ 0.47 and RPIQ ≤ 1.83). For both spectral ranges, performance indices were kept in testing steps, and no atypical distribution pattern was identified by residual analysis. Statistically, mid-IR spectral models showed better performance for 60% of the studied properties. For some oxides (Al, Fe, Ti, and Mn), vis–NIR models were better. Models developed from vis–NIR and mid-IR spectral libraries are effective and useful to quantify properties suggesting soil mineralogy, reactivity, fertility and acidity of tropical Brazilian soils; however, mid-IR is the greatest potential spectral range. The excellent results of clay (0.85 ≤ R2 ≤ 0.88 and 3.88 ≤ RPIQ ≤ 5.56) and sand (0.85 ≤ R2 ≤ 0.90 and 4.85 ≤ RPIQ ≤ 5.62) modeling prove that at least soil particle size analyses can be efficiently replaced by the reflectance spectroscopy methods.

[1]  R. V. Rossel,et al.  Spectral soil analysis and inference systems : A powerful combination for solving the soil data crisis , 2006 .

[2]  R. J. Hanks,et al.  REFLECTION OF RADIANT ENERGY FROM SOILS , 1965 .

[3]  A. McBratney,et al.  Critical review of chemometric indicators commonly used for assessing the quality of the prediction of soil attributes by NIR spectroscopy , 2010 .

[4]  T. Nguyen,et al.  Diffuse reflectance infrared Fourier transform (DRIFT) spectroscopy in soil studies , 1991 .

[5]  E. R. Stoner,et al.  Characteristic variations in reflectance of surface soils , 1981 .

[6]  Keith D. Shepherd,et al.  Prediction of Soil Fertility Properties from a Globally Distributed Soil Mid-Infrared Spectral Library , 2010 .

[7]  L. K. Sørensen,et al.  Determination of Clay and Other Soil Properties by Near Infrared Spectroscopy , 2005 .

[8]  A. McBratney,et al.  A soil science renaissance , 2008 .

[9]  R. M. Lark,et al.  Improved analysis and modelling of soil diffuse reflectance spectra using wavelets , 2009 .

[10]  James B. Reeves,et al.  The potential of mid- and near-infrared diffuse reflectance spectroscopy for determining major- and trace-element concentrations in soils from a geochemical survey of North America. , 2009 .

[11]  K. Oinuma,et al.  Infrared study of mixed-layer clay minerals , 1965 .

[12]  Sabine Grunwald,et al.  Modeling of Soil Organic Carbon Fractions Using Visible–Near‐Infrared Spectroscopy , 2009 .

[13]  B. Minasny,et al.  Regional transferability of mid-infrared diffuse reflectance spectroscopic prediction for soil chemical properties , 2009 .

[14]  H. Beecher,et al.  The potential of near-infrared reflectance spectroscopy for soil analysis — a case study from the Riverine Plain of south-eastern Australia , 2002 .

[15]  W. White Infrared characterization of water and hydroxyl ion in the basic magnesium carbonate minerals , 1971 .

[16]  Kening Wu,et al.  Micronutrients in Soils, Crops, and Livestock , 2008 .

[17]  John W. Salisbury,et al.  Emissivity of terrestrial materials in the 8-14 microns atmospheric window , 1992 .

[18]  L. Janik,et al.  Can mid infrared diffuse reflectance analysis replace soil extractions , 1998 .

[19]  K. Shepherd,et al.  Development of Reflectance Spectral Libraries for Characterization of Soil Properties , 2002 .

[20]  R. V. Rossel,et al.  Using data mining to model and interpret soil diffuse reflectance spectra. , 2010 .

[21]  Balwant Singh,et al.  Ultra-violet, visible, near-infrared, and mid-infrared diffuse reflectance spectroscopic techniques to predict several soil properties , 2005 .

[22]  E. R. Stoner,et al.  REFLECTANCE PROPERTIES OF SOILS , 1986 .

[23]  Alex B. McBratney,et al.  Using a legacy soil sample to develop a mid-IR spectral library , 2008 .

[24]  R. V. Rossel,et al.  Visible, near infrared, mid infrared or combined diffuse reflectance spectroscopy for simultaneous assessment of various soil properties , 2006 .

[25]  Raphael Bragança Alves Fernandes,et al.  Quantificação de óxidos de ferro de Latossolos brasileiros por espectroscopia de refletância difusa , 2004 .

[26]  James B. Reeves,et al.  Near- versus mid-infrared diffuse reflectance spectroscopy for soil analysis emphasizing carbon and laboratory versus on-site analysis: Where are we and what needs to be done? , 2010 .

[27]  I. Bertrand,et al.  The rapid assessment of concentrations and solid phase associations of macro- and micronutrients in alkaline soils by mid-infrared diffuse reflectance spectroscopy , 2002 .

[28]  José Alexandre Melo Demattê,et al.  Visible–NIR reflectance: a new approach on soil evaluation , 2004 .

[29]  Keith D. Shepherd,et al.  Soil condition classification using infrared spectroscopy: A proposition for assessment of soil condition along a tropical forest-cropland chronosequence , 2008 .

[30]  José Alexandre Melo Demattê,et al.  Soil spectral library and its use in soil classification , 2010 .

[31]  David M. Sherman,et al.  Electronic spectra of Fe3+ oxides and oxide hydroxides in the near IR to near UV , 1985 .

[32]  J. Demattê,et al.  Spectral Reflectance Methodology in Comparison to Traditional Soil Analysis , 2006 .

[33]  R. V. Rossel,et al.  In situ measurements of soil colour, mineral composition and clay content by vis–NIR spectroscopy , 2009 .

[34]  Eyal Ben-Dor,et al.  Near-Infrared Analysis as a Rapid Method to Simultaneously Evaluate Several Soil Properties , 1995 .

[35]  M. Vohland,et al.  Comparing different multivariate calibration methods for the determination of soil organic carbon pools with visible to near infrared spectroscopy , 2011 .

[36]  José Alexandre Melo Demattê,et al.  Spectral pedology: A new perspective on evaluation of soils along pedogenetic alterations , 2014 .

[37]  F. Bergaya,et al.  Infrared Spectroscopy Study of Tetrahedral and Octahedral Substitutions in an Interstratified Illite-Smectite Clay , 1994 .

[38]  E. Ben-Dor,et al.  Laboratory, field and airborne spectroscopy for monitoring organic carbon content in agricultural soils , 2007 .

[39]  M. D. Dyar,et al.  Reflectance and emission spectroscopy study of four groups of phyllosilicates: smectites, kaolinite-serpentines, chlorites and micas , 2008, Clay Minerals.

[40]  G. McCarty,et al.  Mid‐ and Near‐Infrared Spectroscopic Determination of Carbon in a Diverse Set of Soils from the Brazilian National Soil Collection , 2005 .

[41]  W. R. Horwath,et al.  NIR and DRIFT-MIR spectrometry of soils for predicting soil and crop parameters in a flooded field , 2003, Plant and Soil.

[42]  P. Hostert,et al.  Free iron oxide determination in Mediterranean soils using diffuse reflectance spectroscopy. , 2009 .

[43]  J. Stoorvogel,et al.  Pedology, precision agriculture, and the changing paradigm of agricultural research , 1999 .

[44]  Alexander F. H. Goetz,et al.  Rapid gangue mineral concentration measurement over conveyors by NIR reflectance spectroscopy , 2009 .

[45]  Rick L. Lawrence,et al.  Comparing local vs. global visible and near-infrared (VisNIR) diffuse reflectance spectroscopy (DRS) calibrations for the prediction of soil clay, organic C and inorganic C , 2008 .

[46]  James B. Reeves,et al.  COMPARISON OF NEAR INFRARED AND MID INFRARED DIFFUSE REFLECTANCE SPECTROSCOPY FOR FIELD-SCALE MEASUREMENT OF SOIL FERTILITY PARAMETERS , 2006 .

[47]  Ewald Schnug,et al.  Estimation of Some Chemical Properties of an Agricultural Soil by Spectroradiometric Measurements , 2008 .

[48]  H. W. Van der Marel,et al.  Atlas of Infrared Spectroscopy of Clay Minerals and Their Admixtures , 1976 .

[49]  N. Fageria,et al.  Micronutrients in Crop Production , 2002 .

[50]  G. Hunt Visible and near-infrared spectra of minerals and rocks : I silicate minerals , 1970 .

[51]  P. Komadel,et al.  Baseline studies of the clay minerals society source clays: Infrared methods , 2001 .

[52]  Jeffrey W. White,et al.  Interfacing Geographic Information Systems with Agronomic Modeling: A Review , 1999 .

[53]  Andrew Rawson,et al.  The prediction of soil chemical and physical properties from mid-infrared spectroscopy and combined partial least-squares regression and neural networks (PLS-NN) analysis , 2009 .

[54]  E. Ben-Dor,et al.  A Novel Method of Classifying Soil Profiles in the Field using Optical Means , 2008 .

[55]  James B. Reeves,et al.  Mid- and near-infrared spectroscopic assessment of soil compositional parameters and structural indices in two Ferralsols , 2006 .

[56]  David J. Chittleborough,et al.  Visible near-infrared reflectance spectroscopy as a predictive indicator of soil properties , 2011 .

[57]  J. Salisbury,et al.  Emissivity of terrestrial materials in the 3–5 μm atmospheric window☆ , 1992 .

[58]  G. McCarty,et al.  Mid-Infrared and Near-Infrared Diffuse Reflectance Spectroscopy for Soil Carbon Measurement , 2002 .

[59]  J. Deckers,et al.  World Reference Base for Soil Resources , 1998 .

[60]  Richard Webster,et al.  Discrimination of Australian soil horizons and classes from their visible–near infrared spectra , 2011 .