Prediction of volumetric soil organic carbon from field‐moist intact soil cores

This study investigated the potential for visible–near‐infrared (vis–NIR) spectroscopy to predict locally volumetric soil organic carbon (SOC) from spectra recorded from field‐moist soil cores. One hundred cores were collected from a 71‐ha arable field. The vis–NIR spectra were collected every centimetre along the side of the cores to a depth of 0.3 m. Cores were then divided into 0.1‐m increments for laboratory analysis. Reference SOC measurements were used to calibrate three partial least‐squares regression (PLSR) models for bulk density (ρ_b), gravimetric SOC (SOC_g) and volumetric SOC (SOC_v). Accurate predictions were obtained from averages of spectra from those 0.1‐m increments for SOC_g (ratio of performance to inter‐quartile (RPIQ) = 5.15; root mean square error (RMSE) = 0.38%) and SOC_v (RPIQ = 5.25; RMSE = 4.33 kg m^?3). The PLSR model for ρ_b performed least well, but still produced accurate results (RPIQ = 3.76; RMSE = 0.11 Mg m^?3). Predictions for ρ_b and SOC_g were combined to compare indirect and direct predictions of SOC_v. No statistical difference in accuracy between these approaches was detected, suggesting that the direct prediction of SOC_v is possible. The PLSR models calibrated on the 10‐cm depth intervals were also applied to the spectra originally recorded on a 1‐cm depth increment. While a bigger bias was observed for 1‐cm than for 10‐cm predictions (1.13 and 0.19 kg m^?3, respectively), the two populations of estimates were not distinguishable statistically. The study showed the potential for using vis–NIR spectroscopy on field‐moist soil cores to predict SOC at high depth resolutions (1 cm) with locally derived calibrations.     

Influence of the number of samples on prediction error of visible and near infrared spectroscopy of selected soil properties at the farm scale

This paper reports on the influence of the number of samples used for the development of farm‐scale calibration models for moisture content (MC), total nitrogen (TN) and organic carbon (OC) on the prediction error expressed as root mean square error of prediction (RMSEP) for visible and near infrared (vis‐NIR) spectroscopy. Fresh (wet) soil samples collected from four farms in the Czech Republic, Germany, Denmark and the UK were scanned with a fibre‐type vis‐NIR, AgroSpec spectrophotometer with a spectral range of 305–2200 nm. Spectra were divided into calibration (two thirds) and prediction (one third) sets and the calibration spectra were subjected to a partial least squares regression (PLSR) with leave‐one‐out cross‐validation using Unscrambler 7.8 software. The RMSEP values of models with a large sample number (46–84 samples from each farm) were compared with those of models developed with a small sample number (25 samples selected from the large sample set of each farm) for the same variation range. Both large‐set and small‐set models were validated by the same prediction set for each property. Further PLSR analysis was carried out on samples from the German farm, with different sample numbers of the calibration set of 25, 50, 75 and 100 samples. Results showed that the large‐size dataset models resulted in smaller RMSEP values than the small‐size dataset models for all the soil properties studied. The results also demonstrated that with the increase in sample number used in the calibration set, RMSEP decreased in almost linear fashion, although the largest decrease was between 25 and 50 samples. Therefore, it is recommended that the number of samples should be chosen according to the accuracy required, although 50 soil samples is considered appropriate in this study to establish calibration models of TN, OC and MC with smaller expected prediction errors as compared with smaller sample numbers.     

Calibration of visible and near infrared spectroscopy for soil analysis at the field scale on three European farms

The development of accurate calibration models for selected soil properties is a crucial prerequisite for successful implementation of visible and near infrared (Vis‐NIR) spectroscopy for soil analysis. This paper compares the performance of calibration models developed for individual farms with that of general models valid for three farms in three European countries. Fresh soil samples collected from farms in the Czech Republic, Germany and Denmark were scanned with a fibre‐type Vis‐NIR spectrophotometer. After dividing spectra into calibration (70%) and validation (30%) sets, spectra in the calibration set were subjected to partial least squares regression (PLSR) with leave‐one‐out cross‐validation to establish calibration models of soil properties. Except for the Czech Republic farm, individual farm models provided successful calibration for total carbon (TC), total nitrogen (TN) and organic carbon (OC), with coefficients of determination (R²) of 0.85–0.93 and 0.74–0.96 and residual prediction deviations (RPD) of 2.61–3.96 and 2.00–4.95 for the cross‐validation and independent validation respectively. General calibration models gave improved prediction accuracies compared with models of farms in the Czech Republic and Germany, which was attributed to larger ranges in the variation of soil properties in general models compared with those in individual farm models. The results revealed that larger standard deviations (SDs) and wider variation ranges have resulted in larger R² and RPD, but also larger root mean square errors of prediction (RMSEP). Therefore, a compromise solution, which also results in small RMSEP values, should be found when selecting soil samples for Vis‐NIR calibration to cover a wide variation range.     

Simultaneous assessment of key properties of arid soil by combined PXRF and Vis–NIR data

Arid soil is common worldwide and has unique properties that often limit agronomic productivity, specifically, salinity expressed as soluble salts and large amounts of calcium carbonate and gypsum. Currently, the most common methods for evaluating these properties in soil are laboratory‐based techniques such as titration, gasometry and electrical conductivity. In this research, we used two proximal sensors (portable X‐ray fluorescence (PXRF) and visible near‐infrared diffuse reflectance spectroscopy (Vis–NIR DRS)) to scan a diverse set (n = 116) of samples from arid soil in Spain. Then, samples were processed by standard laboratory procedures and the two datasets were compared with advanced statistical techniques. The latter included penalized spline regression (PSR), support vector regression (SVR) and random forest (RF) analysis, which were applied to Vis–NIR DRS data, PXRF data and PXRF and Vis–NIR DRS data, respectively. Independent validation (30% of the data) of the calibration equations showed that PSR + RF predicted gypsum with a ratio of performance to interquartile distance (RPIQ) of 5.90 and residual prediction deviation (RPD) of 4.60, electrical conductivity (1:5 soil : water) with RPIQ of 3.14 and RPD of 2.10, Ca content with RPIQ of 2.92 and RPD of 2.07 and calcium carbonate equivalent with RPIQ of 2.13 and RPD of 1.74. The combined PXRF and Vis–NIR DRS approach was superior to those that use data from a single proximal sensor, enabling the prediction of several properties from two simple, rapid, non‐destructive scans.     

Improving the prediction performance of a large tropical vis‐NIR spectroscopic soil library from Brazil by clustering into smaller subsets or use of data mining calibration techniques

Effective agricultural planning requires basic soil information. In recent decades visible near‐infrared diffuse reflectance spectroscopy (vis‐NIR) has been shown to be a viable alternative for rapidly analysing soil properties. We studied 7172 samples of seven different soil types collected from several regions of Brazil and varying in organic matter (OM) (0.2–10.3%) and clay content (0.2–99.0%). The aim was to explore the possibility of enhancing the performance of vis‐NIR data in predicting organic matter and clay content in this library by dividing it into smaller sub‐libraries on the basis of their vis‐NIR spectra. We used partial least square regression (PLSR) models on the sub‐libraries and compared the results with PLSR and two non‐linear calibration techniques, boosted regression trees (BT) and support vector machines (SVM) applied to the whole library. The whole library calibrations for clay performed well (ME (modelling efficiency) > 0.82; RMSE (root mean squared error) < 10.9%), reflecting the influence of the direct spectral responses of this property in the vis‐NIR range. Calibrations for OM were reasonably good, especially in view of the very small variation in this property (ME > 0.60; RMSE < 0.55%). The best results were, however, found when dividing the large library into smaller subsets by using variation in the mean‐normalized or first derivative spectra. This divided the global data set into clusters that were more uniform in mineralogy, regardless of geographical origin, and improved predictive performance. The best clustering method improved the RMSE in the validation to 8.6% clay and 0.47% OM, which corresponds to a 21% and 15% reduction, respectively, as compared with whole library PLSR. For the whole library, SVM performed almost equally well, reducing RMSE to 8.9% clay and 0.48% OM.     

Transferability and scalability of soil total carbon prediction models in Florida, USA

The applicability, transferability, and scalability of visible/near-infrared (VNIR)-derived soil total carbon (TC) models are still poorly understood. The objectives of this study were to: i) compare models of three multivariate statistical methods, partial least squares regression (PLSR), support vector machine (SVM), and random forest methods, to predict soil logarithm-transformed TC (logTC) using five fields (local scale) and a pooled (regional-scale) VNIR spectral dataset (a total of 560 TC spectral datasets), ii) assess the model transferability among fields, and iii) evaluate their up- and downscaling behaviors in Florida, USA. The transferability and up- and downscaling of the models were limited by the following factors: i) the spectral data domain, ii) soil attribute domain, iii) methods that describe the internal model structure of VNIR-TC relationships, and iv) environmental domain space of attributes that control soil carbon dynamics. All soil logTC models showed excellent performance based on all three methods with R² > 0.86, bias < 0.01%, root mean squared error (RMSE) = 0.09%, residual predication deviation (RPD) > 2.70%, and ratio of prediction error to interquartile range (RPIQ) > 4.54. The PLSR method performed substantially better than the SVM method to scale and transfer the TC models. This could be attributed to the tendency of SVM to overfit models, while the asset of the PLSR method was its robustness when the models were validated with independent datasets, transferred, and/or scaled. The upscaled soil TC models performed somewhat better in terms of model fit (R²), RPD, and RPIQ, whereas the downscaled models showed less bias and smaller RMSE based on PLSR. We found no universal trend indicating which of the four limiting factors mentioned above had the most impact that constrained the transferability and scalability of the models. Given that several factors can impinge on the empirically derived soil spectral prediction models, as demonstrated by this study, more focus on their applicability and scalability is needed.     

Improved estimates of organic carbon using proximally sensed vis–NIR spectra corrected by piecewise direct standardization

We investigated the use of piecewise direct standardization (PDS) to remove the effects of water and other environmental factors from proximally sensed (field) visible–near infrared (vis–NIR) spectra. Our hypothesis was that the PDS‐standardized field spectra can be used to predict soil carbon effectively with calibrations derived from existing spectroscopic databases of spectra recorded in the laboratory on dried, ground and sieved samples. In our experiments we used field spectra recorded in situ with a portable spectrometer at 124 sites in 11 paddy fields in Zhejiang Province, China. We sampled the soil at these same sites, recorded their spectra in the laboratory and measured their soil organic carbon (SOC) contents with a conventional laboratory technique. Two‐thirds of the samples were used to relate the laboratory spectra to SOC by partial least squares regression (PLSR), and the remaining one‐third was used as an independent validation dataset. We selected a representative set of samples from corresponding field and laboratory spectra that we could use as the PDS transfer set. Piecewise direct standardization was used to relate each wavelength in the laboratory spectra to the corresponding wavelength and its neighbours in the field spectra. The field spectra of the validation samples were then corrected with PDS so that they acquired the characteristics of the spectra measured under laboratory conditions. The approach was evaluated by (i) quantifying the similarity between the PDS‐standardized spectra and their corresponding laboratory spectra, (ii) measuring the accuracy of their SOC predictions on the independent validation dataset and (iii) comparing these results with those of direct standardization (DS). Both PDS and DS led to considerable improvements in the predictions of SOC (R² = 0.71, R² = 0.60, respectively), compared with those with original field spectra (R² = 0.03). However, fewer transfer samples were needed with PDS to obtain similar results.     

基于局部加权回归的土壤全氮含量可见-近红外光谱反演

全氮是土壤肥力的重要指标,对作物产量具有决定性作用,采用土壤可见-近红外(Vis-NIR)光谱预测技术及时获取土壤全氮含量信息具有重要意义。采用来自5省的450个土壤样本来验证局部加权回归方法(LWR)结合Vis-NIR光谱技术预测大面积土壤全氮含量的适用性。结果表明,LWR模型的预测效果优于偏最小二乘回归(PLSR)、人工神经网络(ANN)和支持向量机(SVM),选取主成分数为5,相似样本为40时,模型验证的决定系数(RP2)为0.83,均方根误差(RMSEP)为0.25 g kg-1,测定值标准偏差与标准预测误差的比值(RPD)达到2.41。LWR从建模集中选取与验证样本相似的土样作为局部建模样本,降低了差别大的样本对模型的干扰,从而提高了模型的预测能力。因此,LWR建模方法通过大范围、大样本土壤光谱数据进行大尺度区域的全氮等土壤属性预测时能够发挥更好的作用。     

Evaluating a low‐cost portable NIR spectrometer for the prediction of soil organic and total carbon using different calibration models

This study aims to assess the performance of a low‐cost, micro‐electromechanical system‐based, near infrared spectrometer for soil organic carbon (OC) and total carbon (TC) estimation. TC was measured on 151 soil profiles up to the depth of 1 m in NSW, Australia, and from which a subset of 24 soil profiles were measured for OC. Two commercial spectrometers including the AgriSpec^TM (ASD) and NeoSpectra^TM (Neospectra) with spectral wavelength ranges of 350–2,500 and 1,300–2,500 nm, respectively, were used to scan the soil samples, according to the standard contact probe protocol. Savitzky–Golay smoothing filter and standard normal variate (SNV) transformation were performed on the spectral data for noise reduction and baseline correction. Three calibration models, including Cubist tree model, partial least squares regression (PLSR) and support vector machine (SVM), were assessed for the prediction of soil OC and TC using spectral data. A 10‐fold cross‐validation analysis was performed for evaluation of the models and devices accuracies. Results showed that Cubist model predicts OC and TC more accurately than PLSR and SVM. For OC prediction, Cubist showed R² = 0.89 (RMSE = 0.12%) and R² = 0.78 (RMSE = 0.16%) using ASD and NeoSpectra, respectively. For TC prediction, Cubist produced R² = 0.75 (RMSE = 0.45%) and R² = 0.70 (RMSE = 0.50%) using ASD and NeoSpectra, respectively. ASD performed better than NeoSpectra. However, the low‐cost NeoSpectra predictions were comparable to the ASD. These finding can be helpful for more efficient future spectroscopic prediction of soil OC and TC with less costly devices.     

Development of a Near‐Infrared Imaging System for Determination of Rice Moisture

The objective of this study was to develop a near‐infrared (NIR) imaging system to determine rice moisture content. The NIR imaging system fitted with 15 band‐pass filters (wavelengths of 870–1,014 nm) was used to capture the spectral image. In this work, calibration methods including multiple linear regression (MLR), partial least squares regression (PLSR), and artificial neural network (ANN) were used in both near‐infrared spectrometry (NIRS) and the NIR imaging system to determine the moisture content of rice. Comprehensive performance comparison among MLR, PLSR, and ANN approaches has been conducted. To reduce repetition and redundancy in the input data and obtain a more accurate network, six significant wavelengths selected by the MLR model, which had high correlation with the moisture content of rice, were used as the input data of the ANN. The performance of the developed system was evaluated through experimental tests for rice moisture content. This study adopted the coefficient of determination (r_val²), the standard error of prediction (SEP), and the relative performance determinant (RPD) as the performance indices of the NIR imaging system with respect to the tests of rice moisture content. Utilizing these three models, the analysis results of r_val², SEP, and RPD for the validation set were within 0.942–0.952, 0.435–0.479%, and 4.2–4.6, respectively. From experimental results, the performance of NIR imaging system was almost the same as that of NIRS. Using the developed NIR imaging system, all of the three different calibration methods (MLR, PLSR, and ANN) provided a high prediction capacity for the determination of moisture in rice samples. These results indicated that the NIR imaging system developed in this study can be used as a device for the measurement of rice moisture content.     

Quantitative analysis of soil nitrogen and carbon at a farm scale using visible and near infrared spectroscopy coupled with wavelength reduction

Reducing large spectral datasets to parsimonious representations of wavelengths is of value for efficient storage and easing analysis, in addition to the potential to use a simpler and cheaper spectrophotometer. This study evaluated the potential of calibrating visible and near infrared (vis‐NIR) spectra to total nitrogen (N), total carbon (C), organic C and inorganic C in soil on a 15‐ha farm, with the aim of comparing several wavelength reduction algorithms and rates in terms of model prediction accuracy. We explored the uninformative variables elimination (UVE), UVE coupled with successive projections algorithm (SPA) and two uniform‐interval wavelength reduction approaches (UWR‐I and UWR‐II) with successive wavelength reduction rates (WRRs) of 2, 5, 10, 20, 50, 100, 200, 500 and 1000. The standard normal variate (SNV)‐transformed absorbance spectra of soil samples recorded from 400 to 2499 nm at 1‐nm intervals were used. The calibration sets were subjected to a partial least squares regression (PLSR) with leave‐one‐out cross‐validation. Prediction results showed that UVE can reduce wavelength variables significantly while retaining good model prediction accuracy. The UVE‐SPA produced only three or four wavelengths, with which PLSR models achieved competitive prediction performance, compared with those based on all 2100 wavelengths, with coefficient of determination (R²) of 0.91, 0.89, 0.91 and 0.53 and residual prediction deviation (RPD) of 3.53, 2.95, 3.27 and 1.53 for soil total N, total C, organic C and inorganic C, respectively. The UWR tests showed that PLSR models responded insensitively to various WRRs from 2 to 100. The models calibrated for the 100‐nm interval spectra (21 remaining wavelengths) performed almost as well as those for the 1‐nm interval spectra. Although these findings might be valid only at the farm scale, it is recommended that the proposed wavelength reduction algorithms for more soil types and soils originated from larger areas should be examined.     

Optimised use of data fusion and memory-based learning with an Austrian soil library for predictions with infrared data

Infrared spectroscopy in the visible to near-infrared (vis–NIR) and mid-infrared (MIR) regions is a well-established approach for the prediction of soil properties. Different data fusion and training approaches exist, and the optimal procedures are yet undefined and may depend on the heterogeneity present in the set and on the considered scale. The objectives were to test the usefulness of partial least squares regressions (PLSRs) for soil organic carbon (SOC), total carbon (C_t), total nitrogen (N_t) and pH using vis–NIR and MIR spectroscopy for an independent validation after standard calibration (use of a general PLSR model) or using memory-based learning (MBL) with and without spiking for a national spectral database. Data fusion approaches were simple concatenation of spectra, outer product analysis (OPA) and model averaging. In total, 481 soils from an Austrian forest soil archive were measured in the vis–NIR and MIR regions, and regressions were calculated. Fivefold calibration-validation approaches were carried out with a region-related split of spectra to implement independent validations with n ranging from 47 to 99 soils in different folds. MIR predictions were generally superior over vis–NIR predictions. For all properties, optimal predictions were obtained with data fusion, with OPA and spectra concatenation outperforming model averaging. The greatest robustness of performance was found for OPA and MBL with spiking with R² ≥ 0.77 (N), 0.85 (SOC), 0.86 (pH) and 0.88 (C_t) in the validations of all folds. Overall, the results indicate that the combination of OPA for vis–NIR and MIR spectra with MBL and spiking has a high potential to accurately estimate properties when using large-scale soil spectral libraries as reference data. However, the reduction of cost-effectiveness using two spectrometers needs to be weighed against the potential increase in accuracy compared to a single MIR spectroscopy approach.     

Model-Based Integrated Methods for Quantitative Estimation of Soil Salinity from Hyperspectral Remote Sensing Data:A Case Study of Seffected South African Soils

Soil salinization is a land degradation process that leads to reduced agricultural yields. This study investigated the method that can best predict electrical conductivity (EC) in dry soils using individual bands, a normalized difference salinity index (NDSI), partial least squares regression (PLSR), and bagging PLSR. Soil spectral reflectance of dried, ground, and sieved soil samples containing varying amounts of EC was measured using an ASD FieldSpec spectrometer in a darkroom. Predictive models were computed using a training dataset. An independent validation dataset was used to validate the models. The results showed that good predictions could be made based on bagging PLSR using first derivative reflectance (validation R2 = 0.85), PLSR using untransformed reflectance (validation R2 = 0.70), NDSI (validation R2 = 0.65), and the untransformed individual band at 2257 nm (validation R2 = 0.60) predictive models. These suggested the potential of mapping soil salinity using airborne and/or satellite hyperspectral data during dry seasons.     

Accounting for the effects of water and the environment on proximally sensed vis–NIR soil spectra and their calibrations

Visible–near infrared (vis–NIR) spectroscopy can be used to estimate soil properties effectively using spectroscopic calibrations derived from data contained in spectroscopic databases. However, these calibrations cannot be used with proximally sensed (field) spectra because the spectra in these databases are recorded in the laboratory and are different to field spectra. Environmental factors, such as the amount of water in the soil, ambient light, temperature and the condition of the soil surface, cause the differences. Here, we investigated the use of direct standardization (DS) to remove those environmental factors from field spectra. We selected 104 sensing (sampling) sites from nine paddy fields in Zhejiang province, China. At each site, vis–NIR spectra were recorded with a portable spectrometer. The soils were also sampled to record their spectra under laboratory conditions and to measure their soil organic matter (SOM) content. The resulting data were divided into training and validation sets. A subset of the corresponding field and laboratory spectra in the training set (the transfer set) was used to derive the DS transfer matrix, which characterizes the differences between the field and laboratory spectra. Using DS, we transferred the field spectra of the validation samples so that they acquired the characteristics of spectra that were measured in the laboratory. A partial least squares regression (PLSR) of SOM on the laboratory spectra of the training set was then used to predict both the original field spectra and the DS‐transferred field spectra. The assessment statistics of the predictions were improved from R² = 0.25 and RPD = 0.35 to R² = 0.69 and RPD = 1.61. We also performed independent predictions of SOM on the DS‐transferred field spectra with a PLSR derived using the Chinese soil spectroscopic database (CSSD), which was developed in the laboratory. The R² and RPD values of these predictions were 0.70 and 1.79, respectively. Predictions of SOM with the DS‐transferred field spectra were more accurate than those treated with external parameter orthogonalisation (EPO), and more accurate than predictions made by spiking. Our results show that DS can effectively account for the effects of water and environmental factors on field spectra and improve predictions of SOM. DS is conceptually straightforward and allows the use of calibrations made with laboratory‐measured spectra to predict soil properties from proximally sensed (field) spectra, without needing to recalibrate the models.     

Analysis of Fatty Acids in Kernel,Flour, and Oil Samples of Maize by NIR Spectroscopy Using Conventional Regression Methods

High cost and painstaking procedures associated with fatty acid analyses of maize kernel necessitate the use of alternative methods. NIR spectroscopy offers advantages in this respect for a variety of areas such as plant breeding, food and feed industries, and biofuel production, in which different forms of maize kernel (e.g., intact kernel, flour, or oil) are used as material. We investigated the possibility of estimating maize oil quality traits by using different samples (intact kernel, flour, and oil) and conventional regression methods (multiple linear regression [MLR] and partial least squares regression [PLSR]) applied to their NIR spectra. MLR and PLSR calibration models were developed for oleic acid, linoleic acid, oleic/linoleic acid ratios, total monounsaturated fatty acid, total polyunsaturated fatty acid (PUFA), and total saturated fatty acid by analyzing 120 maize samples. Robustness in terms of prediction accuracy of the models developed here was tested with a reserved set of samples (n = 30). The results suggested that fatty acids could be possibly estimated by calibrations developed from flour and oil samples with a high degree of accuracy, whereas intact samples did not offer satisfactory results. PLSR and MLR methods gave better results in flour and oil samples, respectively. PUFA was the trait that was most successfully estimated from both flour (for the PLSR model, standard error of the estimate [SEP] of 1.78%, relative performance to deviation [RPD] of 3.09, R² = 0.93) and oil (for the MLR model, SEP of 0.85%, RPD of 6.52, R² = 0.98) samples. We concluded that sample type and chemometric method should be handled as important factors in calibration development, and the effects of these factors may vary depending on the trait being analyzed.     

Predicting pasture root density from soil spectral reflectance: field measurement

This paper reports the development and evaluation of a field technique for in situ measurement of root density using a portable spectroradiometer. The technique was evaluated at two sites in permanent pasture on contrasting soils (an Allophanic and a Fluvial Recent soil) in the Manawatu region, New Zealand. Using a modified soil probe, reflectance spectra (350–2500 nm) were acquired from horizontal surfaces at three depths (15, 30 and 60 mm) of an 80‐mm diameter soil core, totalling 108 samples for both soils. After scanning, 3‐mm soil slices were taken at each depth for root density measurement and soil carbon (C) and nitrogen (N) analysis. The two soils exhibited a wide range of root densities from 1.53 to 37.03 mg dry root g⁻¹ soil. The average root density in the Fluvial soil (13.21 mg g⁻¹) was twice that in the Allophanic soil (6.88 mg g⁻¹). Calibration models, developed using partial least squares regression (PLSR) of the first derivative spectra and reference data, were able to predict root density on unknown samples using a leave‐one‐out cross‐validation procedure. The root density predictions were more accurate when the samples from the two soil types were separated (rather than grouped) to give sub‐populations (n = 54) of spectral data with more similar attributes. A better prediction of root density was achieved in the Allophanic soil (r² = 0.83, ratio prediction to deviation (RPD ) = 2.44, root mean square error of cross‐validation (RMSECV ) = 1.96 mg g ⁻¹) than in the Fluvial soil (r² = 0.75, RPD = 1.98, RMSECV = 5.11 mg g ⁻¹). It is concluded that pasture root density can be predicted from soil reflectance spectra acquired from field soil cores. Improved PLSR models for predicting field root density can be produced by selecting calibration data from field data sources with similar spectral attributes to the validation set. Root density and soil C content can be predicted independently, which could be particularly useful in studies examining potential rates of soil organic matter change.     

Rapid determination of lime requirement by mid‐infrared spectroscopy: A promising approach for precision agriculture

Mid‐infrared spectroscopy (MIRS) has proven to be a cost‐effective, high throughput measurement technique for soil analysis. After multivariate calibration mid‐infrared spectra can be used to predict various soil properties, some of which are related to lime requirement (LR). The objective of this study was to test the performance of MIRS for recommending variable rate liming on typical Central European soils in view of precision agriculture applications. In Germany, LR of arable topsoils is commonly derived from the parameters organic matter content (SOM), clay content, and soil pH (CaCl₂) as recommended by the Association of German Agricultural Analytical and Research Institutes (VDLUFA). We analysed a total of 458 samples from six locations across Germany, which all revealed large within‐field soil heterogeneity. Calcareous topsoils were observed at some positions of three locations (79 samples). To exclude such samples from LR determination, peak height at 2513 cm^?1 of the MIR spectrum was used for identification. Spectra‐based identification was accurate for carbonate contents > 0.5%. Subsequent LR derivation (LR_SPP) from MIRS‐PLSR predictions of SOM, clay, and pH (CaCl₂) for non‐calcareous soil samples using the VDLUFA look‐up tables was successful for all locations (R² = 0.54–0.82; RMSE = 857–1414 kg CaO ha^?1). Alternatively, we tested direct LR prediction (LR_DP) by MIRS‐PLSR and also achieved satisfactory performance (R² = 0.52–0.77; RMSE = 811–1420 kg CaO ha^?1; RPD = 1.44–2.08). Further improvement was achieved by refining the VDLUFA tables towards a stepless algorithm. It can be concluded that MIRS provides a promising approach for precise LR estimation on heterogeneous arable fields. Large sample numbers can be processed with low effort which is an essential prerequisite for variable rate liming in precision agriculture.     

Estimation of the Deoxynivalenol and Moisture Contents of Bulk Wheat Grain Samples by FT‐NIR Spectroscopy

Deoxynivalenol (DON) levels in harvested grain samples are used to evaluate the Fusarium head blight (FHB) resistance of wheat cultivars and breeding lines. Fourier transform near‐infrared (FT‐NIR) calibrations were developed to estimate the DON level and moisture content (MC) of bulk wheat grain samples harvested from FHB screening trials. Grains in a rotating glass petri dish were scanned in the 10,000–4,000 cm⁻¹ (1,000–2,500 nm) spectral range using a Perkin Elmer Spectrum 400 FT‐IR/FT‐NIR spectrometer. The DON calibration predicted the DON levels in test samples with R ² = 0.62 and root mean square error of prediction (RMSEP) = 8.01 ppm. When 5–25 ppm of DON was used as the cut‐off to classify samples into low‐ and high‐DON groups, 60.8–82.3% of the low‐DON samples were correctly classified, whereas the classification accuracy of the high‐DON group was 82.3–94.0%. The MC calibration predicted the MC in grain samples with R ² = 0.98 and RMSEP = 0.19%. Therefore, these FT‐NIR calibrations can be used to rapidly prescreen wheat lines to identify low‐DON lines for further evaluation using standard laboratory methods, thereby reducing the time and costs of analyzing samples from FHB screening trials.     

The use of visible and near‐infrared spectroscopy for the analysis of soil water repellency

This study investigated the potential of visible/near‐infrared reflectance spectroscopy (Vis‐NIRS) to predict soil water repellency (SWR). The top 40 mm of soils (n = 288) across 48 sites under pastoral land‐use in the North Island of New Zealand, which represented 10 soil orders and covered five classes of drought proneness, were analysed by standard laboratory methods and Vis‐NIRS. Soil WR was measured by using the molarity of ethanol droplet (MED) and the water drop penetration time (WDPT) tests. Soil organic carbon content (%C) was also measured to examine a possible relationship with SWR. A partial least squares regression (PLSR) model was developed by using Vis‐NIRS spectral data and the reference laboratory data. In addition, we explored the power of discrimination based on WDPT classes using partial least squares discriminant analysis (PLS‐DA). The PLSR of the processed spectra produced moderately accurate prediction for MED (R²_val = 0.61, RPD_val = 1.60, RMSE_val = 0.59) and good prediction for %C (R²_val = 0.82, RPD_val = 2.30, RMSE_val = 2.72). When the data from the 10 soil orders were considered separately and based on soil order rather than being grouped, the prediction of MED was further improved except for the Allophanic, Brown, Organic and Ultic soil orders. The PLS‐DA was successful in classifying 60% of soil samples into the correct WDPT classes. Our results indicate clearly that Vis‐NIRS has the potential to predict SWR. Further improvement in the prediction accuracy of SWR is envisaged by increasing the understanding of the relationship between Vis‐NIRS and the SWR of all New Zealand soil orders as a function of their physical properties and chemical constituents such as hydrophobic compounds.     

基于可见/近红外光谱技术的土壤总磷分析研究

Overabundance of phosphorus (P) in soils and water is of great concern and has received much attention in Florida, USA. Therefore, it is essential to analyze and predict the distribution of P in soils across large areas. This study was undertaken to model the variation of soil total phosphorus (TP) in Florida. A total of 448 soil samples were collected from different soil types. Soil samples were analyzed by chemical reference method and scanned in the visible/near-infrared (VNIR) region of 350--2 500 nm. Partial least squares regression (PLSR) calibration model was developed between chemical reference values and VNIR values. The coefficient of determination (R²) and the root mean squares error (RMSE) of calibration and validation sets, and the residual prediction deviation (RPD) were used to evaluate the models. The R² in calibration and validation for log-transformed TP (log TP) were 0.69 and 0.65, respectively, indicating that VNIR calibration obtained in this study accounted for at least 65% of the variance in log TP using only VNIR spectra, and the high RPD of 2.82 obtained suggested that the spectral model derived in this study was suitable and robust to predict TP in a wide range of soil types, being representative of Florida soil conditions.