Adsorption of methylene blue and crystal violet on low-cost adsorbent: waste fruits of <Emphasis Type="Italic">Rapanea ferruginea</Emphasis> (ethanol-treated and H<Subscript>2</Subscript>SO<Subscript>4</Subscript>-treated)

This study assesses the ability of two low-cost adsorbents made from waste of Rapanea ferruginea treated with ethanol (WRf) and its H₂SO₄-treated analog (WRf/H₂SO₄) for the removal of two cationic dyes methylene blue (MB) and crystal violet (CV) from aqueous solutions. The adsorbent was characterized by scanning electron microscopy, Fourier transform infrared spectrometry, thermogravimetric analysis, point of zero charge (pH_pzc), specific surface, and functional groups. The adsorption of dye onto the adsorbents was studied as a function of pH solution (2–12), contact time (up to 120 min) and initial concentration (20–120 mg/L), and temperature (25, 35, and 55 °C). The influence of these parameters on adsorption capacity was studied using the batch process. The response surface methodology (RSM) was used in the experimental design, modeling of the process, and optimizing of the variables and was optimized by the response involving Box–Behnken factorial design (15 runs). The results show that the data correlated well with the Sips isotherm. The maximum adsorption capacities of MB and CV onto WRf were found to be 69 and 106 mg/g, and onto WRf/H₂SO₄, the adsorption capacities were 33 and 125 mg/g, respectively. The kinetic data revealed that adsorption of cationic dyes onto the adsorbents closely follows the pseudo-second-order kinetic model. Regression analysis showed good fit of the experimental data to the second-order polynomial model, with coefficient of determination (R²) values for MB (R²?=?0.9685) and MB (R²?=?0.9832) for WRf and CV (R²?=?0.9685) and CV (R²?=?0.9832) for WRf/H₂SO₄ indicated that regression analysis is able to give a good prediction of response for the adsorption process in the range studied. The results revealed that waste from R. ferruginea is potentially an efficient and low-cost adsorbent for adsorption of MB and CV.     

Comparative study of the absorptive potential of raw and activated carbon <Emphasis Type="Italic">Acacia nilotica</Emphasis> for Reactive Black 5 dye

Acacia nilotica was used for the adsorption of Reactive Black 5 (RB5) dye from an aqueous solution. Both the raw and activated (with H₃PO₄) carbon forms of Acacia nilotica (RAN and ANAC, respectively) were used for comparison. Various parameters (including dye concentration, contact time, temperature, and pH) were optimized to obtain the maximum adsorption capacity. RAN and ANAC were characterized using Fourier transform infrared spectroscopy, scanning electron microscopy, and energy-dispersive X-ray spectroscopy. The maximum experimental adsorption capacities for RAN and ANAC were 34.79 and 41.01 mg g^?1, respectively, which agreed with the maximum adsorption capacities predicted by the Langmuir, Freundlich, and Dubinin–Radushkevich equilibrium isotherm models. The adsorption data of ANAC showed a good fit to the isotherm models based on the coefficient of determination (R ²): Langmuir type II (R ² = 0.99) > Freundlich (R ² = 0.9853) > Dubinin–Radushkevich (R ² = 0.9659). This result suggested monolayer adsorption of RB5 dye. The adsorption of RB5 dye followed pseudo-second-order kinetics. The RAN adsorbent reflected an exothermic reaction (enthalpy change, ΔH = ?0.006 kJ mol^?1) and increased randomness (standard entropy change, ΔS = 0.038 kJ mol^?1) at the solid–solution interface. In contrast, ANAC reflected both exothermic [?0.011 kJ mol^?1 (303–313 K)] and endothermic [0.003 kJ mol^?1 (313–323 K)] reactions. However, the ΔS value of ANAC was lower when the RB5 adsorption increased from 313 to 323 K. The negative values for the Gibbs free energy change at all temperatures indicated that the adsorption of RB5 dye onto RAN and ANAC was spontaneous in the forward direction.     

Removal of cationic dye methylene blue (MB) from aqueous solution by ground raw and base modified pine cone powder

The adsorption capacity of raw and sodium hydroxide-treated pine cone powder in the removal of methylene blue (MB) from aqueous solution was investigated in a batch system. It was found that the base modified pine cone exhibits large adsorption capacity compared with raw pine cone. The extent of adsorption capacity was increased with the increase in NaOH concentration. Overall, the extent of MB dye adsorption increased with increase in initial dye concentration, contact time, and solution pH but decreased with increase in salt concentration and temperature for both the systems. Surface characteristics of pine cone and base modified pine cone were investigated using Fourier transform infrared spectrophotometer and scanning electron microscope. Equilibrium data were best described by both Langmuir isotherm and Freundlich adsorption isotherm. The maximum monolayer adsorption capacity was found to be 129.87 mg g^?1 at solution pH of 9.02 for an initial dye concentration of 10 ppm by raw pine cone. The base modified pine cone showed the higher monolayer adsorption capacity of 142.25 mg g^?1 compared with raw pine cone biomass. The value of separation factor, R _L, from Langmuir equation and Freundlich constant, n, both give an indication of favourable adsorption. The various kinetic models, such as pseudo-first-order model, pseudo-second-order model, intraparticle diffusion model, double-exponential model, and liquid film diffusion model, were used to describe the kinetic and mechanism of adsorption process. Overall, kinetic studies showed that the dye adsorption process followed pseudo-second-order kinetics based on other models. The different kinetic parameters, including rate constant, half-adsorption time and diffusion coefficient, were determined at different physicochemical conditions. A single-stage bath adsorber design for the MB adsorption onto pine cone and modified pine cone has been presented based on the Langmuir isotherm model equation. Thermodynamic parameters, such as standard Gibbs free energy (ΔG ⁰), standard enthalpy (ΔH ⁰) and standard entropy (ΔS ⁰), were also calculated.     

Efficient removal of Evans blue dye by Zn–Al–NO<Subscript>3</Subscript> layered double hydroxide

Evans blue (EB) dye has been successfully removed from aqueous solution through chemisorption process with synthetic layered double hydroxides (LDH) [Zn_1?x Al _x (OH)₂NO₃·nH₂O, x = 0.2–0.33]. Detailed evaluation of dye adsorption characteristics in aqueous medium has been studied for different layer charged hydroxides. The objective of the study was efficient removal of a dye by LDH and understanding the structure–property relationship of the LDH on its adsorption behaviour. Highest Langmuir monolayer adsorption capacity (Qt) of 113.64 mg g^?1 was observed for highest layer charge x = 0.33, and it is higher than previously reported values for the LDH-EB dye system. Under optimized condition, 99% of EB dye is removed from aqueous solution within 60 min at 313 K. The monotonous increase in Qt value with increasing layer charge is correlated with layer charge density (LCD) and lower particle size of the synthetic LDH. The variation in Qt among different layer charged materials is marginal (3.46–4.17%) with respect to the respective anion exchange capacity (AEC) of LDH NO₃. The limited contribution of AEC surmises the occurrence of surface-only adsorption and absence of intercalation as validated by the XRD analysis. The spontaneity of the EB dye removal increases with increasing temperature and LCD. The chemisorption nature of the adsorption reaction is well supported by the thermodynamics values.     

Atomic layer deposition surface functionalized biochar for adsorption of organic pollutants: improved hydrophilia and adsorption capacity

Atomic layer deposition (ALD) thin film coating was applied to improve the hydrophilia of biochar derived from black willow. 2 (2Al, 0.82 wt% Al₂O₃), 5 (5Al, 1.40 wt% Al₂O₃), and 10 (10Al, 2.36 wt% Al₂O₃) cycles of alumina ALD were applied. The biochars were characterized by inductively coupled plasma–atomic emission spectroscopy, nitrogen adsorption and desorption, scanning electron microscopy, and Fourier transform infrared spectroscopy. The adsorbents were utilized for the removal of methylene blue (MB) from an aqueous solution to evaluate their adsorption capacities. The 5Al biochar showed the highest adsorption capacity, compared to the uncoated biochar and other Al₂O₃ coated biochars, due to its improved hydrophilia. The amount of MB adsorbed onto the 5Al biochar was almost three times that adsorbed onto the uncoated biochar during the first hour of adsorption experiments. Adsorption isotherms were modeled with the Langmuir and Freundlich isotherms. The data fit well with the Langmuir isotherm, and the maximum adsorption capacities were found to be 26.8 and 35.0 mg/g at 25 °C for the uncoated biochar and 5Al biochar, respectively. The adsorbed MB amount per square meter achieved 1.3 mg/m² onto the 5Al biochar, and it was twice the amount on the uncoated biochar. The experimental data were analyzed by pseudo-first-order and pseudo-second-order kinetics models of adsorption. The pseudo-second-order model better describes adsorption kinetic data for the uncoated biochar and 5Al biochar than the pseudo-first-order model does.     

Removal of phosphates from aqueous solution by sepiolite-nano zero valent iron composite optimization with response surface methodology

In this study, sepiolite-nano zero valent iron composite was synthesized and applied for its potential adsorption to remove phosphates from aqueous solution. This composite was characterized by different techniques. For optimization of independent parameters (pH = 3–9; initial phosphate concentration = 5–100 mg/L; adsorbent dosage = 0.2–1 g/L; and contact time = 5–100 min), response surface methodology based on central composite design was used. Adsorption isotherms and kinetic models were done under optimum conditions. The results indicated that maximum adsorption efficiency of 99.43 and 92% for synthetic solution and real surface water sample, respectively, were achieved at optimum conditions of pH 4.5, initial phosphate concentration of 25 mg/L, adsorbent dosage of 0.8 g/L, and 46.26 min contact time. The interaction between adsorbent and adsorbate is better described with the Freundlich isotherm (R ² = 0.9537), and the kinetic of adsorption process followed pseudo-second-order model. Electrostatic interaction was the major mechanisms of the removal of phosphates from aqueous solution. The findings of this study showed that there is an effective adsorbent for removal of phosphates from aqueous solutions.     

Adsorption kinetics and thermodynamics of organophosphorus profenofos pesticide onto Fe/Ni bimetallic nanoparticles

Bimetallic Fe/Ni nanoparticles were synthesized and used for the removal of profenofos organophosphorus pesticide from aqueous solution. These novel bimetallic nanoparticles (Fe/Ni) were characterized by scanning electron microscopy, energy-dispersive X-ray analysis spectroscopy, X-ray diffraction, and Fourier transform infrared spectroscopy. The effect of the parameters of initial pesticide concentration, pH of the solution, adsorbent dosage, temperature, and contact time on adsorption was investigated. The adsorbent exhibited high efficiency for profenofos adsorption, and equilibrium was achieved in 8 min. The Langmuir, Freundlich, and Temkin isotherm models were used to determine equilibrium. The Langmuir model showed the best fit with the experimental data (R ² = 0.9988). Pseudo-first-order, pseudo-second-order, and intra-particle diffusion models were tested to determine absorption kinetics. The pseudo-second-order model provided the best correlation with the results (R ² = 0.99936). The changes in the thermodynamic parameters of Gibb’s free energy, enthalpy, and entropy of the adsorption process were also evaluated. Thermodynamic parameters indicate that profenofos adsorption using Fe/Ni nanoparticles is a spontaneous and endothermic process. The value of the activation energy (E _a = 109.57 kJ/mol) confirms the nature of the chemisorption of profenofos onto Fe/Ni adsorbent.     

Sorption characteristics of peat of Brunei Darussalam IV: equilibrium,thermodynamics and kinetics of adsorption of methylene blue and malachite green dyes from aqueous solution

Peat of Brunei Darussalam shows a great potential for the removal of methylene blue (MB) and malachite green (MG) dyes from aqueous solution. Carefully controlled batch experiments performed by changing one parameter at a time indicate that the optimum time periods of agitation and settling required for maximum removal of MB are 2.0 and 1.0 h, respectively, while these values for MG are 4.0 and 1.0 h, respectively. The optimum pH is determined to be the ambient value, and under the optimum conditions, 90 % removal of both dyes was determined under laboratory conditions. The equilibrium adsorption data analyzed for various isotherm models suggest that the Sips and Redlich–Peterson (R–P) models are valid for MB and MG, respectively. Further, thermodynamic studies show that the adsorption of both dyes on peat is spontaneous and endothermic. The adsorption capacities (q _max) of MB and MG dyes on peat are 0.45 and 0.31 mmol g^?1, respectively. Characterization of the surfaces of peat before and after treatment of dyes by SEM and FTIR provides conclusive evidence of adsorption of both dyes. Kinetics studies indicate that the adsorption of both MB and MG dyes is favored toward the pseudo-second-order model, with a little contribution of MG to the pseudo-first-order model. These results suggest that peat is a potential low-cost adsorbent for the removal of MB and MG dyes.     

Response surface methodology mediated optimization of Remazol Orange decolorization in plain distilled water by Pseudomonas aeruginosa BCH

The bacterium Pseudomonas aeruginosa BCH decolorized and degraded the sulphonated azo dye Remazol Orange in plain distilled water. The effects of different parameters, i.e. pH, temperature and cell mass concentration on the biodegradation of dye in aqueous phase was evaluated using response surface methodology. Optimization was carried out using three-level Box–Behnken design. Predicted values were found to be in good agreement with experimental values (R ² 0.9997 and pred R ² 0.9984), which indicated suitability of the employed model and the success of response surface methodology. Optimum dye decolorization was maximized and the favourable conditions were pH 7.43, temperature 29.39 °C and cell mass concentration 2.88 g l^?1, which resulted in 96.01 % decolorization within 5 h. It was validated from the predicted response (97.37 %). According to the analysis of variance results, the proposed model can be used to navigate the design space. 3D plot analysis disclosed the significant interaction between all three tested factors on decolorization process. The combinations of the three variables predicted during response surface methodology were confirmed through confirmatory experiments. Observations indicated that higher cell mass accelerated the decolorization process. Degradation of the dye was verified through high performance liquid chromatography analysis. Phytotoxicity studies carried out with dye and dye metabolites using Phaseolus mungo, Triticum aestivum and Sorghum vulgare indicated the detoxification of dye.     

Kinetic and equilibrium study of Ni(II) sorption from aqueous solutions onto Peganum harmala-L

In this study, the adsorption behavior of Ni(II) in an aqueous solution system using natural adsorbent Peganum harmala-L was measured via batch mode. The prepared sorbent was characterized by scanning electron microscope, Fourier transform infrared spectroscopy, N₂ adsorption–desorption and pH_zpc. Adsorption experiments were carried out by varying several conditions such as contact time, metal ion concentration and pH to assess kinetic and equilibrium parameters. The equilibrium data were analyzed based on the Langmuir, Freundlich, Temkin and Dubinin–Radushkevich isotherms. Kinetic data were analyzed using the pseudo-first-order, pseudo-second-order and intra-particular diffusion models. Experimental data showed that at contact time 60 min, metal ion concentration 50 mg/L and pH 6, a maximum amount of Ni(II) ions can be removed. The experimental data were best described by the Langmuir isotherm model as is evident from the high R ² value of 0.988. The adsorption capacity (q _m) obtained was 68.02 mg/g at an initial pH of 6 and a temperature of 25 °C. Kinetic studies of the adsorption showed that equilibrium was reached within 60 min of contact and the adsorption process followed the pseudo-first-order model. The obtained results show that P. harmala-L can be used as an effective and a natural low-cost adsorbent for the removal of Ni(II) from aqueous solutions.     

Biosorption of hexavalent chromium from aqueous solution onto pomegranate seeds: kinetic modeling studies

Hexavalent chromium has been proved to be the reason of several health hazards. This study aimed at evaluating the application of pomegranate seeds powder for chromium adsorption (VI) from aqueous solution. Chromium adsorption percentage (VI) increased with increasing the adsorbent dosage. Chromium adsorption capacity (VI), at pH = 2 and 10 mg/L initial metal concentration, decreased from 3.313 to 1.6 mg/g through increasing dosage of adsorbent from 0.2 to 0.6 g/100 ml. The adsorption rate increased through increase in chromium initial concentration (VI). However, there was a removal percentage reduction of chromium (VI). Chromium adsorption kinetics by different models (pseudo-first-order, modified pseudo-first-order, pseudo-second-order, Elovich, intraparticle diffusion, Boyd kinetic) was investigated as well. Studies on adsorption kinetic indicated that the experimental data were matched by pseudo-second-order model (R ² = 0.999) better. Obtained results demonstrated the pomegranate seeds can be used as an effective biomaterial and biosorbent for hexavalent chromium adsorption from aqueous solutions.     

Pectin–cerium (IV) tungstate nanocomposite and its adsorptional activity for removal of methylene blue dye

Pectin–cerium (IV) tungstate composite (Pc/CT) has been prepared by sol gel method at room temperature. The composite ion exchanger has been characterized using X-ray diffraction, scanning electron microscopy, energy dispersive X-ray spectroscopy and Fourier infrared spectroscopy. The ion exchange capacity, pH titrations, thermal stability and distribution coefficient of composite ion exchanger were investigated. The Na⁺ ions exchange capacity of the Pc/CT has been observed higher (1.4 meq g^?1) as compared to its inorganic counterpart (0.8 meq g^?1). Pc/CT composite ion exchanger was thermally stable and retained about 60 % of its ion exchange capacity up to 400 °C. The distribution study has inferred more selective the Pc/CT for Zn²⁺ as compared to other metal ions. The adsorption efficiency of Pc/CT was tested for methylene blue removal dye from aqueous phase. The removal of dye followed pseudo-second-order kinetics.     

Formation of one-dimensional composites of poly(<Emphasis Type="Italic">m</Emphasis>-phenylenediamine)s based on <Emphasis Type="Italic">Streptomyces</Emphasis> for adsorption of hexavalent chromium

Here, a novel one-dimensional composite of poly(m-phenylenediamine)s coating on filamentous Streptomyces was successfully constructed via a controllable polymerization reaction. The synthesized composites were characterized by scanning electron microscopy, Fourier transform infrared spectroscopy, and X-ray photoelectron spectroscopy. Their adsorption isotherm and kinetics for aqueous hexavalent chromium were also systematically examined. The results of scanning electron microscopy analysis indicated that the obtained composites based on Streptomyces were showed a uniform and stable one-dimensional morphology with distinct core–shell configuration. Moreover, the Langmuir isotherm model (R ² > 0.96) and pseudo-second-order equation (R ² = 0.9996) described well the equilibrium adsorption behavior and kinetics of hexavalent chromium adsorption by the composites. In addition, bath adsorption experiments demonstrated the highest adsorption capacity of hexavalent chromium by the composites reached 320.03 mg g^?1 in an acid solution, which was 5.6 times as that of the pure Streptomyces filaments. The results of Fourier transform infrared spectroscopy and X-ray photoelectron spectroscopy analyses suggested that the adsorption of hexavalent chromium by the composites possibly involved the protonation, redox, and chelation reactions. Therefore, a promising application of these composites in treating acid hexavalent chromium-contaminated wastewater is expectable.     

Effect of the activation temperature over activated carbon production from castor cake and its evaluation as dye adsorbent

In this work, castor cake produced as a by-product in castor oil extraction was used for activated carbon production. Castor cake was chemically treated with a K₂CO₃ solution, and the effect of the pyrolysis temperature in the 500–900 °C range was studied. Materials were characterized by X-ray powder diffraction, thermogravimetric analysis, scanning electron microscopy and nitrogen adsorption–desorption at ?196 °C. Methylene blue adsorption was selected as a test probe to stress the removal capacity of the prepared materials. By the X-ray powder diffraction analysis, carbon obtaining in its graphite allotropic form together with other inorganic compounds was verified. Scanning electron microscopy images evidenced the generation of porosity in the thermally treated samples compared with the pristine compound. In addition, the specific surface area values augmented progressively with the thermal treatment increment achieving a value of 1015 m² g^?1 in the 900 °C calcined sample. Calcination at 800 °C and m/V = 0.003 ratio were the best parameter combination to achieve a 99.6% methylene blue uptake.     

Biogenic silver nanoparticles on carbonaceous material from sewage sludge for degradation of methylene blue in aqueous solution

Silver nanoparticles (Ag NPs) were synthesized in situ, using a one-step green methodology with Camellia sinensis (green tea) aqueous extract as reducing agent, and supported on a carbonaceous material (Ag-CM), originated from the pyrolysis of sewage sludge. UV–Vis spectroscopy, X-ray diffraction, scanning electron microscopy, transmission electron microscopy and Brunauer–Emmet–Teller were used to characterize the nanocomposite. Ag-CM composite exhibited very good catalytic activity in the degradation process of methylene blue (MB) dye in aqueous solution without using sunlight or UV radiation. Batch kinetic and isothermal experiments, using 30 mg/L MB solution, showed that Ag-CM composite removed near to 91 % of MB in 9 h, whereas the carbonaceous material alone removed only 60 % in 30 h. Experimental data were adjusted to different kinetic and isotherms models, where both materials fit the second-order and Langmuir–Freundlich models, respectively; therefore, a chemisorption mechanism probably occurs in these heterogeneous materials.     

Optimization of ammonia removal by ion-exchange resin using response surface methodology

The ability of ion-exchange resin for ammonia removal from aqueous solution was studied. The results showed that Amberlite ion-exchange resin was effective in removing ammonia from aqueous solution. Factorial design and response surface methodology were applied to evaluate and optimize the effects of pH, resin dose, contact time, temperature and initial ammonia concentration. Low pH condition was preferred with the optimum pH found to be 6. High resin dose generated high removal rate and low exchange capacity. Results of factorial design and response surface methodology showed that temperature was not a significant parameter. The model prediction was in good agreement with observed data (R ² = 0.957). The optimum Q _e was 28.78 mg/g achieved at pH = 6 and initial TAN concentration of 3000 mg/L. The kinetics followed the pseudo-second-order kinetic model (R ² = 0.999). Equilibrium data were fitted to Langmuir and Freundlich isotherm models with Langmuir model providing a slightly better predication (R ² = 0.996). The resin was completely regenerated by 2 N H₂SO₄.     

Adsorption of a cationic dye (methylene blue) by Iranian natural clays from aqueous solutions: equilibrium,kinetic and thermodynamic study

Removal of dyes by low-cost adsorbents is an effective method in wastewater treatment. Iranian natural clays were determined to be effective adsorbents for removal of a basic dye (methylene blue) from aqueous solutions in batch processes. Characterizations of the clays were carried out by X-ray diffraction, Brunauer–Emmett–Teller surface area analysis and field-emission scanning electron microscopy. Effects of the operational parameters such as adsorbent dosage, initial dye concentration, solution pH and temperature were investigated on the adsorption performance. Adsorption isotherms like Langmuir, Freundlich and Temkin were used to analyze the adsorption equilibrium data and Langmuir isotherm was the best fit. Adsorption kinetics was investigated by pseudo-first-order, pseudo-second-order and intraparticle diffusion models and the results showed that the adsorption system conforms well to the pseudo-second-order model. The thermodynamic parameters of adsorption (ΔS°, ΔH° and ΔG°) were obtained and showed that the adsorption processes were exothermic.     

Use of Tunisian raw clay to remove dye from aqueous solution

This paper presents the first attempt to investigate the potential of Tunisian palygorskite-rich clay (Pal-clay) on the effectiveness of a textile dye “Direct orange 34” (DO34) removal. Important parameters which affect adsorption, such as initial solution pH, contact time, adsorbent mass, initial dye concentration, and temperature, were investigated. The raw Pal-clay was characterized using X-ray diffractometer (XRD), X-ray fluorescence (XRF), Fourier transform infrared spectroscopy (FTIR), cation exchange capacity (CEC), specific surface area (SSA) analysis, and point of zero charge (PZC) determination. The results showed that the Pal-clay has a high selectivity for DO34 and had maximum removal efficiency reaching up to about 91 %. The highest adsorption capacity was obtained at 25 °C and pH of 2. The dye uptake process fitted well to the pseudo-second-order kinetic expression and was best described by the Langmuir and Freundlich isotherms. Intra-particle diffusion studies showed that the adsorption mechanism was not exclusively controlled by the diffusion step and was more likely to be governed by external mass transfer. Thermodynamic parameters such as change in free energy (ΔG°), enthalpy (ΔH°), and entropy (ΔS°) were also calculated. The parameters revealed that the adsorption of dye by the raw clay is spontaneous and exothermic. The results indicate that the Pal-clay has a moderate adsorption capacity towards anionic dye.     

Structural investigation of the synthetic CaAn(PO4)2 (An = Th and Np) cheralite-like phosphates

The crystallographic structures of the synthetic cheralite, CaTh(PO₄)₂, and its homolog CaNp(PO₄)₂ have been investigated by X-ray diffraction at room temperature. Rietveld analyses showed that both compounds crystallize in the monoclinic system and are isostructural to monazite LnPO₄ (Ln = La to Gd). The space group is P2₁/n (I.T. = 14) with Z = 2. The refined lattice parameters of CaTh(PO₄)₂ are a = 6.7085(8) Å, b = 6.9160(6) Å, c = 6.4152(6) Å, and β = 103.71(1)° with best fit parameters R _wp = 4.87%, R _p = 3.69% and R _B = 3.99%. For CaNp(PO₄)₂, we obtained a = 6.6509(5) Å, b = 6.8390(3) Å, c = 6.3537(8) Å, and β = 104.12(6)° and R _wp = 6.74%, R _p = 5.23%, and R _B = 6.05%. The results indicate significant distortions of bond length and angles of the PO₄ tetrahedra in CaTh(PO₄)₂ and to a lesser extent in CaNp(PO₄)₂. The structural distortions were confirmed by Raman spectroscopy of CaTh(PO₄)₂. A comparison with the isostructural compounds LnPO₄ (Ln = Ce and Sm) confirmed that the substitution of the large rare earth trivalent cations with Ca²⁺ and Th⁴⁺ introduces a distortion of the PO₄ tetrahedra.     

Data-driven nonlinear modeling studies on removal of Acid Yellow 59 using Si-doped multi-walled carbon nanotubes

Data-driven modeling of removal of color index name of Acid Yellow 59 from aqueous solutions using multi-walled carbon nanotubes by multiple (non)linear regression and artificial neural networks (ANN) models based on leave-one-out cross-validation to predict the adsorbed dye amount per unit mass of adsorbent (mg g^?1) and performance evaluation of the proposed multiple (non)linear regression and ANN models is the main novel contributor of the present study. Initial dye concentration, adsorbent concentration, reaction time, and temperature were determined as explanatory variables and input neurons for multiple (non)linear regression and ANN models, respectively. The total number of experiments was determined as 1280 statistically. The results showed that multilayer perception ANN model (\(R^{2}_{\text{training}}\) = 0.9997, \(R^{2}_{\text{testing}}\) = 0.9993, RMSE = 0.7678, MAE of 0.0007) predicted q _t better than multiple (non)linear regression model (\(R^{2}_{\text{adj}}\) = 0.9645, \(R^{2}_{\text{pred}}\) = 0.9633, SE = 9.55) and MLR (R ² = 0.9543, SE = 10.87) models. The results justified the accuracy of ANN in prediction of q _t , significantly.