Pub Date : 2024-09-06DOI: 10.1007/s10450-024-00533-z
Mushtaq Hussain, Syed Sulaiman Hussaini, Mohammad Shariq, Hanan A. Althikrallah, Noha Al-Qasmi, Kondaiah Seku, Shabbir Ahmed Kazi
A novel strategy was used to successfully remove rhodamine B dye from contaminated water by combining magnetized multi-walled carbon nanotubes (MWCNTs) with myrrh gum as an adsorbent. The shape and structure of the prepared adsorbent were charecterized using X-ray powder diffraction analysis, FTIR, SEM, and TEM. A batch approach was used to study the effect of the adsorbent on rhodamine B removal, and several variables were considered, including pH, agitation time, and adsorbent dosage. The findings revealed that rhodamine B dye removal was best at a basic pH of 8, with a 0.05 g adsorbent dosage, within 30 min. Different models were utilized to analyze the isotherm data obtained during the investigations. The adsorbent exhibited the highest adsorption capacity for rhodamine B removal, reaching 332.22 mg/g. The regression analysis indicated appropriate adsorption kinetics with a pseudo-second order kinetics and an R2 value of 0.999. The thermodynamic analysis specified that the removal process exhibits endothermic characteristics, spontaneous behavior, and involves chemisorption. The obtained results demonstrate the efficacy of the adsorbent in the context of water treatment.
通过将磁化多壁碳纳米管(MWCNTs)与没药胶结合作为吸附剂,一种新颖的策略成功地去除了污染水中的罗丹明 B 染料。利用 X 射线粉末衍射分析、傅立叶变换红外光谱、扫描电镜和 TEM 分析了所制备吸附剂的形状和结构。采用批次法研究了吸附剂对罗丹明 B 的去除效果,并考虑了多个变量,包括 pH 值、搅拌时间和吸附剂用量。研究结果表明,在碱性 pH 值为 8、吸附剂用量为 0.05 克的条件下,罗丹明 B 染料的去除率在 30 分钟内达到最佳。利用不同的模型分析了研究过程中获得的等温线数据。该吸附剂对罗丹明 B 的吸附去除率最高,达到 332.22 毫克/克。回归分析表明,该吸附剂的吸附动力学为假二阶动力学,R2 值为 0.999。热力学分析表明,去除过程表现出内热特性、自发行为和化学吸附。所得结果证明了该吸附剂在水处理方面的功效。
{"title":"Efficient removal of rhodamine B dye using myrrh-based magnetized multi-walled carbon nanotubes as adsorbent","authors":"Mushtaq Hussain, Syed Sulaiman Hussaini, Mohammad Shariq, Hanan A. Althikrallah, Noha Al-Qasmi, Kondaiah Seku, Shabbir Ahmed Kazi","doi":"10.1007/s10450-024-00533-z","DOIUrl":"10.1007/s10450-024-00533-z","url":null,"abstract":"<div><p>A novel strategy was used to successfully remove rhodamine B dye from contaminated water by combining magnetized multi-walled carbon nanotubes (MWCNTs) with myrrh gum as an adsorbent. The shape and structure of the prepared adsorbent were charecterized using X-ray powder diffraction analysis, FTIR, SEM, and TEM. A batch approach was used to study the effect of the adsorbent on rhodamine B removal, and several variables were considered, including pH, agitation time, and adsorbent dosage. The findings revealed that rhodamine B dye removal was best at a basic pH of 8, with a 0.05 g adsorbent dosage, within 30 min. Different models were utilized to analyze the isotherm data obtained during the investigations. The adsorbent exhibited the highest adsorption capacity for rhodamine B removal, reaching 332.22 mg/g. The regression analysis indicated appropriate adsorption kinetics with a pseudo-second order kinetics and an R<sup>2</sup> value of 0.999. The thermodynamic analysis specified that the removal process exhibits endothermic characteristics, spontaneous behavior, and involves chemisorption. The obtained results demonstrate the efficacy of the adsorbent in the context of water treatment.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 8","pages":"1925 - 1936"},"PeriodicalIF":3.0,"publicationDate":"2024-09-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191529","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-06DOI: 10.1007/s10450-024-00534-y
Muhammad Mushtaq, Zheng Chang, Muhammad Abdul Rauf Khan, Iltaf Muhammad, Amel Laref, Norah Algethami, Afaf Khadr Alqorashi
In this work, using first-principles calculations, we explored the sensing properties of formaldehyde (CH2O) on pristine antimonene (p-Sb), single vacancy modified antimonene (SV-Sb), and triple X-doped (X = B, N) SV-Sb (SV-3X-Sb). It is found that CH2O is physically adsorbed on p-Sb with adsorption energy Ea of -0.11 eV. The Ea slightly increased in SV-Sb (-0.17 eV). The maximum Ea was observed for SV-3B-Sb and SV-3N-Sb with Ea of -0.81 (-0.86) eV, respectively. Because of moderate adsorption strength, the electronic and magnetic properties of SV-Sb and SV-3X-Sb are slightly altered in the presence of CH2O. The SV-Sb with CH2O exhibits half-metallic character. The direct band gap (Eg) of SV-3B-Sb is slightly increased after adsorption, and in the presence of CH2O the semiconducting SV-3N-Sb showed a metallic character. These changes in electronic properties are attributed to charge transfer from absorbent to CH2O. These findings suggest that the sensitivity of antimonene for CH2O detection can be tuned with defects.
{"title":"Chemical bonding and tunable adsorption of volatile formaldehyde on B and N decorated antimonene: first-principles insights","authors":"Muhammad Mushtaq, Zheng Chang, Muhammad Abdul Rauf Khan, Iltaf Muhammad, Amel Laref, Norah Algethami, Afaf Khadr Alqorashi","doi":"10.1007/s10450-024-00534-y","DOIUrl":"10.1007/s10450-024-00534-y","url":null,"abstract":"<div><p>In this work, using first-principles calculations, we explored the sensing properties of formaldehyde (CH<sub>2</sub>O) on pristine antimonene (p-Sb), single vacancy modified antimonene (SV-Sb), and triple X-doped (X = B, N) SV-Sb (SV-3X-Sb). It is found that CH<sub>2</sub>O is physically adsorbed on p-Sb with adsorption energy <i>E</i><sub>a</sub> of -0.11 eV. The <i>E</i><sub>a</sub> slightly increased in SV-Sb (-0.17 eV). The maximum <i>E</i><sub>a</sub> was observed for SV-3B-Sb and SV-3N-Sb with <i>E</i><sub>a</sub> of -0.81 (-0.86) eV, respectively. Because of moderate adsorption strength, the electronic and magnetic properties of SV-Sb and SV-3X-Sb are slightly altered in the presence of CH<sub>2</sub>O. The SV-Sb with CH<sub>2</sub>O exhibits half-metallic character. The direct band gap (<i>E</i><sub>g</sub>) of SV-3B-Sb is slightly increased after adsorption, and in the presence of CH<sub>2</sub>O the semiconducting SV-3N-Sb showed a metallic character. These changes in electronic properties are attributed to charge transfer from absorbent to CH<sub>2</sub>O. These findings suggest that the sensitivity of antimonene for CH<sub>2</sub>O detection can be tuned with defects.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 8","pages":"1913 - 1923"},"PeriodicalIF":3.0,"publicationDate":"2024-09-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191531","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-06DOI: 10.1007/s10450-024-00535-x
Thalles S. Diógenes, Sarah A. Altino, Carla E. Hori, Lucienne L. Romanielo
A new set of Lennard–Jones parameters to account the short interactions between atoms of MOFs and of guest molecules is proposed. The Slater‒Kirkwood relationship was used to obtain the LJ parameters for the framework atoms, so the proposed force set of parameters was named the Slater–Kirkwood force field (SKFF). GCMC simulations using SKFF were performed to predict the adsorption of CO2, CH4 and linear alkanes on several IRMOFs. The results predicted by SKFF were compared to those obtained by the traditional general force fields used in screening MOFs (UFF and Dreiding). The performance of the proposed SKFF was superior to those of the UFF and Dreiding force fields, without accounting electrostatic contributions. Additionally, the proposed set of parameters was able to accurately predict the adsorption behavior of binary (CO2–CH4, CO2–N2, CH4–N2) and ternary (N2–CO2–CH4) mixtures on IRMOF-1 at 297 K. To evaluate the transferability of SKFF to other MOFs, the adsorption isotherms of CO2, CH4 and N2 on UiO-66, UiO-67, DUT-52, CuBTC, MIL-100(Cr), MIL-47(V), ZIF-8 and ZIF-97 were also predicted. The results presented good agreement with the experimental data.
{"title":"New parametrization of a Lennard–Jones force field based on Slater-Kirkwood correlation for computing adsorption on MOFs","authors":"Thalles S. Diógenes, Sarah A. Altino, Carla E. Hori, Lucienne L. Romanielo","doi":"10.1007/s10450-024-00535-x","DOIUrl":"10.1007/s10450-024-00535-x","url":null,"abstract":"<div><p>A new set of Lennard–Jones parameters to account the short interactions between atoms of MOFs and of guest molecules is proposed. The Slater‒Kirkwood relationship was used to obtain the LJ parameters for the framework atoms, so the proposed force set of parameters was named the Slater–Kirkwood force field (SKFF). GCMC simulations using SKFF were performed to predict the adsorption of CO<sub>2</sub>, CH<sub>4</sub> and linear alkanes on several IRMOFs. The results predicted by SKFF were compared to those obtained by the traditional general force fields used in screening MOFs (UFF and Dreiding). The performance of the proposed SKFF was superior to those of the UFF and Dreiding force fields, without accounting electrostatic contributions. Additionally, the proposed set of parameters was able to accurately predict the adsorption behavior of binary (CO<sub>2</sub>–CH<sub>4</sub>, CO<sub>2</sub>–N<sub>2</sub>, CH<sub>4</sub>–N<sub>2</sub>) and ternary (N<sub>2</sub>–CO<sub>2</sub>–CH<sub>4</sub>) mixtures on IRMOF-1 at 297 K. To evaluate the transferability of SKFF to other MOFs, the adsorption isotherms of CO<sub>2</sub>, CH<sub>4</sub> and N<sub>2</sub> on UiO-66, UiO-67, DUT-52, CuBTC, MIL-100(Cr), MIL-47(V), ZIF-8 and ZIF-97 were also predicted. The results presented good agreement with the experimental data.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 8","pages":"1947 - 1969"},"PeriodicalIF":3.0,"publicationDate":"2024-09-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191527","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
(upgamma)-alumina is highly employed as support for hydrotreatment catalysts prepared by impregnation and as adsorbent in water treatment. These applications consist of contacting (upgamma)-alumina with aqueous solutions, leading to the transport of ions inside the alumina pores and their adsorption on the pore surface. These physicochemical phenomena are governed by the (upgamma)-alumina pore surface and the solution characteristics. Predicting the physicochemical phenomena at the liquid/solid interface is crucial to optimize the design of catalysts and of water treatment adsorption processes. However, this is very challenging using conventional analytical techniques. In this work, the diffusion of protons and their counter-ions inside (upgamma)-alumina pores and the adsorption of protons on the pore surface are modeled at unsteady state during contact with acid solutions at different initial pH levels. Diffusion inside pores is represented using a combination of the zero current method and the Poisson-Boltzmann equation, while the proton adsorption is described by the Langmuir adsorption isotherm. Simulations agree well with the results of proton adsorption experiments in a batch system. The model accurately predicts the distribution of species inside the electrostatic double layer at the liquid/solid interface. It also computes the surface charge and the maximal adsorption capacities of different types of hydroxyl sites present on the alumina pore surface; both are very difficult to determine experimentally. This model can serve as a guide for the comprehension of the liquid/solid interface inside (upgamma)-alumina structures and their interaction with aqueous solutions during the initial stages of impregnation.
{"title":"Multi-component ionic diffusion and proton adsorption in charged ({{upgamma}})-alumina structures: Dynamic modeling and experimental study","authors":"Rita Fayad, Yu-Yen Ting, Françoise Couenne, Christian Jallut, Aurelie Galfré, Elsa Jolimaitre, Loïc Sorbier, Charles-Philippe Lienemann, Mélaz Tayakout-Fayolle","doi":"10.1007/s10450-024-00530-2","DOIUrl":"10.1007/s10450-024-00530-2","url":null,"abstract":"<div><p><span>(upgamma)</span>-alumina is highly employed as support for hydrotreatment catalysts prepared by impregnation and as adsorbent in water treatment. These applications consist of contacting <span>(upgamma)</span>-alumina with aqueous solutions, leading to the transport of ions inside the alumina pores and their adsorption on the pore surface. These physicochemical phenomena are governed by the <span>(upgamma)</span>-alumina pore surface and the solution characteristics. Predicting the physicochemical phenomena at the liquid/solid interface is crucial to optimize the design of catalysts and of water treatment adsorption processes. However, this is very challenging using conventional analytical techniques. In this work, the diffusion of protons and their counter-ions inside <span>(upgamma)</span>-alumina pores and the adsorption of protons on the pore surface are modeled at unsteady state during contact with acid solutions at different initial pH levels. Diffusion inside pores is represented using a combination of the zero current method and the Poisson-Boltzmann equation, while the proton adsorption is described by the Langmuir adsorption isotherm. Simulations agree well with the results of proton adsorption experiments in a batch system. The model accurately predicts the distribution of species inside the electrostatic double layer at the liquid/solid interface. It also computes the surface charge and the maximal adsorption capacities of different types of hydroxyl sites present on the alumina pore surface; both are very difficult to determine experimentally. This model can serve as a guide for the comprehension of the liquid/solid interface inside <span>(upgamma)</span>-alumina structures and their interaction with aqueous solutions during the initial stages of impregnation.</p><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 8","pages":"1893 - 1912"},"PeriodicalIF":3.0,"publicationDate":"2024-09-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191528","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-02DOI: 10.1007/s10450-024-00527-x
Amany G. Braish, Asaad F. Hassan, Shimaa A. El-Essawy, Mohsen M.T. El-Tahawy
In this work, three solid adsorbents were synthesized, namely, nanozeolite-Y prepared from rice husks ash by a sol-gel method as a green biosource (ZN), chitosan as a cationic biopolymer (CS), and nanozeolite-Y/chitosan composite (CSZ). An eco-friendly composite that consists of chitosan and nanozeolite-Y was used to combine the advantages of nanoparticles with biopolymers two materials to increase the removal % of methylene blue dye. All the synthetized solid adsorbents were investigated using TGA, nitrogen adsorption, SEM, TEM, FTIR, XRD, and zeta potential. The results showed that CSZ particles had a high specific surface area (432.3 m2/g), mesoporosity (with an average pore diameter of 2.59 nm), a smaller TEM particle size (between 28.6 and 60.7 nm), a lot of chemical functional groups, and high thermal stability. CSZ exhibited the maximum adsorption capacity (141.04 mg/g) towards methylene blue. The adsorption nature of methylene blue onto CS and CSZ is endothermic, spontaneous, and a physical adsorption process, while it is exothermic, nonspontaneous, physical adsorption process in the case of ZN, as confirmed by thermodynamic results. Pseudo-second order, Elovich, Dubinin-Radushkevich, Freundlich, Langmuir, Temkin, and adsorption models all fit the MB adsorption well, with correlation coefficients reaching about 0.9997. Nitric acid was found to be the best desorbing agent, with a desorption efficiency of about 99%.
{"title":"Fabrication of nanozeolite-Y/chitosan composite based on rice husks for efficient adsorption of methylene blue dye: kinetic and thermodynamic studies","authors":"Amany G. Braish, Asaad F. Hassan, Shimaa A. El-Essawy, Mohsen M.T. El-Tahawy","doi":"10.1007/s10450-024-00527-x","DOIUrl":"10.1007/s10450-024-00527-x","url":null,"abstract":"<div><p>In this work, three solid adsorbents were synthesized, namely, nanozeolite-Y prepared from rice husks ash by a sol-gel method as a green biosource (ZN), chitosan as a cationic biopolymer (CS), and nanozeolite-Y/chitosan composite (CSZ). An eco-friendly composite that consists of chitosan and nanozeolite-Y was used to combine the advantages of nanoparticles with biopolymers two materials to increase the removal % of methylene blue dye. All the synthetized solid adsorbents were investigated using TGA, nitrogen adsorption, SEM, TEM, FTIR, XRD, and zeta potential. The results showed that CSZ particles had a high specific surface area (432.3 m<sup>2</sup>/g), mesoporosity (with an average pore diameter of 2.59 nm), a smaller TEM particle size (between 28.6 and 60.7 nm), a lot of chemical functional groups, and high thermal stability. CSZ exhibited the maximum adsorption capacity (141.04 mg/g) towards methylene blue. The adsorption nature of methylene blue onto CS and CSZ is endothermic, spontaneous, and a physical adsorption process, while it is exothermic, nonspontaneous, physical adsorption process in the case of ZN, as confirmed by thermodynamic results. Pseudo-second order, Elovich, Dubinin-Radushkevich, Freundlich, Langmuir, Temkin, and adsorption models all fit the MB adsorption well, with correlation coefficients reaching about 0.9997. Nitric acid was found to be the best desorbing agent, with a desorption efficiency of about 99%.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1643 - 1661"},"PeriodicalIF":3.0,"publicationDate":"2024-09-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s10450-024-00527-x.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191532","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-26DOI: 10.1007/s10450-024-00528-w
Jhoan M. Camargo López, José J. Martínez, María H. Brijaldo, Sergio Acevedo
Environment remediation is one of the primary goals of sustainable development and anthropogenic activities, and the use of fuels in various industrial processes through combustion has led to an increase in CO2 as well as big damage to the atmosphere by the greenhouse effect. Biochar has been used for the capture of carbon dioxide due to its high surface area. In this study, we obtained biochar from soursop seeds. The materials were synthesized by pyrolysis of precursor materials and chemical activation with chlorides of Ca and Mg at a concentration of 5% w/v. The effect of the defatting process of the soursop seeds on the obtained carbon was also researched. The absorbed solids were characterized through thermogravimetric analysis, X-ray diffraction, and CO2 adsorption, followed by infrared spectroscopy, N2-physisorption, CO2-physisorption, CO2, XPS, DRIFTS and TPD of NH3. The type of activating agent and pretreatment conditions used were more favorable than the defatted process at obtaining carbons with N2 surface areas between 26 and 220 m2g−1. The biochars were analyzed by CO2 surface area to describe the microporous framework, and the solid with the best CO2 surface area was the one with the highest CO2 adsorption. According to the statistical analyses conducted, the evaluated models Langmuir, Freundlich, and Redlich-Peterson presented good fits to the experimental data. However, the Redlich-Peterson model showed the lowest values for the residual variance, which were of the order of 0.001 or less in all cases based on the CO2 adsorption isotherms on the studied activated carbons. However, the carbons obtained by defatting showed favorable hydrophilic behavior along with adsorption capacities in the bioremediation process and affinity towards of this GHG.
{"title":"CO2 adsorption in biochars obtained from soursop (Anonna muricata) seeds by chemical activation with metallic salts","authors":"Jhoan M. Camargo López, José J. Martínez, María H. Brijaldo, Sergio Acevedo","doi":"10.1007/s10450-024-00528-w","DOIUrl":"10.1007/s10450-024-00528-w","url":null,"abstract":"<div><p>Environment remediation is one of the primary goals of sustainable development and anthropogenic activities, and the use of fuels in various industrial processes through combustion has led to an increase in CO<sub>2</sub> as well as big damage to the atmosphere by the greenhouse effect. Biochar has been used for the capture of carbon dioxide due to its high surface area. In this study, we obtained biochar from soursop seeds. The materials were synthesized by pyrolysis of precursor materials and chemical activation with chlorides of Ca and Mg at a concentration of 5% w/v. The effect of the defatting process of the soursop seeds on the obtained carbon was also researched. The absorbed solids were characterized through thermogravimetric analysis, X-ray diffraction, and CO<sub>2</sub> adsorption, followed by infrared spectroscopy, N<sub>2</sub>-physisorption, CO<sub>2</sub>-physisorption, CO<sub>2</sub>, XPS, DRIFTS and TPD of NH<sub>3</sub>. The type of activating agent and pretreatment conditions used were more favorable than the defatted process at obtaining carbons with N<sub>2</sub> surface areas between 26 and 220 m<sup>2</sup>g<sup>−1</sup>. The biochars were analyzed by CO<sub>2</sub> surface area to describe the microporous framework, and the solid with the best CO<sub>2</sub> surface area was the one with the highest CO<sub>2</sub> adsorption. According to the statistical analyses conducted, the evaluated models Langmuir, Freundlich, and Redlich-Peterson presented good fits to the experimental data. However, the Redlich-Peterson model showed the lowest values for the residual variance, which were of the order of 0.001 or less in all cases based on the CO<sub>2</sub> adsorption isotherms on the studied activated carbons. However, the carbons obtained by defatting showed favorable hydrophilic behavior along with adsorption capacities in the bioremediation process and affinity towards of this GHG.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1865 - 1880"},"PeriodicalIF":3.0,"publicationDate":"2024-08-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s10450-024-00528-w.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191533","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-14DOI: 10.1007/s10450-024-00526-y
Adam Ward, Maria M. Papathanasiou, Ronny Pini
Direct capture of CO(_2) from ambient air is technically feasible today, with commercial units already in operation. A demonstrated technology for achieving direct air capture (DAC) is chemical separation of CO(_2) in a steam-assisted temperature-vacuum swing adsorption (S-TVSA) process. However, the potential to develop scalable solutions remains high, requiring a detailed understanding of the impact of both process design and operation on the performance of the DAC unit. Here, we address this knowledge gap by presenting a state-of-the-art process simulation tool for the purification of CO(_2) from ambient air by a 5-step S-TVSA process. By considering the benchmark adsorbent APDES-NFC, we conduct multi-objective productivity/energy usage optimization of the DAC unit, subject to the requirement of producing a high purity CO(_2) product ((ge 95)%). For the base case scenario, we find a maximum productivity of Pr(_{max } = 6.20) kg/m(^3)/day and a minimum specific equivalent work of W(_{text {EQ},min } = 1.66) MJ/kg. While in reasonable agreement with published data, our results indicate that the description of both competitive adsorption and adsorption kinetics are key factors in introducing uncertainty in process model predictions. We also demonstrate that the application of formal optimization techniques, rather than design heuristics, is central to reliably assess the process performance limits. We identity that system designs employing moderate CO(_2) sorption kinetics and contactors with low length-to-radius ratios yield the best performance in terms of system productivity. Finally, we find that moderate-high ambient relative humidities (50–75%) offer significantly favourable performance, and that a wide range of feed temperatures (5–30 (^circ)C) can be accommodated via process optimization without a significant impact on performance.
{"title":"The impact of design and operational parameters on the optimal performance of direct air capture units using solid sorbents","authors":"Adam Ward, Maria M. Papathanasiou, Ronny Pini","doi":"10.1007/s10450-024-00526-y","DOIUrl":"10.1007/s10450-024-00526-y","url":null,"abstract":"<div><p>Direct capture of CO<span>(_2)</span> from ambient air is technically feasible today, with commercial units already in operation. A demonstrated technology for achieving direct air capture (DAC) is chemical separation of CO<span>(_2)</span> in a steam-assisted temperature-vacuum swing adsorption (S-TVSA) process. However, the potential to develop scalable solutions remains high, requiring a detailed understanding of the impact of both process design and operation on the performance of the DAC unit. Here, we address this knowledge gap by presenting a state-of-the-art process simulation tool for the purification of CO<span>(_2)</span> from ambient air by a 5-step S-TVSA process. By considering the benchmark adsorbent APDES-NFC, we conduct multi-objective productivity/energy usage optimization of the DAC unit, subject to the requirement of producing a high purity CO<span>(_2)</span> product (<span>(ge 95)</span>%). For the base case scenario, we find a maximum productivity of Pr<span>(_{max } = 6.20)</span> kg/m<span>(^3)</span>/day and a minimum specific equivalent work of W<span>(_{text {EQ},min } = 1.66)</span> MJ/kg. While in reasonable agreement with published data, our results indicate that the description of both competitive adsorption and adsorption kinetics are key factors in introducing uncertainty in process model predictions. We also demonstrate that the application of formal optimization techniques, rather than design heuristics, is central to reliably assess the process performance limits. We identity that system designs employing moderate CO<span>(_2)</span> sorption kinetics and contactors with low length-to-radius ratios yield the best performance in terms of system productivity. Finally, we find that moderate-high ambient relative humidities (50–75%) offer significantly favourable performance, and that a wide range of feed temperatures (5–30 <span>(^circ)</span>C) can be accommodated via process optimization without a significant impact on performance.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1829 - 1848"},"PeriodicalIF":3.0,"publicationDate":"2024-08-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s10450-024-00526-y.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191546","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-14DOI: 10.1007/s10450-024-00529-9
Pooja Kashyap, Jyotsna Kaushal
With the advent of industrialization and other anthropogenic activities, water sources are being contaminated incrementally. Groundwater contaminated by fluoride has been a major global concern for public health in recent years. Various types of materials have been employed for the removal of contaminants from water. Among all, biochar has gained attention in recent times. Biochar is a carbon-rich and environmentally friendly pollutant adsorbent important in remediating inorganic contaminants like fluoride from water. In the current study, Bryophyllum pinnatum-raw biochar and activated biochar doped with aluminum were prepared from the leaves of the Bryophyllum pinnatum (B. pinnatum) plant. The removal efficiency of raw/pristine biochar (RB) and Bryophyllum pinnatum-activated biochar (BAB) was investigated by treating both biochars with fluoride-contaminated water. The biochar was characterized using FTIR, FESEM-EDX, XRD, BET, and pHpzc techniques, which showed that the positive charges and adsorption sites were created due to the effective loading of the metal hydroxide on the biochar surface during BAB formation which played a significant role in defluoridation. To investigate the effect of different factors on the percentage of fluoride removal, batch tests were carried out. Kinetic and isotherm models were also applied to evaluate the mode of action and mechanistic approach. The results revealed that BAB exhibited a higher fluoride removal efficiency of 92% compared to RB and followed the pseudo-second-order model and Langmuir model showing chemisorption. Thus, the prepared activated biochar holds a good potential to be used as a sorbent for defluoridation.
{"title":"Bryophyllum pinnatum activated biochar for competent removal of fluoride from water: sorption and equilibrium studies","authors":"Pooja Kashyap, Jyotsna Kaushal","doi":"10.1007/s10450-024-00529-9","DOIUrl":"10.1007/s10450-024-00529-9","url":null,"abstract":"<div><p>With the advent of industrialization and other anthropogenic activities, water sources are being contaminated incrementally. Groundwater contaminated by fluoride has been a major global concern for public health in recent years. Various types of materials have been employed for the removal of contaminants from water. Among all, biochar has gained attention in recent times. Biochar is a carbon-rich and environmentally friendly pollutant adsorbent important in remediating inorganic contaminants like fluoride from water. In the current study, <i>Bryophyllum pinnatum-</i>raw biochar and activated biochar doped with aluminum were prepared from the leaves of the <i>Bryophyllum pinnatum</i> (<i>B. pinnatum</i>) plant. The removal efficiency of raw/pristine biochar (RB) and <i>Bryophyllum pinnatum</i>-activated biochar (BAB) was investigated by treating both biochars with fluoride-contaminated water. The biochar was characterized using FTIR, FESEM-EDX, XRD, BET, and pH<sub>pzc</sub> techniques, which showed that the positive charges and adsorption sites were created due to the effective loading of the metal hydroxide on the biochar surface during BAB formation which played a significant role in defluoridation. To investigate the effect of different factors on the percentage of fluoride removal, batch tests were carried out. Kinetic and isotherm models were also applied to evaluate the mode of action and mechanistic approach. The results revealed that BAB exhibited a higher fluoride removal efficiency of 92% compared to RB and followed the pseudo-second-order model and Langmuir model showing chemisorption. Thus, the prepared activated biochar holds a good potential to be used as a sorbent for defluoridation.</p><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1849 - 1864"},"PeriodicalIF":3.0,"publicationDate":"2024-08-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142191559","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
The wastewater generated from the industrial activities are considered as one of the prime sources of water contamination. The yearly production of synthetic dyes are ~ 700 tons worldwide. Synthetic dyes have detrimental effects on the human as well as animal health. Therefore, there is an urgent need to treat the water containing synthetic dyes. Dye treatment methods can be divided in to three categories namely; chemical, physical, and biological. The chemical procedure includes; photocatalytic degradation, ozonation, fenton reagent, and aerobic and anaerobic degradation are the examples of the biological procedures. However, the physical procedures consists of filtration/coagulation, adsorption, ion exchange etc. Further, these techniques may have its own drawbacks including generation of hazardous sludge and expensive to operate along with high maintenance cost. The most appealing techinque for abatement of dye from the contaminated water is adsorption owing to its ecofriendly, flexibility, affordability, sustainability, and abundant availability of raw materials to produce adsorbents. It has been noticed that over 80% of dye adsorption processes on adsorbent surfaces were endothermic in nature which means the adsorption processes were self-sustaining in terms of energy consumption. In present review paper, the discussion has been focused on the removal of anionic dyes from water using low-cost biochar adsorbents which is not reported in any previous review papers. Further, it will significantly help to the budding researchers to develop continuous water treatment system (in column mode), if wish to work of anionic dyes remediation from water.
{"title":"Sustainable biochar adsorbents for dye removal from water: present state of art and future directions","authors":"Arun Lal Srivastav, Lata Rani, Prakriti Sharda, Akansha Patel, Naveen Patel, Vinod Kumar Chaudhary","doi":"10.1007/s10450-024-00522-2","DOIUrl":"10.1007/s10450-024-00522-2","url":null,"abstract":"<div><p>The wastewater generated from the industrial activities are considered as one of the prime sources of water contamination. The yearly production of synthetic dyes are ~ 700 tons worldwide. Synthetic dyes have detrimental effects on the human as well as animal health. Therefore, there is an urgent need to treat the water containing synthetic dyes. Dye treatment methods can be divided in to three categories namely; chemical, physical, and biological. The chemical procedure includes; photocatalytic degradation, ozonation, fenton reagent, and aerobic and anaerobic degradation are the examples of the biological procedures. However, the physical procedures consists of filtration/coagulation, adsorption, ion exchange etc. Further, these techniques may have its own drawbacks including generation of hazardous sludge and expensive to operate along with high maintenance cost. The most appealing techinque for abatement of dye from the contaminated water is adsorption owing to its ecofriendly, flexibility, affordability, sustainability, and abundant availability of raw materials to produce adsorbents. It has been noticed that over 80% of dye adsorption processes on adsorbent surfaces were endothermic in nature which means the adsorption processes were self-sustaining in terms of energy consumption. In present review paper, the discussion has been focused on the removal of anionic dyes from water using low-cost biochar adsorbents which is not reported in any previous review papers. Further, it will significantly help to the budding researchers to develop continuous water treatment system (in column mode), if wish to work of anionic dyes remediation from water.</p></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1791 - 1804"},"PeriodicalIF":3.0,"publicationDate":"2024-08-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141940418","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-07DOI: 10.1007/s10450-024-00523-1
Gautham Kurup, Neeraj Krishnan, Vaishnav M. R., Roopak A. R., K. Nithya, Asha Sathish, Selvaraju Sivamani, Aswathy S. Cheruvally
The presence of heavy metal ions in water bodies constitutes a significant environmental hazard. The development of sustainable and cost-effective adsorbent materials for their removal is an urgent priority. In alignment with this critical objective, the present study explores the potential of a novel composite material for water remediation. This composite, fabricated from biochar and magnesium ferrite nanoparticles, targets the removal of hexavalent chromium and divalent nickel. While prior research has explored the application of rice husk as an adsorbent, no investigation, to our knowledge, has examined the potential of magnesium ferrite-rice husk composites for this purpose. Initial screening identified the biochar-magnesium ferrite composite (pre-calcination) as the most effective adsorbent. This composite displayed a superior surface area (151 m²/g) compared to calcined magnesium ferrite (91 m²/g) and achieved exceptional removal efficiencies for both chromium (50 mg/g) and nickel (54 mg/g). Optimal chromium removal occurred at pH 1 with a 110-minute contact time, while nickel favored a pH of 6 and the same contact time. The adsorption process was characterized as physisorption and endothermic. Notably, the composite exhibited efficient regeneration (82% for nickel and 90% for chromium) using simple acid/base solutions. The BJH analysis of pore characteristics indicated an average pore diameter of 1.5365 nm and a total pore volume of 0.17 cm³/g. The research findings demonstrate the composite’s effectiveness as a sustainable adsorbent for capturing heavy metal ions from water.
{"title":"Competitive Adsorption Studies of MgFe2O4-Biochar Nanocomposites for the Removal of Chromium and Nickel Ions in Single and Binary Metal Ion System","authors":"Gautham Kurup, Neeraj Krishnan, Vaishnav M. R., Roopak A. R., K. Nithya, Asha Sathish, Selvaraju Sivamani, Aswathy S. Cheruvally","doi":"10.1007/s10450-024-00523-1","DOIUrl":"10.1007/s10450-024-00523-1","url":null,"abstract":"<div><p>The presence of heavy metal ions in water bodies constitutes a significant environmental hazard. The development of sustainable and cost-effective adsorbent materials for their removal is an urgent priority. In alignment with this critical objective, the present study explores the potential of a novel composite material for water remediation. This composite, fabricated from biochar and magnesium ferrite nanoparticles, targets the removal of hexavalent chromium and divalent nickel. While prior research has explored the application of rice husk as an adsorbent, no investigation, to our knowledge, has examined the potential of magnesium ferrite-rice husk composites for this purpose. Initial screening identified the biochar-magnesium ferrite composite (pre-calcination) as the most effective adsorbent. This composite displayed a superior surface area (151 m²/g) compared to calcined magnesium ferrite (91 m²/g) and achieved exceptional removal efficiencies for both chromium (50 mg/g) and nickel (54 mg/g). Optimal chromium removal occurred at pH 1 with a 110-minute contact time, while nickel favored a pH of 6 and the same contact time. The adsorption process was characterized as physisorption and endothermic. Notably, the composite exhibited efficient regeneration (82% for nickel and 90% for chromium) using simple acid/base solutions. The BJH analysis of pore characteristics indicated an average pore diameter of 1.5365 nm and a total pore volume of 0.17 cm³/g. The research findings demonstrate the composite’s effectiveness as a sustainable adsorbent for capturing heavy metal ions from water.</p><h3>Graphical Abstract</h3><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":458,"journal":{"name":"Adsorption","volume":"30 7","pages":"1805 - 1827"},"PeriodicalIF":3.0,"publicationDate":"2024-08-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141940419","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}