chemical Revealing the diverse electrochemistry of nanoparticles with scanning electrochemical cell microscopy By pubs.rsc.org Published On :: Faraday Discuss., 2024, Advance ArticleDOI: 10.1039/D4FD00115J, PaperLachlan F. Gaudin, Cameron L. BentleyThrough presenting and discussing these findings, this article seeks to highlight complications in single-NP SECCM experiments, particularly those arising from issues with sample preparation.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Scanning electrochemical probe microscopy: towards the characterization of micro- and nanostructured photocatalytic materials By pubs.rsc.org Published On :: Faraday Discuss., 2024, Advance ArticleDOI: 10.1039/D4FD00136B, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Giada Caniglia, Sarah Horn, Christine KranzThe feasibility of fabricating micro- and sub-micro-sized AFM probes based on Pt-B electrodeposition for the electrochemical detection of H2 evolution is demonstrated.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Controlling the droplet cell environment in scanning electrochemical cell microscopy (SECCM) via migration and electroosmotic flow By pubs.rsc.org Published On :: Faraday Discuss., 2024, Advance ArticleDOI: 10.1039/D4FD00080C, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Samuel F. Wenzel, Heekwon Lee, Hang RenThe contributions of migration and electroosmotic flow induced by electrochemical redox molecules in dual-barrel SECCM were characterised.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Chemical models for dense solutions By pubs.rsc.org Published On :: Faraday Discuss., 2024, 253,79-99DOI: 10.1039/D4FD00084F, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.J.-F. Dufrêche, B. Siboulet, M. DuvailHere we examine the question of the chemical models widely used to describe dense solutions, particularly ionic solutions.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Nafion coated nanopore electrode for improving electrochemical aptamer-based biosensing By pubs.rsc.org Published On :: Faraday Discuss., 2024, Advance ArticleDOI: 10.1039/D4FD00144C, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Grayson F. Huldin, Junming Huang, Julius Reitemeier, Kaiyu X. FuNafion blocks the aptamer's active sites from planar gold, while the aptamer retains its redox activity from nanoporous gold.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Emerging investigator series: in-depth chemical profiling of tire and artificial turf crumb rubber: aging, transformation products, and transport pathways By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1703-1715DOI: 10.1039/D4EM00326H, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Madison H. McMinn, Ximin Hu, Katherine Poisson, Phillip Berger, Paola Pimentel, Xinwen Zhang, Pranali Ashara, Ella L. Greenfield, Jessica Eig, Zhenyu TianChemical profiling of artificial turf crumb rubber reveals time-based trends in transformation products and transport pathways.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Pollution characteristics and risk assessment of endocrine-disrupting chemicals in surface water of national (freshwater) aquatic germplasm resource reserves in Guangdong Province By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1898-1911DOI: 10.1039/D4EM00425F, PaperTao Zhou, Jie Li, Weizhen Zhang, Yanyi Zeng, Yuan Gao, Haiyan Li, Wanling Yang, Yongzhan Mai, Qianfu Liu, Caiqin Hu, Chao WangEE2, E1, BPA, NP, and E2 were identified as high-risk substances based on comprehensive ecological risk evaluation and fish are the most sensitive organisms.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Critical insights into data curation and label noise for accurate prediction of aerobic biodegradability of organic chemicals By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, 26,1780-1795DOI: 10.1039/D4EM00431K, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Paulina Körner, Juliane Glüge, Stefan Glüge, Martin ScheringerThe newly developed classifier has a balanced accuracy of 94.2%, better than any other classification model for aerobic biodegradability so far. During the model development, some data points needed to be excluded due to a very high variance.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical The gas phase ozonolysis and secondary OH production of cashmeran, a musk compound from fragrant volatile chemical products By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, Advance ArticleDOI: 10.1039/D4EM00452C, PaperAyomide A. Akande, Nadine Borduas-DedekindWe quantified the lifetime of cashmeran, a musk compound, against 20 ppbv of O3 to be 85 days. In the presence of O2, cashmeran may influence the oxidative capacity indoors via production of secondary OH radicals (up to 5.1 × 105 molec cm−3).To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Quantitative read-across structure–property relationship (q-RASPR): a novel approach to estimate the bioaccumulative potential for diverse classes of industrial chemicals in aquatic organisms By pubs.rsc.org Published On :: Environ. Sci.: Processes Impacts, 2024, Advance ArticleDOI: 10.1039/D4EM00374H, PaperProdipta Bhattacharyya, Pabitra Samanta, Ankur Kumar, Shubha Das, Probir Kumar OjhaThe Bioconcentration Factor (BCF) is used to evaluate the bioaccumulation potential of chemical substances in reference organisms, and it directly correlates with ecotoxicity.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical A Perspective on the Future of Quantum Chemical Software: The Example of the ORCA Program Package By pubs.rsc.org Published On :: Faraday Discuss., 2024, Accepted ManuscriptDOI: 10.1039/D4FD00056K, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Frank NeeseTBCThe content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Mapping inorganic crystal chemical space By pubs.rsc.org Published On :: Faraday Discuss., 2024, Accepted ManuscriptDOI: 10.1039/D4FD00063C, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Hyunsoo Park, Anthony Onwuli , Keith Butler, Aron WalshThe combination of elements from the Periodic Table defines a vast chemical space. Only a small fraction of these combinations yields materials that occur naturally or are accessible synthetically. Here,...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Significant adsorption enhancements driven by pore microenvironment tuning for efficient C2H2/C2H4 separation in a chemically stable Ni7-cluster-based framework By pubs.rsc.org Published On :: Inorg. Chem. Front., 2024, Advance ArticleDOI: 10.1039/D4QI01856G, Research ArticleYunli Wang, Rizhao Zhang, Jin-Peng Xue, Yuqiao Chai, Bao Li, Jia LiThis study presents a stable Ni7-cluster MOF with enhanced adsorption through pore microenvironment tuning. Two types of guest-free frameworks achieve C2H2/C2H4 separation, providing deep insights into separation mechanisms.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Engineering a pyrene MOF composite photocatalyst toward the formation of carbon dioxide radical anions through regulating the charge transfer from type II to Z scheme via a chemical bond-modulated strategy By pubs.rsc.org Published On :: Inorg. Chem. Front., 2024, Advance ArticleDOI: 10.1039/D4QI02072C, Research ArticleXin Zhao, Yajun Zhao, Yuan-Peng Li, Pengbo Lyu, Chunying Chen, Zong-Wen Mo, Chao Peng, Jiewei Liu, Li ZhangA new approach was reported for regulating the charge transfer mechanism in a pyrene-based MOF composite, transitioning from a type-II to a Z-scheme configuration.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical The „chemical tug-of-war” in carborane clusters: distinct tuning on different sides of the cluster By pubs.rsc.org Published On :: Inorg. Chem. Front., 2024, Accepted ManuscriptDOI: 10.1039/D4QI02566K, Research ArticleDalma Gál, Daniel Buzsaki, Balázs Szathmári, Tamas Holczbauer, Antal Udvardy, Júlia Kertész Szilágyiné, Denis Kargin, Clemens Bruhn, Rudolf Pietschnig, Zsolt KelemenThe special C-C bond in the icosahedral closo-dicarbadodecaboranes and its high plasticity have been highlighted several times, which is reflected in the ease of tuning the C-C bond distance with...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Exploring the optimal post-treatment strategy for boosting the electrochemical performances of a new bimetal–organic framework-based supercapacitor By pubs.rsc.org Published On :: Inorg. Chem. Front., 2024, Advance ArticleDOI: 10.1039/D4QI02314E, Research ArticleXinwen Dou, Mingyue Liu, Tian Cao, Chan Wang, Yingjie Zhang, Yuhang Jia, Qiang Ju, Zhenlan FangEffects of four kinds of post-treatment strategies on the structures, morphologies, and electrochemical behaviors of MOF derivatives are systematically investigated for the first time.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Rationally reconstructing the surface microstructure of a chemical bath deposited electron transport layer for efficient and stable perovskite solar cells By pubs.rsc.org Published On :: Inorg. Chem. Front., 2024, 11,7910-7920DOI: 10.1039/D4QI01808G, Research ArticleXinxuan Yang, Lexin Wang, Meihan Liu, Jiahui Jin, Lili Yang, Lin Fan, Maobin Wei, Huilian Liu, Haoran Chen, Jinghai Yang, Yulei Chang, Fengyou WangA reconstruction strategy is designed to manipulate the surface microstructure of a CBD SnO2 ETL, yielding PSCs with a high PCE >24%.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical A miniprotein receptor electrochemical biosensor chip based on quantum dots By pubs.rsc.org Published On :: Lab Chip, 2024, 24,1875-1886DOI: 10.1039/D3LC01100C, PaperYunong Zhao, Juan Han, Jing Huang, Qing Huang, Yanbing Tao, Ruiqin Gu, Hua-Yao Li, Yang Zhang, Houjin Zhang, Huan LiuWe developed an on-chip laboratory for biomolecule interactions and kinetics analysis based on the three-electrode and high electron mobility transistor (HEMT) chip platform.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Technoeconomic analysis of fine chemical electrosynthesis: a case study using electrooxidation of 2-methylnaphthelene to vitamin K3 By pubs.rsc.org Published On :: React. Chem. Eng., 2024, Advance ArticleDOI: 10.1039/D4RE00346B, PaperQifeng Yang, Liping Liang, Ning Xu, Yang Li, Zhihui Wang, Dadong Shen, Yiming MoA cerium-mediated electrooxidation method was developed for synthesizing vitamin K3 in a green and efficient manner. A systematic technoeconomic analysis was provided to understand its potential for practical implementation.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Two-temperature model of the non-thermal chemical dissociation of CO2 By pubs.rsc.org Published On :: React. Chem. Eng., 2024, Advance ArticleDOI: 10.1039/D4RE00300D, PaperQ. Shen, A. Pikalev, F. J. J. Peeters, J. Gans, M. C. M. van de SandenA two-temperature model with a vibrational temperature different from the gas temperature is presented for the decomposition of CO2.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Catalytic pyrolysis and in situ carbonization of walnut shells: poly-generation and enhanced electrochemical performance of carbons By pubs.rsc.org Published On :: RSC Adv., 2024, 14,12255-12264DOI: 10.1039/D4RA01608D, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Wenjing He, Keling Liu, Lanjun Zhang, Muxin Liu, Zhengjie Ni, Yueyang Li, Duoduo Xu, Minjie Cui, Yibo ZhaoCoupling catalytic pyrolysis and carbonization of walnut shells in one step can indeed lead to improvements in both the quality of bio-oil and gas produced, as well as the electrochemical performance of the resulting carbons.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Gamma-irradiated stibnite thin films set a remarkable benchmark performance for photoelectrochemical water splitting By pubs.rsc.org Published On :: RSC Adv., 2024, 14,12475-12495DOI: 10.1039/D4RA01382D, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Adel ChihiThe study sets out to show the positive impact of sulfur vacancy engineering on the structural, morphological, optical, electrical, and photoelectrochemical (PEC) properties of Sb2S3 films synthesized using the spin coating technique.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Tunable thermal diffusivity of silk protein assemblies based on their structural control and photo-induced chemical cross-linking By pubs.rsc.org Published On :: RSC Adv., 2024, 14,12449-12453DOI: 10.1039/D3RA06473E, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Michihiro Tanaka, Toshiki Sawada, Keiji Numata, Takeshi SerizawaThe tunable thermal diffusivity of silk fibroin-based assemblies (films) is demonstrated here. The control of secondary structures and subsequent photo-induced chemical cross-linking are essential for heat conduction in the films.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemical oxidative radical cascade cyclization of dienes and diselenides towards the synthesis of seleno-benzazepines By pubs.rsc.org Published On :: RSC Adv., 2024, 14,12556-12560DOI: 10.1039/D4RA01914H, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Ling Hu, Jingyi Zhang, Minghan Li, Yulin Feng, Fangling LuAn electrochemical approach to access seleno-benzazepines through an oxidative radical cascade cyclization of dienes with diselenides under metal-free, external oxidant-free and base-free conditions.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Correction: Facile fabrication of a graphene-based chemical sensor with ultrasensitivity for nitrobenzene By pubs.rsc.org Published On :: RSC Adv., 2024, 14,12633-12633DOI: 10.1039/D4RA90041C, Correction Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Ali Raza, Zaka Ullah, Adnan Khalil, Rashida Batool, Sajjad Haider, Kamran Alam, Nazmina Imrose Sonil, Alvi Muhammad Rouf, Muhammad Faizan NazarThe content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical High performance electrochemical CO2 reduction over Pd decorated cobalt containing nitrogen doped carbon By pubs.rsc.org Published On :: RSC Adv., 2024, 14,13017-13026DOI: 10.1039/D4RA01641F, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Shayan Gul, Fatima Nasim, Waheed Iqbal, Amir Waseem, Muhammad Arif NadeemEfficient electrocatalytic CO2 reduction reaction (eCO2RR) to various products, such as carbon monoxide (CO), is crucial for mitigating greenhouse gas emissions and enabling renewable energy storage.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Grind, shine and detect: mechanochemical synthesis of AIE-active polyaromatic amide and its application as molecular receptor of monovalent anions or nucleotides By pubs.rsc.org Published On :: RSC Adv., 2024, 14,13227-13236DOI: 10.1039/D4RA02129K, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Jakub S. Cyniak, Artur KasprzakThe mechanochemical synthesis of AIE-active amide, as well as the application of the title compound as molecular receptor of monovalent anions and nucleotides, are described.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Chemically engineered exogenous organic reactions in living cells for in situ fluorescence imaging and biomedical applications By pubs.rsc.org Published On :: J. Mater. Chem. B, 2024, Advance ArticleDOI: 10.1039/D4TB01925C, Review ArticleGang Song, Zhiwen Yang, Yiming Huang, Haotian Bai, Fengting Lv, Shu WangKey intracellular in situ synthesis processes, including the synthesis of near-infrared fluorescent dyes, intracellular oxidative cross-linking, polymerization, and bioorthogonal reactions, as well as their biomedical applications were summarized.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Towards the rational design of N-(1,3-dimethylbutyl)-N'-phenyl-1,4-benzenediamine (6PPD) electrochemical sensor By pubs.rsc.org Published On :: Analyst, 2024, 149,5165-5173DOI: 10.1039/D4AN00973H, PaperEmily Dominique, Christophe RenaultThe strong adsorption of 6PPD onto glassy carbon and its reversible two electron oxidation enables simple and sensitive electrochemical detection with an LOD of 10 nM.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical A cerium-doped tungsten trioxide-functionalized sensing platform for photoelectrochemical detection of ascorbic acid with high sensitivity By pubs.rsc.org Published On :: Analyst, 2024, 149,5206-5212DOI: 10.1039/D4AN01165A, PaperXueying Zhu, Tikai Liang, Dianping TangA highly efficient photoelectrochemical (PEC) strategy was proposed for the determination of ascorbic acid (AA).The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Reference-free quantitative mass spectrometry in the presence of nonlinear distortion caused by in situ chemical reactions among constituents By pubs.rsc.org Published On :: Analyst, 2024, 149,5320-5328DOI: 10.1039/D4AN00961D, PaperYusuke HibiNonlinear reference-free analysis in pyrolysis-MS enables accurate compositional analysis even in reactive and interactive systems.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Detection of several volatile organic compounds through Ar+ induced chemical ionisation using inductively coupled plasma-tandem mass spectrometry (ICP-MS/MS) By pubs.rsc.org Published On :: Analyst, 2024, 149,5174-5183DOI: 10.1039/D4AN00996G, PaperTakafumi Hirata, Kyoko Kobayashi, Hui Hsin Khoo, Osamu Shikino, Hisashi AsanumaA new analytical technique for detection of organic compounds using inductively coupled plasma-tandem mass spectrometry (ICP-MS/MS) is described.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Current trends in electrochemical approaches for liver biomarker detection: a mini-review By pubs.rsc.org Published On :: Analyst, 2024, 149,5156-5164DOI: 10.1039/D4AN01109K, Minireview Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Derya Yaman, Melanie Jimenez, Sofia Ferreira Gonzalez, Damion CorriganElectrochemical detection of liver biomarkers, including aspartate aminotransferase (AST), alanine aminotransferase (ALT), bilirubin, gamma-glutamyl transferase (GGT), alkaline phosphatase (ALP), and albumin, all with vital physiological functions.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Alterations of the chemical profile of cholesterol in cancer tissue as traced with ToF-SIMS By pubs.rsc.org Published On :: Analyst, 2024, 149,5344-5352DOI: 10.1039/D4AN01050G, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Auraya Manaprasertsak, Julhash U. Kazi, Catharina Hagerling, Kenneth J. Pienta, Per Malmberg, Emma U. HammarlundThis study uses Time-of-Flight Secondary Ion Mass Spectrometry (ToF-SIMS) to analyze cholesterol alterations in cancer tissue, revealing changes in fragmentation and isotopes that suggest potential diagnostic vulnerabilities.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemical and imaging evaluations of electrochemically activated screen-printed gold electrodes By pubs.rsc.org Published On :: Analyst, 2024, 149,5401-5410DOI: 10.1039/D4AN00990H, PaperNor Dyana Zakaria, Ibrahim Luqman Salih, Hairul Hisham Hamzah, Turgut Sönmez, Muhamad Huzaifah Omar, Noorhashimah Mohamad Nor, Khairunisak Abdul Razak, Venugopal BalakrishnanThe graphic abstract displays the integration of the SPGE measurement system with an electrochemical cell-based 3D printing to evaluate the electrochemical behaviors and 3D images of both unactivated and activated SPGEs.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Effects of media composition and light exposure on the electrochemical current response during scanning electrochemical microscopy live cell imaging By pubs.rsc.org Published On :: Analyst, 2024, 149,5555-5562DOI: 10.1039/D4AN01075B, PaperNikita Thomas, Mengzhen Lyu, Jadon Khouv, Dhésmon Lima, Sabine KussThe cellular electrochemical current response is impacted by media composition and light exposure during scanning electrochemical microscopy (SECM).The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemical Sensing of Sodium ions present in Bovine Serum using 4-tert Butylcalix[4]arene as Receptor By pubs.rsc.org Published On :: Analyst, 2024, Accepted ManuscriptDOI: 10.1039/D4AN01297F, PaperAdrian Ebenazer Paul, Gaurav Gaur, Abdullah Alswieleh, Jerry J. Wu, Sambandam AnandanThe concentration of sodium ions can cause severe imbalances (high pressure on blood vessels, swelling of the muscular tissues, and misfunctioning of the whole nervous system) to the system in...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemically modulated surface plasmon waves for characterization and interrogation of DNA-based sensors By pubs.rsc.org Published On :: Analyst, 2024, Advance ArticleDOI: 10.1039/D4AN01164C, PaperAnil Sharma, Thomas Hulse, Aymen H. Qatamin, Monica Moreno, Klester S. Souza, Marcelo B. Pereira, Fabricio S. Campos, Leandro B. Carneiro, Antonio M. H. de Andrade, Paulo M. Roehe, Flavio Horowitz, Sergio B. MendesThis article focuses on the application of electrochemically modulated surface plasmon waves for structural characterization and for assessing signal transduction performance of redox-labeled DNA-based sensing platforms.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Comparing coupled cluster and composite quantum chemical methods for computing activation energies and reaction enthalpies of radical propagation reactions By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, 26,27536-27543DOI: 10.1039/D4CP03676J, PaperTimothy B. Huber, Ralph A. WheelerThe accuracy of DLPNO-CCSD(T)/CBS and composite methods G3(MP2)-RAD and CBS-RAD is assessed against CCSD(T)/aug-cc-pVTZ for activation energies and reaction enthalpies in hydrocarbon radical addition reactions relevant to free radical polymerization.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemical system of nitrogen-doped TiO2, Fe–N–C, and copper hexacyanoferrate electrodes for photo-assisted energy conversion in acidic wastewater treatment By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, 26,27498-27509DOI: 10.1039/D4CP02063D, PaperBianca Tainá Ferreira, Matheus Martins, Fritz HugueninThis study examines the electrochemical performance of nitrogen-doped TiO2, Fe–N–C, and CuHCF electrodes for energy conversion in acidic solution neutralization, capturing 62.9 kJ per mole of protons.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Fundamental basis of mechanochemical reactivity By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, 26,27245-27247DOI: 10.1039/D4CP90153C, EditorialAdam A. L. Michalchuk, Francesco DeloguThis themed collection includes a collection of articles on the fundamental basis of mechanochemical reactivity.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Insight into physico-chemical properties of oxalatoborate-based ionic liquids through combined experimental-theoretical characterization By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Advance ArticleDOI: 10.1039/D4CP02296C, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Matteo Palluzzi, Giorgia Mannucci, Akiko Tsurumaki, Matteo Busato, Maria Assunta Navarra, Paola D’AngeloAn anion–anion attraction was inferred from the thermal behavior of oxalate-borate ionic liquids and confirmed through computational methods.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Exploring the electrochemical properties and lithium insertion mechanisms in akaganeite (β-FeOOH) – a combined DFT/experimental study By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Advance ArticleDOI: 10.1039/D4CP02947J, PaperPaulo Roberto Garcês Gonçalves, Heitor Avelino De Abreu, Luciano Andrey Montoro, Gabriela Cordeiro Silva, Angela de Mello Ferreira, Hélio Anderson DuarteUnveiling the unique charge/discharge characteristics of akaganeite offers valuable insights into electron transfer mechanisms through experimental and DFT calculations.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Investigation on the combustion mechanism for NF3/H2 in DF/HF chemical lasers: a new perspective based on deep potential molecular dynamics simulations By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Advance ArticleDOI: 10.1039/D4CP03014A, PaperYinhua Ma, Dongmei Mu, Meiheng Lv, Nan Wang, Huaxin Liu, Fangjian Shang, Jianyong LiuCombustion-driven deuterium fluoride/hydrogen fluoride (DF/HF) lasers are a crucial type of chemical lasers.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Theoretical Insights into the Vibrational Spectra and Chemical Bonding of Ln(III) Complexes with a Tripodal N4O3 Ligand Along the Lanthanide Series By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Accepted ManuscriptDOI: 10.1039/D4CP03677H, PaperFrancielle C Machado, Mateus M Quintano, Carlos Vital dos Santos Junior, Albano Carneiro Neto, Elfi Kraka, Ricardo Luiz Longo, Renaldo Tenorio Moura Jr.{This study provides new theoretical insights into the vibrational spectra of Ln(III) complexes, along the lanthanide series by utilizing the LModeAGen protocol and integrating cutting-edge topological ideas. It provides a...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Multi-scale study on the electrochemical behavior and corrosion mechanism of 5083 aluminum alloy with different microstructures in a NaCl environment By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Advance ArticleDOI: 10.1039/D4CP03380A, PaperZhijie Dai, Zhengbing Xiao, Dahong Zhao, Sunhang Xiao, Yuanchun Huang, Qingsong DaiMulti-scale study on the electrochemical behavior and corrosion mechanism of 5083 aluminum alloy with different microstructures in a NaCl environment.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Magnetic field enhanced discharge and water activation of atmospheric pressure plasma jet: effect of assistance region and underlying physico-chemical mechanism By pubs.rsc.org Published On :: Phys. Chem. Chem. Phys., 2024, Accepted ManuscriptDOI: 10.1039/D4CP03938F, PaperXiongfeng Zhou, Bin Chen, Hua Liao, Kun LiuMagnetic field-assistance holds the promise of becoming a new or complementary approach to enhance the efficiency of atmospheric pressure plasma jet (APPJ), but there is currently a lack of research...The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Sixty years of electrochemical optical spectroscopy: a retrospective By pubs.rsc.org Published On :: Chem. Soc. Rev., 2024, 53,3579-3605DOI: 10.1039/D3CS00734K, Review Article Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Chao-Yu Li, Zhong-Qun TianAfter sixty years of development, electrochemical optical spectroscopy has evolved from the early phase of proof-of-concept to an advanced phase with various spectroscopic modes and has contributed significantly to the field of electrochemistry.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Electrochemical coupling in subnanometer pores/channels for rechargeable batteries By pubs.rsc.org Published On :: Chem. Soc. Rev., 2024, 53,3829-3895DOI: 10.1039/D3CS01043K, Review ArticleYao-Jie Lei, Lingfei Zhao, Wei-Hong Lai, Zefu Huang, Bing Sun, Pauline Jaumaux, Kening Sun, Yun-Xiao Wang, Guoxiu WangThis review categorizes subnanometer pores/channels (SNPCs) from structural perspective and demonstrates electrochemical couplings in SNPCs for batteries while proposing corresponding challenges and future research directions.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article
chemical Synthesis of environmentally friendly energetic cocrystal derived from commodity chemicals By pubs.rsc.org Published On :: Chem. Commun., 2024, Advance ArticleDOI: 10.1039/D4CC04037F, Communication Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Kazuki Inoue, Yosuke Nishiwaki, Mieko Kumasaki, Shinya Matsumoto, Ken OkadaAmmonium nitrate/glycine (2 : 1) energetic cocrystal was synthesized to address two drawbacks of ammonium nitrate: phase transitions and hygroscopicity. The cocrystal did not show phase transitions and exhibited decreased hygroscopicity.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry Full Article