Article
Thermodynamics
Yanjun Yin, Zili Ma
Summary: CuNCN is investigated as a novel oxidizer in thermite reactions, and the Al/CuNCN thermite system shows stronger combustion, larger energy release, and the generation of gases such as N2 and (CN)2 compared to the conventional Al/CuO thermite system. The burning flame of Al/CuNCN presents a mushroom-cloud shape and is accompanied by a large number of hot spots due to the unique combustion characteristics of blasting and gas production. The Al/CuNCN system is also able to prepare AlN materials within one second via a self-propagating route, indicating potential applications in thermite reactions and the preparation of gas generators and AlN materials.
COMBUSTION AND FLAME
(2023)
Article
Chemistry, Physical
Zongyu Wang, Haowei Li, Liyan Dang, Zepeng Pu, Zhengguan Xu, Aiping Fu, Hongliang Li
Summary: The composites of reduced graphene oxide (rGO) encapsulated porous silicon (P-Si) microspheres are constructed using metallic aluminum as a bi-functional reducing agent at low temperatures. The P-Si is prepared using SiO2 as the silicon source and AlCl3 to maintain the progress of the thermite reduction reaction. Graphene oxide is then reduced by aluminum powder and freeze-drying technique is used to construct the P-Si/rGO composite material. The resulting material exhibits excellent electrochemical performance with high capacity and cycling stability.
JOURNAL OF ALLOYS AND COMPOUNDS
(2023)
Article
Chemistry, Physical
Rebecca D. McAuliffe, Guanglong Huang, David Montiel, Apurva Mehta, Ryan C. Davis, Victoria Petrova, Katie L. Browning, James R. Neilson, Ping Liu, Katsuyo Thornton, Gabriel M. Veith
Summary: A paradigm for studying complex reaction mechanisms in material synthesis was highlighted. The use of thin-film bilayers provided a simplified system to study solid-state metathesis reactions and revealed the complexity of diffusion at solid-state interfaces.
CHEMISTRY OF MATERIALS
(2022)
Article
Genetics & Heredity
Mariana Galvao Ferrarini, Irene Ziska, Ricardo Andrade, Alice Julien-Laferriere, Louis Duchemin, Roberto Marcondes Cesar, Arnaud Mary, Susana Vinga, Marie-France Sagot
Summary: The paper presents a novel constrained-based method Totoro that integrates quantitative non-targeted metabolomic data of two different metabolic states into genome-wide metabolic models and predicts reactions most likely active during the transient state. Applied to real data, this approach was able to predict known active pathways and provide new insights into metabolism.
FRONTIERS IN GENETICS
(2022)
Article
Mechanics
Alfonso M. Ganan-Calvo, Jose M. Lopez-Herrera
Summary: Using dynamical scaling analysis, this study predicts the size and speed of ejected droplets within the experimental range of Ohnesorge and Bond numbers, showing a delicate balance in the transient ejection process around a critical Ohnesorge number and sensitivity to initial conditions. The model presented in this study impacts the statistical description of phenomena such as sea spray.
JOURNAL OF FLUID MECHANICS
(2021)
Article
Thermodynamics
Kesiany M. de Souza, Marcelo J. S. de Lemos, Elizabete Yoshie Kawachi
Summary: The article discusses the application of thermite reactions in plugging and abandonment of wells, emphasizing the importance of selecting efficient thermite mixtures and calculating reaction characteristics using thermodynamic principles. Lastly, the minimization of Gibbs free energy method is used to predict the final products, determining 2Al-Fe2O3 thermite as a promising candidate.
CONTINUUM MECHANICS AND THERMODYNAMICS
(2022)
Article
Chemistry, Physical
Enyuan Hu, Qinghao Li, Xuelong Wang, Fanqi Meng, Jue Liu, Jie-Nan Zhang, Katharine Page, Wenqian Xu, Lin Gu, Ruijuan Xiao, Hong Li, Xuejie Huang, Liquan Chen, Wanli Yang, Xiqian Yu, Xiao-Qing Yang
Summary: In the highly delithiated LiCoO2, oxygen redox occurs globally rather than forming localized dimerization. Experimental techniques like RIXS and NPDF, along with theoretical calculations, provide insights into achieving reversible deep delithiation and high energy density for LiCoO2-based electrodes.
Article
Chemistry, Multidisciplinary
Hans C. Hendrikse, Stivell Hemon-Charles, Lukas Helmbrecht, Eliane P. van Dam, Erik C. Garnett, Willem L. Noorduin
Summary: This study demonstrates a shape-preserving conversion method that overcomes the limitation of carbonate formation, converting BaCO3/SiO2 nanocomposites into tin-containing nanocomposites through a single-step cation/anion exchange driven by temporal pH change. The converted Sn-3(OH)(2)O-2/SiO2 nanocomposites show excellent preservation of 3D geometry and fine features. These nanocomposites can serve as precursors for functional compositions in next-generation optoelectronic devices.
CRYSTAL GROWTH & DESIGN
(2021)
Article
Materials Science, Multidisciplinary
Arman Ahmadi-Binahri, Mandana Adeli, M. Reza Aboutalebi, Sergey Krasikov
Summary: In this study, the application of thermite reactions in Nb2O5-Al system for fabricating novel NbAl3/Al2O3 composites was investigated. The effect of parameters such as stoichiometry and green density on the properties of the obtained composites was studied, showing that excess aluminum resulted in prolonged reaction times, lower combustion temperatures, and lower mean values of hardness. Samples with a green density of 85%TMD exhibited the most intensive reactions, highest combustion temperature, and highest mean value of hardness.
METALS AND MATERIALS INTERNATIONAL
(2022)
Article
Nanoscience & Nanotechnology
Yasuhiro Domi, Hiroyuki Usui, Kei Nishikawa, Hiroki Sakaguchi
Summary: Lanthanum silicide/silicon composite electrodes exhibit remarkable lithiation-delithiation properties, but changes in metallographic structure after cycling can lead to a decrease in reversible capacity by preventing the silicide phase from relieving stress generated by silicon. Insights into the reaction behaviors of silicide/Si composite electrodes could help improve the performance of lithium-ion batteries.
ACS APPLIED NANO MATERIALS
(2021)
Article
Energy & Fuels
Changjun Wu, Yu Wu, Xuning Feng, Huaibin Wang, Fukui Zhang, Siqi Chen, Biao Li, Tao Deng, Minggao Ouyang
Summary: This study investigates the thermal decomposition mechanism of LiNi0.8Co0.1Mn0.1O2 electrode at ultra-high temperature and discovers the heat release mechanism that leads to the thermal runaway of lithium-ion batteries. This finding is significant for improving electrode design and reducing the risk of thermal runaway.
JOURNAL OF ENERGY STORAGE
(2022)
Article
Chemistry, Multidisciplinary
Krystyna M. Demkiw, Wouter A. Remmerswaal, Thomas Hansen, Gijsbert A. van der Marel, Jeroen D. C. Codee, K. A. Woerpel
Summary: This study found that acetal substitution reactions of alpha-halogenated five- and six-membered rings can exhibit high stereoselectivity, but this stereoselectivity diminishes as nucleophilicity increases. Computational investigations confirmed that open-form oxocarbenium ions are the reactive intermediates involved, and that hyperconjugative effects and through-space electrostatic interactions contribute to the stabilization of halogen-substituted oxocarbenium ions.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
(2022)
Article
Environmental Sciences
Monika Patel, Neha Bisht, Priyanka Prabhakar, Raj Kumar Sen, Pradip Kumar, Neeraj Dwivedi, Mohammad Ashiq, D. P. Mondal, Avanish Kumar Srivastava, Chetna Dhand
Summary: We developed an effective electrochemical sensor using a ternary nanocomposite of reduced graphene oxide functionalized with polydopamine and alanine for simultaneous detection of four heavy metal ions (Cd2+, Pb2+, Fe2+, and Cu2+). The sensor exhibited high sensitivity and low interference in detecting the targeted heavy metal ions in water and soil samples with detection limits and sensitivities provided.
ENVIRONMENTAL RESEARCH
(2023)
Article
Nanoscience & Nanotechnology
Jingyi Zhang, Jian Liu, Huizeng Li, Xiaohe Li, Yuanfeng Zhao, Peng Zhao, Jiaxi Cui, Bo Yang, Yanlin Song, Yijun Zheng
Summary: This study reports a new class of chemical reaction networks that can construct life-like polymer hydrogels and exhibit both autoevolution and fuel-driven transient behaviors. The event and lifetime of each transient state can be delicately controlled by varying reaction conditions, which could guide the molecular designs of autonomous and adaptive materials.
ACS APPLIED MATERIALS & INTERFACES
(2022)
Article
Chemistry, Physical
Hideaki Oka, Takamasa Nonaka, Yasuhito Kondo, Yoshinari Makimura
Summary: In this study, an electrochemical cell capable of controlled overcharging and temperature regulation is developed, and the reactions between the electrodes and the electrolyte are investigated during heated overcharging. The results show that higher temperatures during overcharging lead to increased side reactions in the positive electrode, while the negative electrode gradually increases side reactions with increasing temperature in the normal charge-discharge region. The side reactions are induced by the oxidative decomposition of the electrolyte at the positive electrode.
JOURNAL OF POWER SOURCES
(2023)