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DFT Simulation-Based Design of 1T-MoS2 Cathode Hosts for Li-S Batteries and Experimental Evaluation.
Elaheh Hojaji, Eleftherios I Andritsos, Zhuangnan Li, Manish Chhowalla, Constantina Lekakou, Qiong Cai
Jan 25, 2023
The main challenge in lithium sulphur (Li-S) batteries is the shuttling of lithium polysulphides (LiPSs) caused by the rapid LiPSs migration to the anode and the slow reaction kinetics in the chain of LiPSs conversion. In this...
Unprecedented strong and reversible atomic orbital hybridization enables a highly stable Li-S battery.
The shuttle effect and excessive volume change of the sulfur cathode severely impede the industrial implementation of Li-S batteries. It is still highly challenging to find an efficient way to suppress the shuttle effect and...
Local charge inhomogeneity and lithium distribution in the superionic argyrodites Li<sub>6</sub>PS<sub>5</sub><i>X</i> (<i>X</i> = Cl, Br, I)
Nicolò Minafra, Marvin Kraft, Tim Bernges, Cheng Li, Roman Schlem, Benjamin Morgan, Wolfgang Zeier
Aug 03, 2020
The lithium-argyrodites Li6PS5X (X = Cl, Br, I) exhibit high lithium-ion conductivities, making them promising candidates for use in solid-state batteries. These solid electrolytes can show...
Local charge inhomogeneity and lithium distribution in the superionic argyrodites Li<sub>6</sub>PS<sub>5</sub><i>X</i> (<i>X</i> = Cl, Br, I)
Nicolò Minafra, Marvin Kraft, Tim Bernges, Cheng Li, Roman Schlem, Benjamin Morgan, Wolfgang Zeier
Aug 03, 2020
The lithium-argyrodites Li6PS5X (X = Cl, Br, I) exhibit high lithium-ion conductivities, making them promising candidates for use in solid-state batteries. These solid electrolytes can show...
Structural and mechanistic insights into fast lithium-ion conduction in Li<sub>4</sub>SiO<sub>4</sub>-Li<sub>3</sub>PO<sub>4 </sub>solid electrolytes
Yue Deng, Christopher Eames, Jean Noël Chotard, Fabien Laleìre, Vincent Seznec, Steffen Emge, Oliver Pecher, Clare P. Grey, Christian Masquelier, M. Saiful Islam
Jul 22, 2015
Solid electrolytes that are chemically stable and have a high ionic conductivity would dramatically enhance the safety and operating lifespan of rechargeable lithium batteries. Here, we apply a multi-technique approach to the...
Factors that influence quality and yield of circulating-free DNA
BACKGROUND: Circulating-free DNA (cfDNA) is under investigation as a liquid biopsy of cancer for early detection, monitoring disease progression and therapeutic response. This systematic review of the primary cfDNA literature...
Structural and mechanistic insights into fast lithium-ion conduction in Li<sub>4</sub>SiO<sub>4</sub>-Li<sub>3</sub>PO<sub>4 </sub>solid electrolytes
Yue Deng, Christopher Eames, Jean Noël Chotard, Fabien Laleìre, Vincent Seznec, Steffen Emge, Oliver Pecher, Clare P. Grey, Christian Masquelier, M. Saiful Islam
Jul 22, 2015
Solid electrolytes that are chemically stable and have a high ionic conductivity would dramatically enhance the safety and operating lifespan of rechargeable lithium batteries. Here, we apply a multi-technique approach to the...
Unprecedented and highly stable lithium storage capacity of (001) faceted nanosheet-constructed hierarchically porous TiO2/rGO hybrid architecture for high-performance Li-ion batteries.
Wen-Bei Yu, Zhi-Yi Hu, Jun Jin, Min Yi, Min Yan, Yu Li, Hong-En Wang, Huan-Xin Gao, Li-Qiang Mai, Tawfique Hasan, Bai-Xiang Xu, Dong-Liang Peng, Gustaaf Van Tendeloo, Bao-Lian Su
Jan 06, 2022
Active crystal facets can generate special properties for various applications. Herein, we report a (001) faceted nanosheet-constructed hierarchically porous TiO2/rGO hybrid architecture with unprecedented and highly stable...
Unprecedented and highly stable lithium storage capacity of (001) faceted nanosheet-constructed hierarchically porous TiO2/rGO hybrid architecture for high-performance Li-ion batteries.
Wen-Bei Yu, Zhi-Yi Hu, Jun Jin, Min Yi, Min Yan, Yu Li, Hong-En Wang, Huan-Xin Gao, Li-Qiang Mai, Tawfique Hasan, Bai-Xiang Xu, Dong-Liang Peng, Gustaaf Van Tendeloo, Bao-Lian Su
Feb 28, 2020
Active crystal facets can generate special properties for various applications. Herein, we report a (001) faceted nanosheet-constructed hierarchically porous TiO2/rGO hybrid architecture with unprecedented and highly stable...
Structure Prediction of Li--Sn and Li--Sb Intermetallics for Lithium-ion Batteries Anodes.
A variety of new stable and metastable Li–Sn and Li–Sb intermetallics are presented using the ab initio random structure searching (AIRSS) and species swapping methods. There include LiSn2–P4/mmm, Li2Sn3–P-1, Li7Sn9–P42/n...
Structure and lithium transport pathways in Li<sub>2</sub>FeSiO<sub>4</sub> cathodes for lithium batteries
The importance of exploring new low-cost and safe cathodes for large-scale lithium batteries has led to increasing interest in Li2FeSiO4. The structure of Li2FeSiO4 undergoes...
Towards prediction of ordered phases in rechargeable battery chemistry via group–subgroup transformation
Abstract The electrochemical thermodynamic and kinetic characteristics of rechargeable batteries are critically influenced by the ordering of mobile ions in electrodes or solid electrolytes....
Quantitatively analyzing the failure processes of rechargeable Li metal batteries.
Yuxuan Xiang, Mingming Tao, Guiming Zhong, Ziteng Liang, Guorui Zheng, Xiao Huang, Xiangsi Liu, Yanting Jin, Ningbo Xu, Michel Armand, Ji-Guang Zhang, Kang Xu, Riqiang Fu, Yong Yang
Jan 07, 2022
Practical use of lithium (Li) metal for high–energy density lithium metal batteries has been prevented by the continuous formation of Li dendrites, electrochemically isolated Li metal, and the irreversible formation of solid...
Towards prediction of ordered phases in rechargeable battery chemistry via group–subgroup transformation
Abstract The electrochemical thermodynamic and kinetic characteristics of rechargeable batteries are critically influenced by the ordering of mobile ions in electrodes or solid electrolytes....
Lithium-ion conductivity in Li<sub>6</sub>Y(BO<sub>3</sub>)<sub>3</sub>
Beatriz Lopez-Bermuda, Wolfgang G. Zeier, Shiliang Zhou, Anna J. Lehner, Jerry Hu, David O. Scanlon, Benjamin J. Morgan, Brent C. Melot
May 14, 2016
The development of new frameworks for solid electrolytes that exhibit fast Li-ion diffusion is critical for enabling new energy storage technologies. Here, we present a combined experimental and computational investigation into...
Structure and lithium transport pathways in Li<sub>2</sub>FeSiO<sub>4</sub> cathodes for lithium batteries
The importance of exploring new low-cost and safe cathodes for large-scale lithium batteries has led to increasing interest in Li2FeSiO4. The structure of Li2FeSiO4 undergoes...
RDF(S) Store in Object-Relational Databases
The Resource Description Framework (RDF) and RDF Schema (RDFS) recommended by World Wide Web Consortium (W3C) provide a flexible model for semantically representing data on the web. With the widespread acceptance of RDF(S) (RDF...
Published by: IGI Global Scientific Publishing
Progress towards understanding protein S-acylation
S-acylation, also known as S-palmitoylation or palmitoylation, is a reversible post-translational lipid modification in which long chain fatty acid, usually the 16-carbon palmitate, covalently attaches to a cysteine residue(s)...
Progress towards understanding protein S-acylation
S-acylation, also known as S-palmitoylation or palmitoylation, is a reversible post-translational lipid modification in which long chain fatty acid, usually the 16-carbon palmitate, covalently attaches to a cysteine residue(s)...
CT/MRI LI-RADS v2018 vs. CEUS LI-RADS v2017-Can Things Be Put Together?
Different LI-RADS core documents were released for CEUS and for CT/MRI. Both documents rely on major and ancillary diagnostic criteria. The present paper offers an exhaustive comparison of the two documents focusing on the...
Published by: Biology
Lithium-ion conductivity in Li<sub>6</sub>Y(BO<sub>3</sub>)<sub>3</sub>
Beatriz Lopez-Bermuda, Wolfgang G. Zeier, Shiliang Zhou, Anna J. Lehner, Jerry Hu, David O. Scanlon, Benjamin J. Morgan, Brent C. Melot
May 14, 2016
The development of new frameworks for solid electrolytes that exhibit fast Li-ion diffusion is critical for enabling new energy storage technologies. Here, we present a combined experimental and computational investigation into...
Iron, oxidative stress and the example of solar ultraviolet A radiation
Iron has outstanding biological importance as it is required for a wide variety of essential cellular processes and, as such, is a vital nutrient. The element holds this central position by virtue of its facile redox chemistry...
Mg<inf>x</inf>Mn<inf>2-x</inf>B<inf>2</inf>O<inf>5</inf> Pyroborates (2/3 ≤ x ≤ 4/3)
MgMnB2O5, Mg2/3Mn4/3B2O5, and Mg4/3Mn2/3B2O5 pyroborates have been prepared via a ceramic method. When charging MgMnB2O5 vs Li, all of the Mg2+ can be removed, and with subsequent cycles, 1.4 Li ions, corresponding to a capacity...
Synthesis of Li(I), Zn(II) and Mg(II) complexes of amine bis(phenolates) and their exploitation for the ring opening polymerisation of <em>rac</em>-lactide
In this paper a series of Mg(II), Li(I) and Zn(II) complexes based on two families of amine bis(phenolate)s have been prepared and structurally characterised. In the solid-state the Li(I) complexes form common Li4O4 cubes and...
Native Defects and their Doping Response in the Lithium Solid Electrolyte Li<sub>7</sub>La<sub>3</sub>Zr<sub>2</sub>O<sub>12</sub>
The Li-stuffed garnets Li xM 2M3′O 12 are promising Li-ion solid electrolytes with potential use in solid-state batteries. One strategy for optimizing ionic conductivities in these materials...
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