Cargando…

Unravelling the alkali transport properties in nanocrystalline A(3)OX (A = Li, Na, X = Cl, Br) solid state electrolytes. A theoretical prediction

Transport properties of the halogeno-alkali oxides A(3)OX (A = Li, Na, X = Cl, Br) nanocrystalline samples with the presence of ∑3(111) grain boundaries were computed using large-scale molecular dynamic simulations. Results on the diffusion/conduction process show that these nanocrystalline samples...

Descripción completa

Detalles Bibliográficos
Autores principales:	Van Duong, Long, Nguyen, Minh Tho, Zulueta, Yohandys A.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2022
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9272413/ https://www.ncbi.nlm.nih.gov/pubmed/35919608 http://dx.doi.org/10.1039/d2ra03370d

Ejemplares similares

Coherence in the Ferroelectric A(3)ClO (A = Li, Na) Family of Electrolytes
por: Braga, Maria Helena
Publicado: (2021)

Unraveling the Bonding Complexity of Polyhalogen Anions: High-Pressure Synthesis of Unpredicted Sodium Chlorides Na(2)Cl(3) and Na(4)Cl(5) and Bromide Na(4)Br(5)
por: Yin, Yuqing, et al.
Publicado: (2023)

Lithium-Ion Transport in Nanocrystalline Spinel-Type Li[In(x)Li(y)]Br(4) as Seen by Conductivity Spectroscopy and NMR
por: Gombotz, Maria, et al.
Publicado: (2020)

Study of the Structure and Infrared Spectra of LiF, LiCl and LiBr Using Density Functional Theory (DFT)
por: Chruszcz-Lipska, Katarzyna, et al.
Publicado: (2023)

Vapor–Liquid Equilibrium Study of LiBr + H(2)O and LiBr + CaCl(2) + H(2)O Systems
por: Wang, Huinan, et al.
Publicado: (2020)

Unraveling Li growth kinetics in solid electrolytes due to electron beam charging
por: Peng, Xinxing, et al.
Publicado: (2023)

Charge Transport in Water–NaCl Electrolytes with Molecular Dynamics Simulations
por: Gullbrekken, Øystein, et al.
Publicado: (2023)

Preparation and Application of a NaCl-KCl-CsCl-Cs(2)ZrCl(6) Composite Electrolyte
por: Zou, Wenzhen, et al.
Publicado: (2023)

CeCl(3)/n‐BuLi: Unraveling Imamoto's Organocerium Reagent
por: Berger, Tassilo, et al.
Publicado: (2021)

Addressing Manufacturability and Processability in Polymer Gel Electrolytes for Li/Na Batteries
por: Gregorio, Víctor, et al.
Publicado: (2021)

Charge and spin state of dilute Fe in NaCl and LiF
por: Gunnlaugsson, H P, et al.
Publicado: (2022)

Kinetic regulation of MXene with water-in-LiCl electrolyte for high-voltage micro-supercapacitors
por: Zhu, Yuanyuan, et al.
Publicado: (2022)

Three-Dimensional BiOI/BiOX (X = Cl or Br) Nanohybrids for Enhanced Visible-Light Photocatalytic Activity
por: Liu, Yazi, et al.
Publicado: (2017)

Thermochemical stability, and electronic and dielectric properties of Janus bismuth oxyhalide BiOX (X = Cl, Br, I) monolayers
por: Das, Tilak, et al.
Publicado: (2020)

Design of a Novel Series of Hetero-Binuclear Superhalogen Anions MM′X(4) (−) (M = Li, Na; M′ = Be, Mg, Ca; X = Cl, Br)
por: Yang, Hui, et al.
Publicado: (2022)

Unraveling the Catalyst‐Solvent Interactions in Lean‐Electrolyte Sulfur Reduction Electrocatalysis for Li−S Batteries
por: Li, Huan, et al.
Publicado: (2022)

Studies of mutual neutralization in collisions involving Mg(+)/H(−), Na(+)/H(−), Li(+)/H(−) and Li(+)/Cl(−)
por: Nkambule, Sifiso M., et al.
Publicado: (2022)

Solid-liquid equilibria in relevant subsystems of LiBr-NaBr-KBr-MgBr(2)-CaBr(2)-H(2)O system at 298.15 K
por: Cui, Ruizhi, et al.
Publicado: (2023)

Shifts in the ESR Spectra of Alkali-Metal Atoms (Li, Na, K, Rb) on Helium Nanodroplets
por: Hauser, Andreas W, et al.
Publicado: (2013)

New-concept Batteries Based on Aqueous Li(+)/Na(+) Mixed-ion Electrolytes
por: Chen, Liang, et al.
Publicado: (2013)

Thermodynamic Properties of Ternary Systems Containing (LiCl and LiBr) + Propylene Carbonate + Ionic Liquid (1-Alkyl-3-methylimidazolium Thiocyanate)
por: Golmohammadi, Behrang, et al.
Publicado: (2021)

Comparative Study of Methanol Activation by Different Small Mixed Silicon Clusters Si(2)M with M = H, Li, Na, Cu, and Ag
por: Dieu Hang, Tran, et al.
Publicado: (2017)

Strategies of NaCl Tolerance in Saline–Alkali-Tolerant Green Microalga Monoraphidium dybowskii LB50
por: Yang, Haijian, et al.
Publicado: (2023)

Exploiting Coordination Effects for the Regioselective Zincation of Diazines Using TMPZnX⋅LiX (X=Cl, Br)
por: Kremsmair, Alexander, et al.
Publicado: (2022)

Molecular Insights into Aqueous NaCl Electrolytes Confined within Vertically-oriented Graphenes
por: Bo, Zheng, et al.
Publicado: (2015)

Porosity of Solid Electrolyte Interphases on Alkali Metal Electrodes with Liquid Electrolytes
por: Lim, Kyungmi, et al.
Publicado: (2021)

Real-time tracking the Li(+)-ion transition behavior and dynamics in solid Poly(vinyl alcohol)/LiClO(4) electrolytes
por: Bao, Lixia, et al.
Publicado: (2017)

Presence of Li Clusters in Molten LiCl-Li
por: Merwin, Augustus, et al.
Publicado: (2016)

Contrasting Thermoelectric Transport Behaviors of p-Type PbS Caused by Doping Alkali Metals (Li and Na)
por: Hou, Zhenghao, et al.
Publicado: (2020)

Theoretical investigation on the addition reaction of the germylenoid H(2)GeLiCl with acetone
por: ZHANG, Xiaolin, et al.
Publicado: (2021)

Electrolytic extraction of dysprosium and thermodynamic evaluation of Cu–Dy intermetallic compound in eutectic LiCl–KCl
por: Han, Wei, et al.
Publicado: (2018)

Molecular Characterization of a Tolerant Saline-Alkali Chlorella Phosphatidate Phosphatase That Confers NaCl and Sorbitol Tolerance
por: Wang, Jingang, et al.
Publicado: (2021)

Novel Unexpected Reconstructions of (100) and (111) Surfaces of NaCl: Theoretical Prediction
por: Kvashnin, Alexander G., et al.
Publicado: (2019)

Influence of Porosity of Sulfide-Based Artificial Solid Electrolyte Interphases on Their Performance with Liquid and Solid Electrolytes in Li and Na Metal Batteries
por: Lim, Kyungmi, et al.
Publicado: (2022)

Solid–Liquid Phase Equilibria of Quaternary System LiBr–NaBr–KBr–H(2)O and Its Subsystems at 348.15 K
por: Nie, Guo-liang, et al.
Publicado: (2022)

Unveiling Solid Electrolyte Interphase Formation at the Molecular Level: Computational Insights into Bare Li-Metal Anode and Li(6)PS(5–x)Se(x)Cl Argyrodite Solid Electrolyte
por: Golov, Andrey, et al.
Publicado: (2023)

Bismuth Oxyhalide-Based Materials (BiOX: X = Cl, Br, I) and Their Application in Photoelectrocatalytic Degradation of Organic Pollutants in Water: A Review
por: Castillo-Cabrera, G. Xavier, et al.
Publicado: (2022)

Mechanochemical Synthesis and Structure of Lithium Tetrahaloaluminates, LiAlX(4) (X = Cl, Br, I): A Family of Li-Ion Conducting Ternary Halides
por: Flores-González, Nicolás, et al.
Publicado: (2021)

Theoretical insight into the interaction between SnX(2) (X = H, F, Cl, Br, I) and benzene
por: Matczak, Piotr
Publicado: (2016)

Theoretical Assessment of Thermodynamic Stability in Nanocrystalline Metallic Alloys
por: Locci, Antonio Mario
Publicado: (2019)

Cannot write session to /tmp/vufind_sessions/sess_cg0qk4gp6ku75d4f55gnfu45ev