Bidirectional heterostructures consisting of graphene and lateral MoS<sub>2</sub>/WS<sub>2</sub> composites: a first-principles study

Tang, Yingqi; Li, Hao; Mao, Xiaotong; Xie, Ju; Lee, Jin Yong; Fu, Aiping

doi:10.1039/c9ra05692k

Cited by 5 publications

(1 citation statement)

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“…Two‐dimensional (2D) materials have received attention due to their extraordinary chemical and physical properties, such as large surface area, high carrier mobility (1000 cm 2 /V s), and excellent electronic properties [1–8]. Recently, the 15th group elements (P, As, and Sb) nanosheets, denoted as phosphorene (P), arsenene (As), and antimonene (Sb), respectively, have emerged as novel 2D materials with semiconducting electronic properties [2, 5, 8–13].…”

Section: Introductionmentioning

confidence: 99%

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Tang

Huai

et al. 2021

Int J of Quantum Chemistry

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Density functional theory calculations have been performed to study the adsorption behavior of ionic liquids (ILs) on 15th group nanosheets including phosphorene (BP), arsenene (As), and antimonene (Sb). Three ILs based on 1‐ethyl‐3‐methylimidazolium ([EMIM]+), tetramethylammonium ([TMA]+), and N‐methylpyridinium ([MPI]+) cations paired with tetrafluoroborate ([BF4]−) anion were selected as adsorbates on different 2D nanosheets to explore the interfacial behavior. The calculated structural, energy, charge transfer, and electronic properties of the adsorption systems for ILs/nanosheets exhibit combination by non‐covalent interaction. Adsorption of ILs induces a very small reduction of band gap for BP, As, and Sb nanosheets, and the electronic properties of nanosheets are nearly unchanged. These results increase understanding of the experimental mechanism for IL dispersion 2D materials and suggest that ILs can be used to functionalize elemental 15th group nanosheets for further applications in various fields.

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Section: Introductionmentioning

confidence: 99%

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Tang

Huai

et al. 2021

Int J of Quantum Chemistry

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Atomically Thin Nanosheets Confined in 2D Heterostructures: Metal‐Ion Batteries Prospective

Khan

Azadmanjiri

et al. 2021

Advanced Energy Materials

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Owing to the surge of energy storage devices, lithium and beyond‐lithium metal ion batteries (MIBs) have gained considerable research attention. The large size and multivalent ions drastically deteriorate the performance of conventional battery electrode materials which demands unique types of structures in order to fulfill the electrode requirements of next‐generation MIBs. Developing atomically thin nanosheets confined in 2D heterostructures is a favorable choice to synergistically handle the deficiencies of individual 2D materials and achieve distinct physical and electrochemical properties, retaining their 2D features. This article sheds light on the significance and characteristics of graphene‐based and beyond‐graphene 2D heterostructures as electrode materials in lithium‐ion, sodium‐ion, potassium‐ion, magnesium‐ion, and aluminum‐ion batteries. In this regard, the pathways for the selection of 2D heterostructures electrode materials and their possible geometric configurations are first recognized. Second, the fundamental science, underlying charge storage mechanisms, and robust interfacial charge transfer processes in 2D heterostructures are discussed comprehensively in the context of recent computational studies. Third, the recent state‐of‐the‐art experimental approaches for the fabrication of novel 2D heterostructures and their performance as anode and cathode materials for MIBs are discussed systematically. Finally, the current challenges facing 2D heterostructures and potential future research directions in the context of advanced MIBs are highlighted.

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Interfacial lattice coupling engineering in all-inorganic coupled flexible films for dielectric energy storage

Zhao,

Zhang,

Chen

et al. 2024

Acta Materialia

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Bidirectional heterostructures consisting of graphene and lateral MoS₂/WS₂ composites: a first-principles study

Abstract: The properties of G@(MoS2)X/(WS2)4−X bidirectional heterostructures under the external electric fields have been investigated by first principles calculations.

Cited by 5 publications

References 56 publications

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Atomically Thin Nanosheets Confined in 2D Heterostructures: Metal‐Ion Batteries Prospective

Interfacial lattice coupling engineering in all-inorganic coupled flexible films for dielectric energy storage

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Bidirectional heterostructures consisting of graphene and lateral MoS2/WS2 composites: a first-principles study

Abstract: The properties of G@(MoS2)X/(WS2)4−X bidirectional heterostructures under the external electric fields have been investigated by first principles calculations.

Cited by 5 publications

References 56 publications

Adsorption of [BF4]− anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Adsorption of [BF4]− anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Atomically Thin Nanosheets Confined in 2D Heterostructures: Metal‐Ion Batteries Prospective

Interfacial lattice coupling engineering in all-inorganic coupled flexible films for dielectric energy storage

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Product

Resources

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Bidirectional heterostructures consisting of graphene and lateral MoS₂/WS₂ composites: a first-principles study

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study

Adsorption of [BF₄]⁻ anion‐based ionic liquids on phosphorene, arsenene, and antimonene: A density functional theory study