Van der Waals heterostructure of graphene Defected&Doped X(X = Au, N) composite ZnO monolayer: A First Principle study

2D van der Waals (vdW) heterostructures as potential materials for solar energy-related applications have been brought to the forefront for researchers. Here, by employing first-principle calculations, we proposed that PtS2/GaSe...

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Optoelectronic response and interlayer exciton features of MoS2/WS2 Van der Waals heterostructure within first principle calculations and Wannier Mott model

Superlattices and Microstructures ◽

10.1016/j.spmi.2017.06.015 ◽

2017 ◽

Vol 109 ◽

pp. 897-904 ◽

Cited By ~ 4

Author(s):

Imen Ben Amara ◽

Emna Ben Salem ◽

Sihem Jaziri

Keyword(s):

Van Der Waals ◽

First Principle ◽

First Principle Calculations ◽

Van Der Waals Heterostructure ◽

Mott Model

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Adjustable electronic and optical properties of BlueP/MoS2 van der Waals heterostructure by external strain: a first-principles study

Nanotechnology ◽

10.1088/1361-6528/ab978b ◽

2020 ◽

Vol 31 (37) ◽

pp. 375706 ◽

Cited By ~ 1

Author(s):

Fei Yang ◽

Junnan Han ◽

Le Zhang ◽

Xianhong Tang ◽

Zhenguo Zhuo ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Van Der Waals ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Van Der Waals Heterostructure ◽

External Strain

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Misfit layer SnTiS3: An assemble-free van der Waals heterostructure SnS/TiS2 for lithium ion battery anode

Journal of Power Sources ◽

10.1016/j.jpowsour.2021.229712 ◽

2021 ◽

Vol 494 ◽

pp. 229712

Author(s):

Yue-E Huang ◽

Weilin Lin ◽

Chenguang Shi ◽

Li Li ◽

Kaiqing Fan ◽

...

Keyword(s):

Lithium Ion Battery ◽

Van Der Waals ◽

Lithium Ion ◽

Van Der Waals Heterostructure ◽

Battery Anode

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A first-principles study on the electronic and optical properties of a type-II C2N/g-ZnO van der Waals heterostructure

Physical Chemistry Chemical Physics ◽

10.1039/d1cp00122a ◽

2021 ◽

Vol 23 (6) ◽

pp. 3963-3973

Author(s):

Jianxun Song ◽

Hua Zheng ◽

Minxia Liu ◽

Geng Zhang ◽

Dongxiong Ling ◽

...

Keyword(s):

Optical Properties ◽

Dft Calculations ◽

First Principles ◽

Van Der Waals ◽

Band Alignment ◽

Type Ii ◽

Electronic And Optical Properties ◽

Direct Bandgap ◽

Van Der Waals Heterostructure ◽

Vdw Heterostructure

The structural, electronic and optical properties of a new vdW heterostructure, C2N/g-ZnO, with an intrinsic type-II band alignment and a direct bandgap of 0.89 eV at the Γ point are extensively studied by DFT calculations.

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