most citedFirst-Principles Prediction of Two-Dimensional B3C2P3 and B2C4P2: Structural Stability, Fundamental Properties, and Renewable Energy Applications

47 citations · 75 across the 3 of their papers we have counts for

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cond-mat.mtrl-sci2021★ 47 cited

First-Principles Prediction of Two-Dimensional B3C2P3 and B2C4P2: Structural Stability, Fundamental Properties, and Renewable Energy Applications

Andrey A. Kistanov, Stepan A. Shcherbinin, Svetlana V. Ustiuzhanina +4

The existence of two novel hybrid two-dimensional (2D) monolayers, 2D B3C2P3 and 2D B2C4P2, has been predicted based on the density functional theory calculations. It has been show…

cond-mat.mtrl-sci2021★ 28 cited

Point Defects in Two-Dimensional γ-Phosphorus Carbide

Andrey A. Kistanov, Vladimir R. Nikitenko, Oleg V. Prezhdo

Defects are inevitably present in two-dimensional (2D) materials and usually govern their various properties. Here a comprehensive density functional theory-based investigation of…