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Structural, electronic and optical properties of pristine and functionalized MgO monolayers: a first principles study

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In this paper, we present a detailed investigation of the structural, electronic, and optical properties of pristine, nitrogenated, and fluorinated MgO monolayers using ab initio calculations. Click to show full abstract

In this paper, we present a detailed investigation of the structural, electronic, and optical properties of pristine, nitrogenated, and fluorinated MgO monolayers using ab initio calculations.

Keywords: properties pristine; mgo monolayers; structural electronic; optical properties; electronic optical

Journal Title: RSC Advances
Year Published: 2020

Link to full text (if available)


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