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Strain-induced structural transformations in hexagonal monolayer boron nitride. A density functional study

Bystrenko, O. et al.
arXiv (All) · Papers
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materials-science
In this work we theoretically study the structural transformations occurring in monolayer hexagonal boron nitride (h-BN) subjected to strong deformations. The first-principle computer simulations are based on the density functional theory employing the pseudopotentials with the exchange-correlation
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