Structural and electronic properties of ZrX2 and HfX2 (X = S and Se) from first principles calculations

MoS2 and WS2 Analogues of Graphene

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Photoswitching of azobenzene multilayers on a layered semiconductor

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Electronic band structure of zirconia and hafnia polymorphs from theGWperspective

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Recent progress in the research of inorganic fullerene-like nanoparticles and inorganic nanotubes

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Calculation of the lattice constant of solids with semilocal functionals

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Excitonic Effects on the Optical Response of Graphene and Bilayer Graphene

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Exciting prospects for solids: Exact-exchange based functionals meet quasiparticle energy calculations

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Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

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Insights into Current Limitations of Density Functional Theory

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