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Showing 2025 · cond-mat.mtrl-sciShow all
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cond-mat.mtrl-sci2025★ 28 cited
Abinit 2025: New Capabilities for the Predictive Modeling of Solids and Nanomaterials
Matthieu J. Verstraete, Joao Abreu, Guillaume E. Allemand +71
Abinit is a widely used scientific software package implementing density functional theory and many related functionalities for excited states and response properties. This paper p…
cond-mat.mtrl-sci2025★ 13 cited
Tuning electronic and optical properties of 2D polymeric C by stacking two layers
Dylan Shearsby, Jiaqi Wu, Dekun Yang +1
Benefiting from improved stability due to stronger interlayer van der Waals interactions, few-layer fullerene networks are experimentally more accessible compared to monolayer poly…