4.5k citations · 5.5k across the 9 of their papers we have counts for
Showing 2023Show all
2 papers · 1 filter
cond-mat.mtrl-sci2023★ 5 cited
Unraveling the interlayer and intralayer coupling in two-dimensional layered MoS by X-ray absorption spectroscopy and ab initio molecular dynamics simulations
Inga Pudza, Dmitry Bocharov, Andris Anspoks +4
Understanding interlayer and intralayer coupling in two-dimensional layered materials (2DLMs) has fundamental and technological importance for their large-scale production, enginee…
cond-mat.mtrl-sci2023★ 87 cited
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
Emanuele Bosoni, Louis Beal, Marnik Bercx +42
In the past decades many density-functional theory methods and codes adopting periodic boundary conditions have been developed and are now extensively used in condensed matter phys…