Gian‐Marco Rignanese

1. The PseudoDojo: Training and grading a 85 element optimized norm-conserving pseudopotential table
   2017/10/30 by M.J. van Setten, M. J. van Setten, Michiel J. van Setten +14 · 218 citations
   Engineering · Materials Science · Mathematics · Physics and Astronomy · #Applied mathematics #Computer science #Cutoff #Geometry #Mathematics #Norm (philosophy) #Nuclear Materials and Properties #Nuclear Physics and Applications #Physics #Pseudopotential #Quantum mechanics #Rotation formalisms in three dimensions #Statistical physics #Thermodynamic and Structural Properties of Metals and Alloys #cond-mat.mtrl-sci
2. Reproducibility in density functional theory calculations of solids
   2016/03/24 by Kurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman +66 · 25 citations
   Materials Science · Chemistry · #X-ray Diffraction in Crystallography #Thermal and Kinetic Analysis #Inorganic Fluorides and Related Compounds #Reproducibility #Density functional theory #Chemistry #Computational chemistry #Chromatography