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Andris Guļāns

  1. Numerical Quality Control for DFT-based Materials Databases
    2020/08/24 by Christian Carbogno, Carbogno, Christian, Kristian S. Thygesen +23 · 1 citation
    Chemistry · Materials Science · #Computational Physics (physics.comp-ph) #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #X-ray Diffraction in Crystallography #Zeolite Catalysis and Synthesis
  2. Radial Kohn-Sham problem via integral-equation approach
    2022/02/01 by Jānis Užulis, Andris Guļāns, Užulis, Jānis +1 · 1 citation
    Chemistry · Physics and Astronomy · #Advanced Chemical Physics Studies #Advanced NMR Techniques and Applications #Atomic and Molecular Clusters (physics.atm-clus) #Atomic and Molecular Physics #FOS: Physical sciences
  3. Reproducibility in density functional theory calculations of solids
    2016/03/24 by Kurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman +66 · 1 citation
    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