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Bartolomeo Civalleri

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Papers (5)

  1. Interfacing CRYSTAL/AMBER to Optimize QM/MM Lennard-Jones Parameters for Water and to Study Solvation of TiO2 Nanoparticles physics.chem-ph · 2019 · author #6
  2. Dielectric Properties of Metal-Organic Frameworks Probed via Synchrotron Infrared Reflectivity cond-mat.mtrl-sci · 2018 · author #8
  3. Detecting Molecular Rotational Dynamics Complementing the Low-Frequency Terahertz Vibrations in a Zirconium-Based Metal-Organic Framework cond-mat.mtrl-sci · 2017 · author #3
  4. Range-separated double-hybrid density-functional theory applied to periodic systems physics.chem-ph · 2015 · author #2
  5. Double-hybrid density-functional theory applied to molecular crystals physics.chem-ph · 2014 · author #4

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