Search Results - Prencipe, M.

  • Showing 1 - 4 results of 4
Refine Results
  1. 1
    Toward an accurate ab initio estimation of compressibility and thermal expansion of diamond in the [0, 3000 K] temperature and [0, 30 GPa] pressures ranges, at the hybrid HF/DFT theoretical level

    Toward an accurate ab initio estimation of compressibility and thermal expansion of diamond in the [0, 3000 K] temperature and [0, 30 GPa] pressures ranges, at the hybrid HF/DFT th... by Prencipe, M., Bruno, M., Nestola, F., De La Pierre, Marco, Nimis, P.

    Published 2014
    Get full text
  2. 2
    Ab Initio Calculations of the Main Crystal Surfaces of Forsterite (Mg2SiO4): A Preliminary Study to Understand the Nature of Geochemical Processes at the Olivine Interface

    Ab Initio Calculations of the Main Crystal Surfaces of Forsterite (Mg2SiO4): A Preliminary Study to Understand the Nature of Geochemical Processes at the Olivine Interface by Bruno, M., Massaro, F., Prencipe, M., Demichelis, Raffaella, De La Pierre, M., Nestola, F.

    Published 2014
    Get full text
  3. 3
    First-Principle Modelling of Forsterite Surface Properties: Accuracy of Methods and Basis Sets

    First-Principle Modelling of Forsterite Surface Properties: Accuracy of Methods and Basis Sets by Demichelis, Raffaella, Bruno, M., Massaro, F., Prencipe, M., De La Pierre, Marco, Nestola, F.

    Published 2015
    Get full text
  4. 4
    The (100), (111) and (110) surfaces of diamond: an ab initio B3LYP study

    The (100), (111) and (110) surfaces of diamond: an ab initio B3LYP study by De La Pierre, Marco, Bruno, M., Manfredotti, C., Nestola, F., Prencipe, M., Manfredotti, C.

    Published 2014
    Get full text

Search Tools: