Multipoles and interaction potentials in ionic materials from planewave-DFT calculations

  • Andr�s Aguado, Leonardo Bernasconi, Sandro Jahn, Paul A. Madden
  • Faraday Discussions, January 2003, Royal Society of Chemistry
  • DOI: 10.1039/b300319c

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http://dx.doi.org/10.1039/b300319c

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