Utilizing high performance computing for chemistry: parallel computational chemistry

Wibe A. de Jong, Eric Bylaska, Niranjan Govind, Curtis L. Janssen, Karol Kowalski, Thomas Müller, Ida M. B. Nielsen, Hubertus J. J. van Dam, Valera Veryazov, Roland Lindh
  • Physical Chemistry Chemical Physics, January 2010, Royal Society of Chemistry
  • DOI: 10.1039/c002859b