Counterpoise-corrected geometries and harmonic frequencies of N-body clusters: application to (HF)n (n=3,4)

A study was conducted on the methods of basis set superposition error (BSSE)-free geometry optimization and frequency calculations in clusters larger than a dimer. In particular, three different counterpoise schemes were critically examined. It was shown that the counterpoise-corrected supermolecule energy can be easily obtained in all the cases by using the many-body partitioning of energy

Iowa Community Empowerment Newsletter, August 2004, Vol. 6, no. 4

Monthly newsletter for the Iowa Department of Public Health

Iowa Technology, May 2002, Issue 4

Newsletter produced by the Iowa Information Technology Department

Histoire du dix-neuvième siècle depuis les traités de Vienne. Tome 4 / G. G. Gervinus,... ; traduit de l'allemand par J.-F. Minssen,...

Collection : Collection d'historiens contemporains

Credit Union Division Activities, November 2002, Issue 4

Newsletter for Iowa Credit Union Division

Iowa Community Empowerment Newsletter, December 2003, Vol. 4, no. 7

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, October 2003, Vol. 4, No. 6

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, August 2003, Vol. 4, no. 5

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, July 2003, Vol. 4, no. 3

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, April 2003, Vol 4, no. 4

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, February 2003, Vol. 4, no. 1

Monthly newsletter for the Iowa Department of Public Health

Iowa Community Empowerment Newsletter, August 2002, Vol. 3, no. 4

Monthly newsletter for the Iowa Department of Public Health