HF HF / John Wiley & Sons Inc. / ECHA HF / ECP AB / Burton N. A. / IBM Corp. / ECP HF / J. A. Gaussian Inc. / /
Country
Germany / Hungary / France / / /
Facility
Center Scientific Engineering Computations / University of Debrecen / Institute of Mathematics / Hungary University of Debrecen / /
IndustryTerm
monomer energy / corrected interaction energy / projection operator / monomer energy calculations / supermolecule energy / energy corrections / supermolecule energy calculation / appropriate second order energy / zero order energy / interaction energy surface / conventional energy calculation / order energy contribution / interaction energy / energy calculations / uncorrected interaction energy / interaction energy minima / energy / needed calculating the appropriate BSSE-corrected interaction energy / /
OperatingSystem
Linux / /
Organization
Institute of Mathematics / German Cancer Research Center / International Congress / Department of Theoretical Physics / Institute of Mathematics and Informatics / European Union / Molecular Biophysics Department / Hungary University of Debrecen / University of Debrecen / /
BSSE-Free Description of the Formamide Dimers A. BENDE,1 Á. VIBÓK,1 G. J. HALÁSZ,2 S. SUHAI3 1 University of Debrecen, Department of Theoretical Physics, H-4010 Debrecen, Hungary