Counterpoise method | Article about counterpoise method by The Free Dictionary
counterpoise method[′kau̇n·tər‚pȯiz ‚meth·əd]
McGraw-Hill Dictionary of Scientific & Technical Terms, 6E, Copyright © 2003 by The McGraw-Hill Companies, Inc.
References in periodicals archive
Therefore, counterpoise method
(CP) can be applied, which can estimate the BSSE size.
The basis set superposition error (BSSE) correction was evaluated using the counterpoise method .
The estimation of the basis set superposition error (BSSE) for all the structures presented here was performed by the full counterpoise method at the B3LYP/6-311G (d,p) level.
Application of the BSSE correction by the counterpoise method
overcorrected the error and gave systematically too low complexation energies.
We applied the counterpoise method
[31, 32] to calculate the basis set superposition error using the equation: