Analytical method for the representation of atoms-in-molecules densities.
Rico JF, López R, Ramírez G, Ema I, Ludeña EV.
Rico JF, et al. Among authors: lopez r.
J Comput Chem. 2004 Aug;25(11):1355-63. doi: 10.1002/jcc.20064.
J Comput Chem. 2004.
PMID: 15185329
We present analytic refinements and applications of the deformed atomic densities method [Fernandez Rico, J.; Lopez, R.; Ramirez, G. J Chem Phys 1999, 110, 4213-4220]. In this method the molecular electron density is partitioned into atomic contributions, using a mi …
We present analytic refinements and applications of the deformed atomic densities method [Fernandez Rico, J.; Lopez, R.; Ramir …