Comparison of the perfomance of van der waals dispersion functionals in the description of water and ethanol on transition metal surfaces
Rafael Luiz Heleno Freire Diego Guedes Sobrinho; Adam Kiejna; Juarez Lopes Ferreira da Silva
Journal of Physical Chemistry C v. 122, n. 3, p. 1577-1588, 2018Washington 2018
Localização: IQSC - Inst. Química de São Carlos (P17358 )(Acessar)