Dear all,
Kindly, how can I calculate presence of a bond critical point (BCP),and the magnitude of the electron density (rbcp) at the BCP using Dmol3 for Oxygen adsorption on Boron.
Appreciate your help
Thanks
Niveen
Dear all,
Kindly, how can I calculate presence of a bond critical point (BCP),and the magnitude of the electron density (rbcp) at the BCP using Dmol3 for Oxygen adsorption on Boron.
Appreciate your help
Thanks
Niveen