Method that is used is divided into 2 parts. In the first part is finding cluter using B3LYP/TZVP basis set to find -Structural properties (DdDA) -Energetic properties (DE) -H-bonds
method used is split into 2 parts., the first part is to search using cluter B3LYP/TZVP basis set., to find. -Structural Properties (DdDA) -Energetic Properties (DE) -Charge -Classifications of H-Bonds -IR and NMR Spectra
Method used to be divided into 2 parts. First part is to find cluter using B3LYP / TZVP basis set. To find - Structural properties (DdDA) - Energetic properties (DE) - - charge Classifications of H-bonds - IR and NMR spectra