Author/Authors :
Kolandaivel، نويسنده , , P. and Arulmozhiraja، نويسنده , , S. and Bhuvaneswari، نويسنده , , R.، نويسنده ,
Abstract :
The hybridization effect on two important quantities, chemical hardness abd chemical potential, has been studied by HF-SCF theory using a 6-31G basis set. The maximum hardness principle has been tested for CC and CH symmetric stretching with positive and negative mean amplitudes of vibration. For the above study, three different types of hybrid orbital molecules, CH4, C2H6, C2H4, and C2H2, have been used.