NWCHEM: Natural Chemical Shielding and Natural J Coupling
From: Sidney Ramos de Santana <sidney|at|dqf.ufpe.br>
Subject: NWCHEM: Natural Chemical Shielding and Natural J
Coupling
Date: Sat, 12 Jul 2003 17:17:46 -0300
Dear CCL,
Please, Could someone send me any example of NWChem input for
Natural Chemical Shielding and Natural J Coupling Calculations ?
Thanks for any help !
Best Regards !
Sidney Ramos
Graduate Program of Materials Science
CCEN - UFPE