Electrostatic Potential Fit

Click here for full thread

Gets Around

9:58:15 AM PST - Tue, Mar 6th 2012
NWChem Electrostatic Potential Fit Module provides the following information about the quality of fit: RMS deviation kJ/mol 0.095166 ABS deviation % 65.922748 Could you be so kind to give a formal definition of these quantities?