CCL: Accurate Volomes



 Sent to CCL by: John McKelvey [jmmckel(a)gmail.com]
 Folks,
 I found the answer.. If one has ever tried computing pi to .01
 accuracy using a random number generator and the circle inscribed in a
 square method, one immediately requires a Huge! number of points..
 For volume accuracy for Carbon using 6-311+G*  it was necessary to
 raise the number of points in boihrs**3  from the default value of 20
 to a value of 40,000...
 Cheers!
 John
 --
 John McKelvey
 10819 Middleford Pl
 Ft Wayne, IN 46818
 260-489-2160
 jmmckel ~~ gmail.com