Re: CCL:collation of responses on ab initio/first principles



 Even the integrals need NOT be evaluated EXACTLY for a method to be called
 ab initio. For instance, Gaussian employs several asymptotic and other
 cutoffs to approximate integral evaluation.
 
 This is only partly a valid argument.
 
Are sin(x), cos(x), exp(x) etc. calculated "analytically" on any computer? They are computed with similar methods, so erf(x) or F0(x) (or a two-electron integral) is as analytical as any other transcendental function.
 +---------------------------------+----------------------------------+
 | Prof. Christoph van Wüllen      | Tele-Phone (+49) (0)30 314 27870 |
 | Technische Universität Sekr. C3 | Tele-Fax   (+49) (0)30 314 23727 |
 | Straße des 17. Juni 135         | eMail                            |
 | D-10623 Berlin, Germany         | Christoph.vanWullen # - at - # TU-Berlin.De
 |
 +---------------------------------+----------------------------------+
 --