Name

FAIL — Superseded by NEWDEN.

Synopsis

 FAIL 

Description

FAIL forces AMPAC to use a new diagonal density to start the SCF procedure rather than using a previous density matrix. FAIL has been eliminated in AMPAC 8 and NEWDEN should be used in its place.

Abbreviation:

none

Requires:

none

Default value:

none

See also:

NEWDEN