OPTIL
Prev  Appendix A. Keyword Reference  Next

Name

OPTIL — Optimize left (reactant) starting geometry.

Synopsis

 OPTIL

Description

OPTIL causes the left (reactant) geometry to be optimized prior to building the initial chain in a CHAIN/CHN calculation.

Abbreviation:

none

Requires:

CHN, CHECKCHN, FULLCHN, or CHAIN.

Default value:

none

See also:

OPTILR, OPTIR.

Copyright © 1992-2013 Semichem, Inc. All rights reserved.
Prev  Up  Next
OPEN  Home  OPTILR