CCL:G: 2D Relaxed Surface Scan
- From: "Wassja A. Kopp" <wassjakopp^^^web.de>
- Subject: CCL:G: 2D Relaxed Surface Scan
- Date: Wed, 9 Nov 2011 05:32:45 -0500
Sent to CCL by: "Wassja A. Kopp" [wassjakopp::web.de]
My recommendation is, since gaussian03 scans are limited to 400 points anyway,
to write a simple script that reads in the scan of one coordinate and starts
scans of the second coordinate for all those points.
This leads to efficient "parallelization" since all these jobs can be
done in parallel. Using perl, such a script is just a few lines.