From owner-chemistry@ccl.net Tue Feb 1 17:44:01 2011 From: "Leonid Shirkov leonid.shirkov!A!tiger.chem.uw.edu.pl" To: CCL Subject: CCL:G: number of digits in Gaussian output Message-Id: <-43827-110201163813-27528-lWH5YcGkJhbc1LcamlUB4A : server.ccl.net> X-Original-From: "Leonid Shirkov" Date: Tue, 1 Feb 2011 16:38:11 -0500 Sent to CCL by: "Leonid Shirkov" [leonid.shirkov _ tiger.chem.uw.edu.pl] Dear Colleagues, I need to have more digits after the decimal point in the Gaussian output. For example, when I do PES Scan and have the final table, there are only five digits. Of course, I can find more precise values in the output file, but I thought maybe there is a way to define the precision in the final table. Another example is the eigenvectors in frequency analysis, by default they are printed with 2 digits. Thank you in advance! Regards, Leonid