[molpro-user] {SPAM}? Asking your help please

Rana Zahdeh ranazahdeh at hotmail.com
Fri Apr 27 13:13:10 BST 2012


I need to calculate the transition dipole moment between two states saved in different record numbers. I used the following command:


The problem is that the record 6000.2 is calculated in another output file, in the same directory where I’m doing my calculations.     
The error that I receive is that it doesn’t find this record.

Will you please help me to know how to enable it to read this record?

Thanks in advance,
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20120427/1f544feb/attachment.html>

More information about the Molpro-user mailing list