Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
orbital energy output
Remi
chauvin@lcc-toulouse.fr
Dear Alex, dear all,
Just two quick questions about the control of the output content :
- how to increase the accuracy of the given orbital energy values (up to 6-8 digits instead of the 5 default) ?
- is it possible to obtain a separate list of ordered orbital energies ?
Thanks for your help.
Remi
![[ Previous ]](/ceilidh-icons/ceil_prv.gif)
![[ Next ]](/ceilidh-icons/ceil_nxt.gif)
![[ Index ]](/ceilidh-icons/ceil_ind.gif)
Fri Apr 29 '16 1:26pm
![[ Reply ]](/ceilidh-icons/ceil_rep.gif)
![[ Edit ]](/ceilidh-icons/ceil_edt.gif)
![[ Delete ]](/ceilidh-icons/ceil_del.gif)
This message read 546 times