Firefly and PC GAMESS-related discussion club


 
Learn how to ask questions correctly  
 
 
We are NATO-free zone
 


Re: WRONG ECP

Alex Granovsky
gran@classic.chem.msu.su

Hi,

try to replace tabs by spaces in the input file.

Kind regards,
Alex Granovsky


On Sat Aug 24 '13 11:58am, David G. wrote
-----------------------------------------
>>Hi

>I have followed the instruction to make $ECP group but still I get the following error.

> WRONG ECP LIST IN $ECP GROUP!
> $ECP GROUP SHOULD DEFINE THE VALID ECP PARAMETERS FOR ALL ATOMS.

>Attached please find my input file which includes the LANL2DZ ECP.

>Sincerely, David

[ Previous ] [ Next ] [ Index ]           Sat Aug 24 '13 1:14pm
[ Reply ] [ Edit ] [ Delete ]           This message read 874 times