$ECP group

Hi all

I’m new in Avogadro program. I installed it to build input files of GAMESS. I want to build $ECP group,but in Avogadro I can’t find it with other CONTRL, DATA. BASIS groups
Please, can any one tell me how can I build like that

$ECP

H-ECP GEN 0
1

3
p

1.00000000 1 4.47692410

4.47692410 3 2.97636451

-4.32112340 2 3.01841596

1 5

         0                           2

$END
Thanks
Nagat

I’m new in Avogadro program. I installed it to build input files of GAMESS. I want to build $ECP group,but in Avogadro I can’t find it with other CONTRL, DATA. BASIS groups

Click on the “Advanced” tab in the GAMESS input builder. When you pick a BASIS which can combine with an ECP, there will be an “ECP” popup menu to select these options.

Hope that helps,
-Geoff