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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


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