[molpro-user] CIS calcul

[Merabti karim]

	hello,

	I want to make a CIS calculation, and
when I added the
option'' THRESH,
PRINTCI =
0.0001'' printed
for every transition with a greater than 0.0001 coef, it does not
print all the
transistion however,
only 50 premeir
grans who are more
than this, my qustion that there are as an option for CIS increased the number of transition printed my input're
down

	{cis -11, trans =
2

	orbital, 2140.2

	THRESH, PRINTCI = 0.0001

	occ, 74

	wf, 148,1,0;

	}


	 

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