%nproc=4
%mem=6400mb
#p B3LYP/genecp scf=(maxcyc=1000,conver=8)
5D 7F scf=nosym empiricaldispersion=gd3 scrf=pcm

Bitartekari zentralaren dobletea base handiagoa erabiliz:
        
-1 1
S -0.00099 1.890782 -0.000184
Pd 0.000209 -0.530126 -0.000304
P -2.243742 -0.128234 0.000397
P 2.244068 -0.127455 0.00038
H 0.000655 -2.170965 -0.000133
H -2.779064 0.615767 -1.070666
H -3.245186 -1.162326 0.000125
H -2.778012 0.614256 1.073021
H 2.779241 0.616954 -1.070542
H 2.777466 0.615672 1.073023
H 3.246217 -1.16076 0.000428

-H -C -N -O -P -B -S -Al -Cl -F -He -Si 0
6-31+g*
****
-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd
*******************

-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd


