%mem=3200mb
%nproc=4
#p B3LYP/genecp scf=(xqc,maxcyc=1000,conver=8)
 5D 7F scf=nosym empiricaldispersion=gd3 scrf=(pcm)

Bitartekari zentralaren dobletea base handiagoa erabiliz:

0 1
Si 0.88992798 0.00765128 0.00519708
C 1.65343085 0.00604881 1.77984321
C 1.73842364 -1.51139457 -0.83222696
C 1.7617753 1.5093719 -0.84033103
H 1.34357861 -0.87767184 2.35442828
H 1.35439921 0.89415997 2.35358614
H 2.75454796 -0.00124969 1.7257514
H 2.8346206 -1.43717593 -0.74450488
H 1.49430678 -1.57486072 -1.90162685
H 1.43091583 -2.45771958 -0.36643781
H 2.85667574 1.41714351 -0.75254551
H 1.47046481 2.46316635 -0.379228
H 1.51841848 1.57120723 -1.90985916
K -2.37396679 0.03253151 -0.1114028

-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


