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

Bitartekari zentralaren dobletea base handiagoa erabiliz:

-2 1
Si 1.72901384 0.01581222 0.00183417
C 2.43889387 1.78849432 0.05809855
C 2.41520405 -0.92590119 1.51244292
C 2.42622763 -0.82930207 -1.56103254
H 2.07281704 2.29893314 0.95731143
H 2.0669946 2.35593916 -0.80355743
H 3.54222827 1.79758376 0.05586144
H 3.51757275 -0.92088827 1.5524532
H 2.05511653 -1.96144278 1.47266852
H 2.00733012 -0.4749685 2.42474275
H 3.52925963 -0.83910051 -1.57887054
H 2.04542519 -0.31324222 -2.45021933
H 2.05218954 -1.85993632 -1.59992949
Pt -0.59046194 0.00207737 0.00373925
F -2.7673139 -0.07722181 0.01443221
F -0.44887724 -2.00454371 0.0396868
F -0.63931063 2.00418614 -0.0347273
F -0.56476444 -0.02823171 -2.00231179
F -0.54099991 0.04976688 2.01074381

-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


