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Bond Length differences between FULL (all electrons correlated) and FROZEN core

Such as MP2=Frozen and MP2=Full
17 10 27 16 27

For I2+ atoms 1 and 2

For I2+ (Iodine diatomic cation)
Bond length differences (full - frozen) in Å. Mouse over a difference for the bond length with full correlation.
Methods with standard basis sets
STO-3G 3-21G 3-21G* 6-311G*
Moller Plesset perturbation MP2=FULL 0.0000 -0.0010 0.0013 -0.0033
MP3=FULL       -0.0033
MP4=FULL   -0.0006   -0.0027
B2PLYP=FULL 0.0000 -0.0003 0.0004 -0.0010
Quadratic configuration interaction QCISD(T)=FULL       -0.0024
Coupled Cluster CCSD=FULL       -0.0015
CCSD(T)=FULL       -0.0025
STO-3G 3-21G 3-21G* 6-311G*

i2q1.gif