Reply to the Comment on the application of basis set
superposition error to ab initio calculation of water dimer,
Abstract:
This reply is to a comment on our paper finding low-energy
trifurcated water dimers, arguing that our finding is spurious
due to the lack of basis-set superposition error (BSSE)
correction. Our reply cites several papers showing that the usual
way to correct for the BSSE is quite often unreliable. We also
show that the also neglected zero-point vibration energy
correction would act in the opposite direction, providing further
support to the conclusions of our original paper.