Skip to main content
. Author manuscript; available in PMC: 2014 Feb 21.
Published in final edited form as: J Phys Chem A. 2013 Feb 12;117(7):1560–1568. doi: 10.1021/jp308364d

Figure 2.

Figure 2

DF-SCS-MP2/aug-cc-pVTZ interaction energies (kcal/mol) for canonical A-form and B-form base-stacking conformations. The optimized geometry is the MP2/cc-pVDZ optimization of the intramolecular coordinates. The planar geometry restricts the base monomers to planar geometries, but allows other intramolecular coordinates to optimize.