Structures, IR specra and wavefunctions of acetylene, ethane and their dimers, optimized at the MP2/cc-pVDZ level.

XYZ files of optimized structures, JCAMP-DX containing IR spectra of optimized structures and MOLDEN format of wavefunctions for the optimized structures have been deposited at figshare.org under DOI:10.6084/m9.figshare.16712935 and are publicly available as of the date of publication. The files in XYZ format contain optimum structures, energies and zero point energies at the MP2/cc-pVDZ level. Files in MOLDEN format can be analyzed by Multiwfn. Text files contain the values of properties at the critical points found by topology analysis of dimers 7 and 8. In both cases the critical point of interest is #16.