Reference Label | Details |
---|---|
triv | Trivial |
Ruscic G3B3 | G3B3LYP calculation; B3LYP/6-31G(d) frequencies are scaled by 0.9614 (see Scott 1996) |
Rodler 1986 | M. Rodler, Chem. Phys. 105, 345-353 (1986) Ab initio Studies of the Structures and Energies of Methanediol and 1,1-Ethanediol |