Authors:
May, K
Dapprich, S
Furche, F
Unterreiner, BV
Ahlrichs, R
Citation: K. May et al., Structures, C-H and C-CH3 bond energies at borders of polycyclic aromatic hydrocarbons (vol 2, pg 5084, 2000), PHYS CHEM P, 2(24), 2000, pp. 5771-5771
Authors:
May, K
Dapprich, S
Furche, F
Unterreiner, BV
Ahlrichs, R
Citation: K. May et al., Structures, C-H and C-CH3 bond energies at borders of polycyclic aromatic hydrocarbons, PHYS CHEM P, 2(22), 2000, pp. 5084-5088
Authors:
Dapprich, S
Komaromi, I
Byun, KS
Morokuma, K
Frisch, MJ
Citation: S. Dapprich et al., A new ONIOM implementation in Gaussian98. Part I. The calculation of energies, gradients, vibrational frequencies and electric field derivatives, THEOCHEM, 462, 1999, pp. 1-21