@article {3108, title = {COMPARISON OF MOLECULAR-ENERGY PREDICTIONS FOR THE NEUTRAL AND IONIC (C, H-N, O N=0-4) SYSTEM BY AB-INITIO GAUSSIAN-2 AND DENSITY-FUNCTIONAL METHODS}, journal = {Chemical Physics}, volume = {179}, number = {3}, year = {1994}, note = {ISI Document Delivery No.: MV915Times Cited: 13Cited Reference Count: 42}, month = {Feb}, pages = {365-375}, type = {Article}, abstract = {{The ionization energies (IEs), electron affinities (EAs), total atomization energies (Sigma D-0), and bond dissociation energies at 0 K (BDEs) for the neutral and ionic (C, H-n, O}, keywords = {1ST-ROW, ABINITIO, APPROXIMATION, GAS, RADICAL CATION CH3OH.+, THERMOCHEMISTRY}, isbn = {0301-0104}, url = {://A1994MV91500009}, author = {Ma, N. L. and Li, W. K. and Chong, D. P. and Ng, C. Y.} }