Journal of Chemical Physics, Vol.101, No.10, 8945-8954, 1994
High-Level Ab-Initio Study on the Ground-State Potential-Energy Hypersurface of the Hco+-Coh+ System
Keywords:INFRARED-LASER SPECTROSCOPY;GAUSSIAN BASIS FUNCTIONS;ATOMIC BASIS SETS;FIRST-ROW ATOMS;MOLECULAR-IONS;VIBRATIONAL FREQUENCIES;ISOELECTRONIC SERIES;ANALYTIC EVALUATION;FUNDAMENTAL-BAND;ABUNDANCE RATIO