Journal of Chemical Physics, Vol.102, No.18, 7142-7149, 1995
Ab Inito Study of the Vibronic and Spin-Orbit-Coupling in the X-(2)Pi(U) State of C2H2+
Keywords:CONFIGURATION-INTERACTION CALCULATIONS;RENNER-TELLER;TRIATOMIC-MOLECULES;PHOTOELECTRON-SPECTROSCOPY;ENERGY EXTRAPOLATION;ANGULAR-MOMENTUM;CI CALCULATIONS;ACETYLENE;VIBRATION