15min:
FTIR AND DFT STUDIES OF NOVEL GERMANIUM-CARBON AND MIXED GERMANIUM-SILICON-CARBON CLUSTERS.

D. L. ROBBINS, C. M. L. RITTBY AND W. R. M. GRAHAM, Department of Physics and Astronomy, TCU, Fort Worth,TX 76129.

The vibrational fundamentals and structures of novel germanium-carbon and mixed germanium-silicon-carbon clusters, formed by laser ablation and trapped in solid Ar, are currently under investigation. Vibrational fundamentals and ground state geometries are characterized by comparison of Fourier transform infrared measurements of vibrational frequencies and 13C isotopic shifts for the matrix isolated clusters with the predictions of density functional theory (DFT). Linear GeC3Si has been detected, the first GejCmSin species to be observed optically, and its nu1 fundamental identified at 1939.0 cm-1. The results are in excellent agreement with DFT predictions. Additional results and assignments for GenCm clusters will be reported.