화학공학소재연구정보센터
Chemical Physics Letters, Vol.336, No.5-6, 451-456, 2001
Polarizability of silicon clusters
The polarizability of hydrogen-terminated silicon dusters derived from the silicon diamond-lattice structure was evaluated by linear response calculations. The dependences on cluster size and basis set were systematically investigated. A convergence in calculated polarizability per silicon atom toward the bulk value was found. Frequency-dependent polarizabilities were also addressed.