Temperature dependence of vibrational modes of CH3‒C≡C(ads) and I(ads) coadsorbed on Ag(111): Ab initio molecular dynamics approach. - Jyh Shing Lin; Shao-Yu Lu; Po-Jung Tseng; Wen-Chi Chou (J. Comput. Chem., 2012)

Ab Initio molecular dynamics study of ethylene adsorption onto Si(001) surface: Short-time fourier transform analysis of structural coordinate autocorrelation function. - Yung-Ting Lee; Jyh Shing Lin (J. Comput. Chem., 2013)

Chemical mechanism of surface-enhanced raman scattering spectrum of pyridine adsorbed on Ag cluster: Ab initio molecular dynamics approach. - Jen-Ping Su; Yung-Ting Lee; Shao-Yu Lu; Jyh Shing Lin (J. Comput. Chem., 2013)