Stability and Raman Spectroscopy of Alkane Guest Molecules (C nH m, n≤6, m≤14) in 5 126 2 and 5 126 4 Water Cavities by Density Functional Theory Calculations
CAO Xiao-Xiao, SU Yan, ZHAO Ji-Jun, LIU Chang-Ling, ZHOU Pan-Wang
Acta Phys. -Chim. Sin. . 2014, (8): 1437 -1446 .  DOI: 10.3866/PKU.WHXB201405292