Bv. Zhmud et al., ROLE OF HYDRATION AND CONFORMATIONAL-CHANGES IN ADSORPTION DYNAMICS OF ETHYL(HYDROXYETHYL)CELLULOSE AT THE AIR SOLUTION INTERFACE/, Langmuir, 14(13), 1998, pp. 3620-3624
Previous studies have discussed the kinetics involved in the reduction
in surface tension of ethyl(hydroxyethyl)cellulose (EHEC) at the air/
aqueous solution interface in terms of configuration changes involved
in the transfer of individual polymer segments between soluted and ads
orbed states. It was suggested that the process kinetics were governed
by a substantially high activation barrier. In the present study, bas
ed on molecular mechanic simulations, it is shown. that a nearly activ
ation-free path between configurations exists for EHEC due to the extr
eme flexibility of the polymer chain. Hence, the relatively slow kinet
ics of the process should rather be attributed to a stepwise transform
ation between conformations which is expressed as a sequence of elemen
tary processes involving a considerable number of intermediate isomers
. This occurs over an extended time period. Also, the configuration ch
anges involved in the uncoiling of the polymer at the interface are re
lated to the hydration effects.