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91.
92.
A systematic comparison of the diffusion coefficients of cations (Al, Cd, Co, Cu, Mn, Ni, Pb, Zn) and oxyanions (Al, As, Mo, Sb, V, W) in open (ODL) and restricted (RDL) diffusive layers used by the DGT technique was undertaken. Diffusion coefficients were measured using both the diffusion cell (Dcell) method at pH 4.00 and the DGT time-series (DDGT) method at pH 4.01 and 7.04 (pH 8.30 was used instead of 7.04 for Al) using the Chelex-Metsorb mixed binding layer. The performance of Chelex-Metsorb as a new DGT binding layer for Al uptake was also evaluated for the first time. Reasonable agreement was observed between Dcell and DDGT measurements for both ODL and RDL, except for V and W. The ratios of Dcell/DDGT for V of 0.44 and 0.39, and for W of 0.66 and 0.63 with ODL and RDL respectively, were much lower due to the formation of a high proportion of polyoxometalate species at the higher concentrations required with the Dcell measurements. This is the first time that D values have been reported for several oxyanions using RDL. Except for Al at pH 8.30 with ODL, all DDGT measurements were retarded relative to diffusion coefficients in water (DW) for both diffusive hydrogels. Diffusion in RDL was further retarded compared with ODL, for all elements (0.66–0.78) with both methods. However, the degree of retardation observed changed for cations and anions at each pH. At pH 7.04 cations had a slightly higher DDGT and oxyanions had a slightly lower DDGT than at pH 4.01 for both ODL and RDL. It is proposed that this is due to partial formation of acrylic acid functional groups (pKa ≈4.5), which would be fully deprotonated at pH 7.04 (negative) and mostly protonated at pH 4.01 (neutral). As Al changes from being cationic at pH 4.01 to anionic at pH 8.30 the results were more complex. 相似文献
93.
Sushko I Novotarskyi S Körner R Pandey AK Rupp M Teetz W Brandmaier S Abdelaziz A Prokopenko VV Tanchuk VY Todeschini R Varnek A Marcou G Ertl P Potemkin V Grishina M Gasteiger J Schwab C Baskin II Palyulin VA Radchenko EV Welsh WJ Kholodovych V Chekmarev D Cherkasov A Aires-de-Sousa J Zhang QY Bender A Nigsch F Patiny L Williams A Tkachenko V Tetko IV 《Journal of computer-aided molecular design》2011,25(6):533-554
94.
Crispin St John Alvah Nash-Williams was born in Cardiff on 19December 1932. His father was Keeper of Archaeology at the NationalMuseum of Wales and also Senior Lecturer in Archaeology at UniversityCollege, Cardiff. War broke out when Crispin was six; his fatherjoined the army and his consequent absence changed the family'slife. 相似文献
95.
96.
The second-order processes of optical-rectification and photoconduction are well known and widely used to produce ultrafast electromagnetic pulses in the terahertz frequency domain. We present a new form of rectification that relies on the excitation of surface plasmons in metal films deposited on a shallow grating. Multiphoton ionization and ponderomotive acceleration of electrons in the enhanced evanescent field of the surface plasmons results in a femtosecond current surge and emission of terahertz electromagnetic radiation. Using gold, this rectification process is third or higher-order in the incident field. 相似文献
97.
The initial value adjusting method for the solution of nonlinear multipoint boundary value problems in which the system dimensions vary over subintervals is proposed. To reduce the computer storage requirements and the excessive amount of computer time, an algorithm based on a digraph and its associated Boolean matrices is also proposed. The effectiveness of these algorithms is illustrated by an application to a five compartment model from pharmacokinetics. 相似文献
98.
99.
100.
A method is proposed for the solution of boundary value problems in which the locations of the interfaces are unknown. Numerical results are obtained for the steady state solution of a shafttype furnace. 相似文献