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31.
Enzymatic hydrolysis of cellulose provides a renewable source of monosaccharides for production of variety of biochemicals and biopolymers. Unfortunately, the enzymatic hydrolysis of cellulose is often incomplete, and the reasons are not fully understood. We have monitored enzymatic hydrolysis in terms of molecular density, ordering and autofluorescence of cellulose structures in real time using simultaneous CARS, SHG and MPEF microscopy with the aim of contributing to the understanding and optimization of the enzymatic hydrolysis of cellulose. Three cellulose-rich substrates with different supramolecular structures, pulp fibre, acid-treated pulp fibre and Avicel, were studied at microscopic level. The microscopy studies revealed that before enzymatic hydrolysis Avicel had the greatest carbon-hydrogen density, while pulp fibre and acid-treated fibre had similar density. Monitoring of the substrates during enzymatic hydrolysis revealed the double exponential SHG decay for pulp fibre and acid-treated fibre indicating two phases of the process. Acid-treated fibre was hydrolysed most rapidly and the hydrolysis of pulp fibre was spatially non-uniform leading to fractioning of the particles, while the hydrolysis of Avicel was more than an order of magnitude slower than that of both fibres.  相似文献   
32.
Methane hydrates with the three clathrate structures I, II, and H are studied by quantum-chemical methods. Hybrid density-functional theory B3LYP computations using periodic boundary conditions are combined with force-field methods for the thermal energy effects to calculate energetic, thermodynamic, and structural properties. The pressure dependencies for the crystal structures, lattice energies, and guest molecule interactions are derived. The quantum-chemical geometry optimizations predict too small cell volumes as compared to experimental data, but by including zero-point energy and thermal energy effects, we find the cell volumes increase and the correct densities are obtained. The phase transition from MH-I to ice Ih and methane was computed and found to occur at about 9.7 MPa.  相似文献   
33.
The first purely alkoxide-based sol-gel route to nano-phase powders and thin films of perovskite La0.75Sr0.25MnO3 is described. The phase and microstructure evolution on heat treatment of free gel films to form the target nano-phase oxide were investigated by TGA, IR spectroscopy, powder XRD, SEM and TEM-EDS. The xerogel consisted of a hydrated oxo-carbonate, without remaining alkoxo groups or solvent. Heating at 5°C·min–1 decomposed the carbonate groups and yielded the pure perovskite La0.75Sr0.25MnO3 at 760°C. The cell dimensions were virtually unchanged from the first observation of perovskite at 680°C, to 1000°C, 4 h. The monoclinic cell of La0.75Sr0.25MnO3 obtained at 1000°C, 4 h, had the dimensions a = 5.475(1), b = 5.504(2), c = 7.771(1) Å, = 90.50(2), fitting the literature data quite well. Crack-free, homogenous, 150 nm thick La0.75Sr0.25MnO3 films were prepared by spin-coating Si/SiO2/TiO2/Pt and polycrystalline -Al2O3 substrates with a 0.6 M alkoxide solution, followed by heating at 5°C·min–1 to 800°C, 30 min.  相似文献   
34.
Starting from the Kubo formula the conductivity tensor of a two-dimensional electronic system in a perpendicular magnetic field is evaluated. It is shown that at zero temperature only the states at the Fermi level contribute. The Hall conductivity of a purely periodic system of finite width is calculated and compared with earlier suggestions by Thouless et al. For a system described by a periodic and a random potential the Hall conductivity is calculated as a function of the electron density. The results emphasize the importance of disorder independent current carrying states for the Quantum Hall effect which extend along the boundaries of the system. The plateaux values of the Hall conductivity are related to the number of these states, and are independent of the existence of extended bulk states below the Fermi energy.  相似文献   
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