Entropy generation of nanomaterial through a tube considering swirl flow tools

Journal of Thermal Analysis and Calorimetry - The focus of the current investigation is on insertion of complex-shaped device for inducing swirl intensity. H2O-based copper oxide mixture was...     

Water catalysis and anticatalysis in photochemical reactions: observation of a delayed threshold effect in the reaction quantum yield

The possible catalysis of photochemical reactions by water molecules is considered. Using theoretical simulations, we investigate the HF-elimination reaction of fluoromethanol in small water clusters initiated by the overtone excitation of the hydroxyl group. The reaction occurs in competition with the process of water evaporation that dissipates the excitation and quenches the reaction. Although the transition state barrier is stabilized by over 20 kcal/mol through hydrogen bonding with water, the quantum yield versus energy shows a pronounced delayed threshold that effectively eliminates the catalytic effect. It is concluded that the quantum chemistry calculations of barrier lowering are not sufficient to infer water catalysis in some photochemical reactions, which instead require dynamical modeling.     

Nutational stimulated photon echoes

Stimulated photon echoes (SPEs) with time duration comparable to the coherent lifetime and Rabi period have been investigated theoretically and experimentally with an angled beam configuration. The Rabi oscillation effects on both the transmitted field (optical nutation) and the SPE fields are explained by analytic solutions of Maxwell-Bloch equations. The theory also predicts that an echo can exist in the noncausal direction, and this was confirmed by experiments with Tm:YAG crystal.     

Dynamics on the Double Morse Potential: A Paradigm for Roaming Reactions with no Saddle Points

In this paper we analyze a two-degree-of-freedom Hamiltonian system constructed from two planar Morse potentials. The resulting potential energy surface has two potential wells surrounded by an unbounded flat region containing no critical points. In addition, the model has an index one saddle between the potential wells. We study the dynamical mechanisms underlying transport between the two potential wells, with emphasis on the role of the flat region surrounding the wells. The model allows us to probe many of the features of the “roaming mechanism” whose reaction dynamics are of current interest in the chemistry community.     

Enhanced grain growth and improved optical properties of the Sn doped thin films of Sb2S3 orthorhombic phase

The applications of newer Sb₂S₃ material as a suitable absorber material for the solar cells have been effected by the toxicity of Sb. The present study is an effort to synthesize lower Sb contents Sn doped Sb₂S₃ materials by retaining or improving the morphological and optical properties. SnCl₂ and SbCl₃ are used respectively as Sn and Sb sources, while Na₂S₂O₃ has been used as a source of S in chemical bath deposition method. Bath temperature was maintained at 10 °C and the deposition time was 4 h and the annealing of the films in vacuum was done for 2 h at 250 °C. X-ray diffraction, Rutherford backscattering spectroscopy, scanning electron microscopy and ultraviolet/visible light spectroscopy have been used for the study of structural, morphological and the optical properties. The chemical composition determined from RBS is Sn_0.11Sb₂S₃. Phase analysis confirms the orthorhombic Sb₂S₃ phase with b and c axis as the preferred ones for the impurity Sn atoms. Grain growth at lower deposition temperature is enhanced on the account of doping. Nanosized spherical particles are seen in the optical micrographs. Annealing lowers the band gap, the values being 1.50 and 1.31 eV for the unannealed and the annealed samples respectively.     

Improving performance of FxRLS algorithm for active noise control of impulsive noise

Active noise control (ANC) systems employing adaptive filters suffer from stability issues in the presence of impulsive noise. New impulsive noise control algorithms based on filtered-x recursive least square (FxRLS) algorithm are presented. The FxRLS algorithm gives better convergence than the filtered-x least mean square (FxLMS) algorithm and its variants but lacks robustness in the presence of high impulsive noise. In order to improve the robustness of FxRLS algorithm for ANC of impulsive noise, two modifications are suggested. First proposed modification clips the reference and error signals while, the second modification incorporates energy of the error signal in the gain of FxRLS (MGFxRLS) algorithm. The results demonstrate improved stability and robustness of proposed modifications in the FxRLS algorithm. However, another limitation associated with the FxRLS algorithm is its computationally complex nature. In order to reduce the computational load, a hybrid algorithm based on proposed MGFxRLS and normalized step size FxLMS (NSS-FXLMS) is also developed in this paper. The proposed hybrid algorithm combines the stability of NSS-FxLMS algorithm with the fast convergence speed of the proposed MGFxRLS algorithm. The results of the proposed hybrid algorithm prove that its convergence speed is faster than that of NSS-FxLMS algorithm with computational complexity lesser than that of FxRLS algorithm.     

Compressive laser ranging

Compressive sampling has been previously proposed as a technique for sampling radar returns and determining sparse range profiles with a reduced number of measurements compared to conventional techniques. By employing modulation on both transmission and reception, compressive sensing in ranging is extended to the direct measurement of range profiles without intermediate measurement of the return waveform. This compressive ranging approach enables the use of pseudorandom binary transmit waveforms and return modulation, along with low-bandwidth optical detectors to yield high-resolution ranging information. A proof-of-concept experiment is presented. With currently available compact, off-the-shelf electronics and photonics, such as high data rate binary pattern generators and high-bandwidth digital optical modulators, compressive laser ranging can readily achieve subcentimeter resolution in a compact, lightweight package.     

Decoration of Graphitic Surfaces with Sn Nanoparticles through Surface Functionalization Using Diazonium Chemistry

Composites of tin nanoparticles (Sn NP) and graphene are candidate materials for high capacity and mechanically stable negative electrodes in rechargeable Li ion batteries. A uniform dispersion of Sn NP with controlled size is necessary to obtain high electrochemical performance. We show that the nucleation of Sn particles on highly ordered pyrolitic graphite (HOPG) from solution can be controlled by functionalizing the HOPG surface by aryl groups prior to Sn deposition. On the contrary, we observe heterogeneous deposition of micrometer sized Sn islands on HOPG subjected to oxidation prior to deposition in the same conditions. We demonstrate that functional groups act as nucleation sites for Sn NP nucleation, and that homogeneous nucleation of small particles can be achieved by combining surface functionalization with diazonium chemistry and appropriate stabilizers in solution.