Self-defocusing/focusing of a relativistic laser pulse in a multiple-ionizing gas

A fast rising flattop high power laser pulse, with Gaussian intensity distribution along its wavefront, causes single and double ionizations of the gas through which it propagates. The foot of the pulse causes single ionization of the gas and creates a sharp radial density profile resulting in strong defocusing of the front part of the pulse. After a little while, single state ionization saturates, creating a flat density profile in the axial region and weakening the divergence of the pulse. As the intensity of the pulse rises further, second state ionization occurs, causing strong defocusing of the beam. Later in time when the second state ionization saturates, the relativistic mass nonlinearity together with the electron cavitation tends to focus the pulse.     

Design,synthesis and spectroscopic and crystallographic characterisation of novel functionalized pyrazole derivatives: biological evaluation for their cytotoxic,angiogenic and antioxidant activities

Research on Chemical Intermediates - The current study presents the synthesis of functionalized pyrazoles (18–29) through 3?+?2 annulation reaction of ethyl...     

Structural,spectral, and theoretical investigations of 5-methyl-1-phenyl-1H-pyrazole-4-carboxylic acid

Research on Chemical Intermediates - The present research work has focused on combined experimental and theoretical studies of one of the biologically important pyrazole-4-carboxylic acid...     

Brookhart's Acid-Catalyzed Switchable Regioselective N-Alkylation of Arylamines/Heterocyclic Amines with Cyclopropylcarbinols by Temperature Regulation

An unprecedented, Brookhart's acid-catalyzed temperature-switchable regioselective divergent approach for N-alkylation of arylamines and heterocyclic amines by utilising cyclopropylcarbinols is presented herein. The reaction offers N-alkylated cyclopropyl derivatives and homoallyl amines by employing 2.5 mol% catalyst loading at different temperatures in excellent regioselectivity and yields. This method has shown to be relevant with a wide range of cyclopropylcarbinols, including aliphatic ones. Several control experiments and spectroscopic studies have been performed to gain insight into the reaction mechanism. Further, the synthetic utility of the protocol has also been described.     

Coordination Cage-Based Emulsifiers: Templated Formation of Metal Oxide Microcapsules Monitored by In Situ LC-TEM

Metallo-supramolecular self-assembly has yielded a plethora of discrete nanosystems, many of which show competence in capturing guests and catalyzing chemical reactions. However, the potential of low-molecular bottom-up self-assemblies in the development of structured inorganic materials has rarely been methodically explored so far. Herein, we present a new type of metallo-supramolecular surfactant with the ability to stabilize non-aqueous emulsions for a significant period. The molecular design of the surfactant is based on a heteroleptic coordination cage ( CGA-3 ; CGA =Cage-based Gemini Amphiphile), assembled from two pairs of organic building blocks, grouped around two Pd(II) cations. Shape-complementarity between the differently functionalized components generates discrete amphiphiles with a tailor-made polarity profile, able to stabilize non-aqueous emulsions, such as hexadecane-in-DMSO. These emulsions were used as a medium for the synthesis of spherical metal oxide microcapsules (titanium oxide, zirconium oxide, and niobium oxide) from soluble, water-sensitive alkoxide precursors by allowing a controlled dosage of water to the liquid-liquid phase boundary. Synthesized materials were analyzed by a combination of electron microscopic techniques. In situ liquid cell transmission electron microscopy (LC-TEM) was utilized for the first time to visualize the dynamics of the emulsion-templated formation of hollow inorganic titanium oxide and zirconium oxide microspheres.     

Ab Initio Molecular Dynamics Simulations of the Interaction between Organic Phosphates and Goethite

Today’s fertilizers rely heavily on mining phosphorus (P) rocks. These rocks are known to become exhausted in near future, and therefore effective P use is crucial to avoid food shortage. A substantial amount of P from fertilizers gets adsorbed onto soil minerals to become unavailable to plants. Understanding P interaction with these minerals would help efforts that improve P efficiency. To this end, we performed a molecular level analysis of the interaction of common organic P compounds (glycerolphosphate (GP) and inositol hexaphosphate (IHP)) with the abundant soil mineral (goethite) in presence of water. Molecular dynamics simulations are performed for goethite–IHP/GP–water complexes using the multiscale quantum mechanics/molecular mechanics method. Results show that GP forms monodentate (M) and bidentate mononuclear (B) motifs with B being more stable than M. IHP interacts through multiple phosphate groups with the 3M motif being most stable. The order of goethite–IHP/GP interaction energies is GP M < GP B < IHP M < IHP 3M. Water is important in these interactions as multiple proton transfers occur and hydrogen bonds are formed between goethite–IHP/GP complexes and water. We also present theoretically calculated infrared spectra which match reasonably well with frequencies reported in literature.     

MAC-level Forward Error Correction mechanism for minimum error recovery overhead and retransmission

Wireless transmission suffers from poor wireless channel conditions, such as high bit error rate and error bursts resulting from channel fading and radio interference. The MAC-level Forward Error Correction (MFEC) mechanism is proposed to solve these problems. The MFEC mechanism cannot only adaptively adjust Forward Error Correction (FEC) redundancy, depending on the network condition, but can also retransmit whole packets even if the error packet includes several bit errors. In this paper, an Adaptive MAC-level FEC (AMFEC) mechanism is proposed to improve wireless transmission quality. The AMFEC mechanism relies on the effective packet loss rate model to dynamically adjust MFEC redundancy in order to minimize error recovery overhead. The AMFEC mechanism will retransmit the error of sub-packets and increase FEC redundancy to reduce transmission redundancy. The AMFEC mechanism not only enhances the quality of wireless transmission but also reduces the overhead of retransmission. The experimental results show the AMFEC mechanism is better than conventional MFEC mechanisms.