Influence of Aluminum, Gallium, Indium- Doping on the Boron-Nitride Nanotubes (BNNTs) investigated with density functional theory (DFT) and Hartreefock (HF) methods. For this purpose, the chemical shift of difference atomic nucleus was studied using the gauge included atomic orbital (GIAO) approch. In the following, structural parameter values, electrostatic potential, thermodynamic parameters,...

We study the effect of rotation on the excitation of internal oscillation modes of a star by the external gravitational potential of its companion. Unlike the nonrotating case, there are difficulties with the usual mode decomposition for rotating stars because of the asymmetry between modes propagating in the direction of rotation and those propagating opposite to it. For an eccentric binary sy...

We present time resolved CCD photometry and spec-troscopy of the cataclysmic variable HE2350-3908 discovered in the Hamburg/ESO survey. We find that the orbital period of this source is 78.2 min. This is the shortest orbital period known to date for a cataclysmic variable with a normal hydrogen-rich secondary. The optical spectrum and the orbital light curve of HE2350-3908 is very similar to WZ...

Beams with helical phasefronts described by exp(ilphi) carry an orbital angular momentum equivalent to lh per photon. Using diffractive optics this helical phase structure can be applied to every spectral component of the beam such that a spatially coherent white-light beam can carry orbital angular momentum without any chromatic distortion. This achromatic property can be hard to achieve in sp...

The hangman motif provides mechanistic insights into the role of pendant proton relays in governing proton-coupled electron transfer (PCET) involved in the hydrogen evolution reaction (HER). We now show improved HER activity of Ni compared with Co hangman porphyrins. Cyclic voltammogram data and simulations, together with computational studies using density functional theory, implicate a shift ...

Detailed numerical analysis is presented for the effect of spaceship orbital transfer on solution convection during protein crystal growth under microgravity. The results show that the flow and mass transfer during protein crystal growth are unsteady in the process of orbital transfer. For the case of quasi-steady acceleration, the flow is so weak that the effect of flow on concentration field ...

We present a numerical study of the mass transfer dynamics prior to the gravitational wave-driven merger of a double white dwarf system. Recently, there has been some discussion about the dynamics of these last stages, different methods seemed to provide qualitatively different results. While earlier SPH simulations indicated a very quick disruption of the binary on roughly the orbital time sca...

We demonstrate the optical orbital angular momentum conservation during the transfer process from subwavelength plasmonic vortex lens (PVLs) to light and the generating process of surface plasmon polaritons (SPPs). Illuminating plasmonic vortex lenses with beams carrying optical orbital angular momentum, the SP vortices with orbital angular momentum were generated and inherit the optical angula...

We introduce a multistate framework for Fragment Molecular Orbital (FMO) quantum mechanical calculations and implement it in the context of protonated water clusters. The purpose of the framework is to address issues of nonuniqueness and dynamic fragmentation in FMO as well as other related fragment methods. We demonstrate that our new approach, Fragment Molecular Orbital Multistate Reactive Mo...

The concept of a measurement of the yet unevaluated Hannay angle, by means of an Earth-bound satellite, adiabatically driven by the Moon, is shown herein. Numerical estimates are given for the angles, the orbital displacements, the shortening of the orbital periods, for different altitudes. It is concluded that the Hannay effect is measurable in high Earth orbits, by means of atomic clocks, acc...