designing a power splitter with five ports has been shown in this article. in order to prevent the direct coupling between waveguides, a t-shaped structure with an appropriate distance has been used. the coupling between the parallel photonic crystal waveguides is based on multimode interference, while selecting the output efficiency is performed by setting the refractive coefficients and radiu...

In the title compound, C(14)H(7)F(2)NO(2), the phthalimide ring system is nearly planar [maximum atomic deviation = 0.028 (1) Å] and it is twisted with respect to the attached benzene ring, making a dihedral angle of 55.70 (6)°. Weak inter-molecular C-H⋯F hydrogen bonds are present in the crystal structure.

In the title compound, C18H12O2, the non-H atoms are nearly coplanar, the maximum atomic deviation being 0.113 (2) Å. π-π stacking is observed in the crystal structure, the shortest centroid-centroid distance being 3.5983 (19) Å. The mol-ecular packing is further stabilized by weak C-H⋯O hydrogen bonds, forming an infinite chain along [100] and generating a C(6) motif.

PDFfit2 is a program as well as a library for real-space refinement of crystal structures. It is capable of fitting a theoretical three-dimensional (3D) structure to atomic pair distribution function data and is ideal for nanoscale investigations. The fit system accounts for lattice constants, atomic positions and anisotropic atomic displacement parameters, correlated atomic motion, and experim...

In the the title compound, C(19)H(18)BrNO(3), the furan-one ring is almost planar [maximum atomic deviation = 0.019 (3) Å] and is nearly perpendicular to the two phenyl rings, making dihedral angles of 88.96 (17) and 87.71 (17)°. Inter-molecular C-H⋯O hydrogen bonding is present in the crystal structure.

The melting of elemental solids is modelled as a dislocation-mediated transition on a lattice. Statistical mechanics of linear defects is used to obtain a new relation between melting temperature, crystal structure, atomic volume, and shear modulus that is accurate to 17% for at least half of the Periodic Table.

Density functional theory is used to determine the possible crystal structure of the CaSiO3 perovskites and their evolution under pressure. The ideal cubic perovskite is considered as a starting point for studying several possible lower-symmetry distorted structures. The theoretical lattice parameters and the atomic coordinates for all the structures are determined, and the results are discusse...

a new metal-organic compound, [fe(pydc)(dmso)(h2o)cl], (where pydc is pyridine-2, 6-dicarboxylate and dmso is dimethyl sulfoxide), has been synthesized and characterized by singlecrystal x-ray diffraction, tga/dta, ir and raman spectroscopy. green-yellow crystals,crystallized in the monoclinic system, space group p21/n, a = 7.2461(4) å, b = 10.3018(4) å, c =17.7667(10) å, α = 90°, β = 90.014°(5...

The title compound, C(15)H(13)NO(2), was synthesized by N-alkyl-ation of methyl bromo-acetate with 9H-carbazole. The carbazole ring system is essentially planar (mean atomic deviation = 0.0346 Å) and makes a dihedral angle of 86.5 (7)° with the methyl acetate group. Weak inter-molecular C-H⋯O hydrogen bonding is present in the crystal structure.

The SDS, PEG and CTAB roofed MgO nano powders were synthesized by co-precipitation method.  The sintered nano powders was shown Fm-3m space group with cubic phase obtained by the XRD pattern. The lattice strain was calculated to be used Williamson-Hall equations (W-H). The formation of Mg-O bond and hydroxyl radicals on the surface were confirmed by the FTIR analyses. The TEM revealed that the ...