This Review provides the first comprehensive overview of the structure and properties of exotic -crystalline aperiodic cyclic multiply twinned nano- (10-100 ) and meso- (up to 1 ) diamond particles (MTPs) exhibiting pentagonal symmetry. It spans their independent experimental discoveries (1963, 1964, 1972, and 1983) and theoretical structural insights (1993) to recent advancements. The Review focuses on high-symmetry MTPs formed by the fusion of multiple cubic diamond fragments through [111] facets.
View Article and Find Full Text PDFMicromachines (Basel)
September 2023
Advanced two-dimensional spin-polarized heterostructures based on twisted (TBG) and nanoporous (NPBG) bilayer graphenes doped with Eu ions were theoretically proposed and studied using Periodic Boundary Conditions Density Functional theory electronic structure calculations. The significant polarization of the electronic states at the Fermi level was discovered for both Eu/NPBG(AA) and Eu/TBG lattices. ions' chemi- and physisorption to both graphenes may lead to structural deformations, drop of symmetry of low-dimensional lattices, interlayer fusion, and mutual slides of TBG graphene fragments.
View Article and Find Full Text PDFSulfonamides are one of the oldest groups of veterinary chemotherapeutic agents. Physico-chemical properties, the concentration and the nature of the environment are the factors responsible for the distribution of sulfonamides in the living organism. Although these drug compounds have been in use for more than half a century, knowledge about their behavior is still limited.
View Article and Find Full Text PDFGd@COH endohedral complexes for advanced biomedical applications (computer tomography, cancer treatment, etc.) were synthesized using high-frequency arc plasma discharge through a mixture of graphite and GdO oxide. The Gd@C endohedral complex was isolated by high-efficiency liquid chromatography and consequently oxidized with the formation of a family of Gd endohedral fullerenols with gross formula Gd@CO(OH).
View Article and Find Full Text PDFZn(II), Pd(II), and Cd(II) complexes, (M = Zn, Pd; X = Br, Cl) and (X = Cl, Br; = , 2), supported by the ()- , -dimethyl- -(thiophen-2-ylmethylene)ethane-1,2-diamine ( ) ligand are synthesized and structurally characterized. Density functional theory (DFT) electronic structure calculations and variable-temperature NMR support the presence of two conformers and a dynamic interconversion process of the minor conformer to the major one in solution. It is found that the existence of two relevant complex conformers and their respective ratios in solution depend on the central metal ions and counter ions, either Cl or Br.
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