This work reports a theoretical study to investigate the electronic structure and optimized
geometry for (PVA-PEG-PbO 2)(78Atom) by using DFT at B3LYP level with bases set …

This study focuses on the quantum mechanical treatment of the geometrical optimization
and the electronic structure problems of a nanomaterial PMMA and nanocomposites. The …

In this paper, the effect of (Al 2 O 3, ZrO 2, Ag, Al 2 O 3-Ag, ZrO 2-Ag) nanoparticles on the
optimized geometrical parameters and electronic properties of poly-methylmethacrylate has …

This work reports a theoretical study to investigate the electronic structure and optimized
geometry for pure PMMA and PMMA doped with ZrO 2, Al 2 O 3 and Pt nanoparticles for …

In this work, design of (polystyrene-lithium fluoride) structure and studying the structural,
electronic (energy gap, cohesive energy, ionization potential, electron affinity, chemical …

Abstract The [(poly-methyl methacrylate (PMMA)-polystyrene (PS)] blend doped with
nanoparticles can be considered a quite promising material for different medical …

In the current work, the effect of increasing the number of atoms on the geometric,
electronics and spectral properties of the PVA-CoO-SiC) structure was studied by Gaussian …

The (polymer blend-oxide) nanocomposites are considered as promising materials in the
fields of sensors, radiation shielding, antibacterial, thermal energy storage and release …

Chemical preparation, crystallographic characterization, thermal behavior, and IR vibration
spectrometry studies are given for the cyclotriphosphate decahydrate of manganese and …

PMMA has many applications in different medical, electronics, optics and industrial fields.
PEG has been used in various biological and industrial applications. Nanometal nitride like …