Green synthesis of AgCl nanoparticles using Calotropis gigantea: characterization and their enhanced antibacterial activities

BK Mandal, R Mandal, D Limbu, MD Adhikari… - Chemical Physics …, 2022 - Elsevier
This research work has mainly focused on the different properties and antibacterial activities
of green synthesized AgCl-NPs. The characterizations of prepared powder of AgCl-NPs …

Validation of hybrid WC1LYP functional for ferroelectric LiNbO3 and LiTaO3 using Compton spectroscopy and first-principles computations

PK Joshi, K Kumar, D Mali, G Arora, L Meena… - Materials Today …, 2022 - Elsevier
Electronic structure and theoretical momentum densities (EMDs) of LiNbO 3 and LiTaO 3
using linear combination of atomic orbitals (LCAO) scheme are deduced. Present energy …

Stability and Polaronic Motion of Self-Trapped Holes in Silver Halides: Insight through DFT+U Calculations

S Loftager, P García-Fernández… - The Journal of …, 2016 - ACS Publications
Polarons and their associated transport properties are a field of great current interest both in
chemistry and physics. To further our understanding of these quasi-particles, we have …

Response properties of AgCl and AgBr under an external static electric field: A density functional study

CS Praveen, A Kokalj, M Rérat, M Valant - Solid state sciences, 2012 - Elsevier
Density functional theory has been applied to investigate the effect of electric field on the
electronic properties of AgCl and AgBr crystals using a static electric field perturbation. A …

Electronic properties and Compton profiles of silver iodide

A Dashora, A Marwal, KR Soni, BL Ahuja - Pramana, 2010 - Springer
We have carried out an extensive study of electronic properties of silver iodide in β-and γ-
phases. The theoretical Compton profiles, energy bands, density of states and anisotropies …

Atomic solid state energy scale applied to novel thin-film solar absorbers

BD Pelatt - 2013 - ir.library.oregonstate.edu
The atomic solid state energy (SSE) scale is introduced as a tool for inorganic materials
design. The SSE scale is obtained by assessing an average electron affinity (EA)(for a …

Determining the mutual Interaction factor for Phonon-Exciton in AgBr crystal doped with copper

N Shaaban, S Nouraldin - Tishreen University Journal-Basic …, 2019 - journal.tishreen.edu.sy
The essential absorption edge of AgBr doped with copper is investigated and studied as a
function of temperature, in the temperature range from 140 K to 490 K, and in the energy …