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Theoretical insight into the stability, magneto-electronic and thermoelectric properties of V2MnAs Heusler alloy
Recognized for its precision in investigating physical properties, we employed the full-potential linearized augmented plane wave (FP-LAPW) method in...
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Insight into the physical properties of beryllium-based ternary centro-symmetric fluoroperovskites BeXF3 (X = Bi, Y, Al, Sc, and In) compounds using the first-principle approach
In this study, an extensive exploration of the perovskite family has been conducted to thoroughly investigate their promising applications and...
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Insight into excitation wavelength and hotspot effect of noble metal nanoparticles dimer
A proper excitation wavelength and strong hot-spot effect are of great importance for the application of surface-enhanced Raman spectroscopy (SERS)...
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Domain structure and structural transformation of melt alumina under compression: insight from visualization method and molecular dynamic simulation
Molecular dynamic simulation has been done to investigate the domain structure and structural transformation of liquid alumina at 3500 K and under...
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Insight of ZnO/CuO and ZnO/Cu2O solar cells efficiency with SCAPS simulator
Despite the low power conversion efficiency of solar cells n-ZnO/p-CuO and n-ZnO/p-Cu 2 O, they can contribute to the development of photovoltaic...
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Insight to the Structural, Electronic, Optical, and Thermoelectric Properties of NaCaSb and KCaSb Half Heusler Compounds: A DFT Approach
Full-potential, linearized augmented plane wave approach (FP LAPW), as employed in Wien2K code was utilized to analyze structural, elastic,...
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Effect of microstrain on the magnetic properties of reduced graphene oxide by Fe3O4 nanoparticles: insight from experimental and density functional theory
In this report, we studied the impact of particle size-lattice strain on the magnetic properties of reduced graphene oxide functionalized with iron...
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Structural, Electronic, and Magnetic Characteristics of Co1-xFexMnSb: Insight from DFT Computation
Both electronic as well as magnetic characteristics of Co 1-x Fe x MnSb ( x = 0, 0.25, 0.50, 0.75, 1) composite have been studied by employing the first...
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Adsorption Characteristics of the Anticancer Drug Hydroxyurea with Armchair BN Graphene Nanoribbons Containing and Lacking Vacancy Defects: Insight via DFT Calculations
The identification of suitable nanocarriers for drug delivery has been a constant area of research and development. Two-dimensional nanomaterials...
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Insight into the structural, elastic, optoelectronic, and thermodynamic properties of GaXF3 (X = Se, Si) via density functional theory
The pursuit of new materials with tailored properties is essential for advancing technology. This research focuses on GaXF 3 (X = Se, Si)...
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Insight of the relation between Regge theory and Hadron dynamics
In the present contribution, efforts are made to develop an insight between two verticals of strong interaction phenomenology, namely the archaic...
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New insight into 3-picoline—deuterium oxide (D2O) mixtures of limited miscibility with the lower critical consolute temperature
Coexistence curves in mixtures of limited miscibility with the lower critical consolute temperature (LCT), of 3-picoline with deuterium oxide (D 2 O),...
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Analytical insight to explore the behavior of neem gum modified NHL 3.5 mortar
The use of lime mortar to bind historic masonries exists over centuries. Traditionally natural additives are used in the manufacture of lime mortar...
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Insight on the optoelectronic properties of novel quaternary Ge–Se–Tl–Sb non-crystalline glassy alloy films for optical fiber sensing devices
Chalcogenide glass (Ge 0.1 Se 0.7 Tl 0.2 ) 85 Sb 15 is synthesized in bulk form by the melt quenching method and thermally evaporated as thin films. The...
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Quantum Chemical Insight into Molecular Structure, Spectroscopic and Nonlinear Optical Studies on Methylene bis(dithiobenzoate)
AbstractIn this study, the methylene bis(dithiobenzoate) molecule, (C 15 H 12 S 4 ), as a bioactive molecule has been subjected to quantum chemical...
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Plasmonic Sensors: An Insight into Fundamentals, Compositions, and Applications
Plasmon resonance principle has become a very important tool for the development of plasmonic sensors, particularly in the case of biosensing and...
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Insight into OLPT model conduction mechanism and dielectric relaxation of lead borate glass containing Cr and Ge ions
Lead borate glass with compositions 25B 2 O 3 –73.8PbO– x GeO 2 -(1.2 − x ) Cr 2 O 3 ( x ≤ 1.2 mol. %) is fabricated by the melt quenching procedure. The...
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Insight into the physical properties of the inter-metallic titanium-based binary compounds
Herein, we present the structural, magnetic, electronic along with elastic properties of inter-metallic X 3 Ti (X = Ce, Eu, Nd, Pm and Yb) compounds...
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Cadmium selenium nanocrystal: first-principles insight into the structural, electronic, and optical properties
A first-principles calculation has investigated the structural, electronic, optical of the CdSe nanocrystal (NC) based on the generalized gradient...
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A systematic insight into the surface plasmon polaritons guided by the graphene based heterostructures
Graphene paves the way for the outstanding applications as it is one-atom thick and possesses perfect tunability properties. The main goal of this...
