| First theoretical probe for efficient enhancement of nonlinear optical properties of quinacridone based compounds through various modifications |
25 |
| Prediction of enthalpy for the gases CO, HCl, and BF |
24 |
| Quantum chemical designing of indolo[1-jk]carbazole-based dyes for highly efficient nonlinear optical properties |
23 |
| Predictions of entropy for diatomic molecules and gaseous substances |
23 |
| First-principles investigation on detection of phosgene gas molecules using phosphorene nanosheet device |
22 |
| Synthesis of ZnO particles with multi-layer and biomorphic porous microstructures and ZnO/rGO composites and their applications for photocatalysis |
17 |
| Prediction of enthalpy for the gases Cl- Br- and gaseous BBr |
17 |
| Multiple energy applications of quantum-dot sensitized TiO2/PbS/CdS and TiO2/CdS/PbS hierarchical nanocomposites synthesized via p-SILAR technique |
16 |
| Study of structural and magnetic properties of cobalt ferrite (CoFe2O4) nanostructures |
15 |
| Sb doping of VLS synthesized SnO2 nanowires probed by Raman and XPS spectroscopy |
15 |
| Tunable electronic and optical properties of new two-dimensional GaN/BAs van der Waals heterostructures with the potential for photovoltaic applications |
15 |
| Facile fabrication and enhanced photocatalytic performance: From BiOCl to element-doped BiOCl |
15 |
| Silicene nanosheet device with nanopore to identify the nucleobases - A first-principles perspective |
15 |
| Magnetic field effects on oscillator strength, dipole polarizability and refractive index changes in spherical quantum dot |
14 |
| Determination of the liquid chemicals depending on the electrical characteristics by using metamaterial absorber based sensor |
14 |
| Vertical strain and electric field tunable electronic properties of type-II band alignment C2N/InSe van der Waals heterostructure |
13 |
| DFT study of third-order nonlinear susceptibility of a chalcone crystal |
13 |
| TiO2 supported gold nanoparticles: An efficient photocatalyst for oxidation of alcohol to aldehyde and ketone in presence of visible light irradiation |
13 |
| Study on interfacial and mechanical improvement of carbon fiber/epoxy composites by depositing multi-walled carbon nanotubes on fibers |
13 |
| Prediction of Gibbs free energy for the gases Cl- Br- and HCl |
13 |
| Application of acoustic micro-resonators in quartz-enhanced photoacoustic spectroscopy for trace gas analysis |
12 |
| Quantum chemical calculations on sparfloxacin and boron complexes |
12 |
| Novel bismuthene nanotubes to detect NH NO2 and PH3 gas molecules - A first-principles insight |
12 |
| Silver nanoparticles anchored reduced graphene oxide for enhanced electrocatalytic activity towards methanol oxidation |
11 |
| Preparation of nitrogen doped carbon from tree leaves as efficient CO2 adsorbent |
11 |
| Synthesis, structural elucidation, thermal, mechanical, linear and nonlinear optical properties of hydrogen bonded organic single crystal guanidinium propionate for optoelectronic device application |
11 |
| Hierarchical porous ZnO microflowers with ultra-high ethanol gas-sensing at low concentration |
11 |
| Super high-rate fabrication of high-purity carbon nanotube aerogels from floating catalyst method for oil spill cleaning |
11 |
| Tunable optical and electronic properties of gallium telluride monolayer for photovoltaic absorbers and ultraviolet detectors |
11 |
| Manganese porphyrin immobilized on magnetic MCM-41 nanoparticles as an efficient and reusable catalyst for alkene oxidations with sodium periodate |
11 |
| Structural and electronic properties of M-MOF-74 (M = Mg, Co or Mn) |
11 |
| Shannon entropy: A study of confined hydrogenic-like atoms |
11 |
| Dye-sensitized solar cells using ionic liquids as redox mediator |
10 |
| Antimonene nanosheet device for detection of explosive vapors - A first-principles inspection |
10 |
| Fe7S8 nanoparticles attached carbon networks as anode materials for both lithium and sodium ion batteries |
10 |
| Activation mechanism of sodium percarbonate by FeOCl under visible-light-enhanced catalytic oxidation |
10 |
| Synthesis and photoluminescence properties of novel thermally robust Na3GdP2O8: Re3+ (Re = Sm, Dy) phosphors |
10 |
| Hierarchical porous carbon materials derived from petroleum pitch for high-performance supercapacitors |
10 |
| Enhanced photocatalytic activities of Ag3PO4/GO in tetracycline degradation |
10 |
| Correlation between surface topography, optical band gaps and crystalline properties of engineered AZO and CAZO thin films |
10 |
| Probing the structures and properties of Ti2Si20-/0 clusters by density functional theory calculations |
10 |
| 2-bis(4-chlorobenzylidene)Azine as new and effective corrosion inhibitor for copper in 0.1 N HCl: A combined experimental and theoretical approach |
10 |
| Photocatalytic hydrogen production using TiO2 nanogranules prepared by hydrothermal route |
9 |
| Core-shell structured TiO2@In2O3 for highly active visible-light photocatalysis |
9 |
| Theoretical insight into molecular mechanisms of inhibitor bindings to bromodomain-containing protein 4 using molecular dynamics simulations and calculations of binding free energies |
9 |
| Insight into visible light-driven photocatalytic performance of direct Z-scheme Bi2WO6/BiOI composites constructed in -situ |
9 |
| In situ synthesis of mesoporous Co3O4 nanorods anchored on reduced graphene oxide nanosheets as supercapacitor electrodes |
9 |
| Application of biochar derived from date palm biomass for removal of lead and copper ions in a batch reactor: Kinetics and isotherm scrutiny |
9 |
| Mechanical properties and strengthening mechanism of epoxy resin reinforced with nano-SiO2 particles and multi-walled carbon nanotubes |
9 |
| Study on the effect of Co doping concentration on optical properties of g-C3N4 |
9 |
