All Stories

  1. Structural and Dynamic Characterization of Li–Ionic Liquid Electrolyte Solutions for Application in Li-Ion Batteries: A Molecular Dynamics Approach
  2. Ab Initio Study of Electronic Transport in Cubic-HfO2 Grain Boundaries
  3. Strain-designed strategy to induce and enhance second-harmonic generation in centrosymmetric and noncentrosymmetric materials
  4. Determination of the Electronic Energy Levels of Colloidal Nanocrystals using Field-Effect Transistors and Ab-Initio Calculations
  5. Defects and strain enhancements of second-harmonic generation in Si/Ge superlattices
  6. Ab Initio Electronic Gaps of Ge Nanodots: The Role of Self-Energy Effects
  7. Large crystal local-field effects in second-harmonic generation of a Si/CaF2interface: Anab initiostudy
  8. Second-harmonic generation in silicon waveguides strained by silicon nitride
  9. Second-Harmonic Generation Spectroscopy from Time-Dependent Density-Functional Theory
  10. Local-fields and disorder effects in free-standing and embedded Si nanocrystallites
  11. Electronic and optical properties of Si and Ge nanocrystals: An ab initio study
  12. Size, oxidation, and strain in smallSi/SiO2
  13. Ab-initio calculations of luminescence and optical gain properties in silicon nanostructures
  14. Optical properties of silicon nanocrystallites in SiO2 matrix: Crystalline vs. amorphous case
  15. Impurity screening in silicon nanocrystals
  16. Silicon nanocrystallites in aSiO2matrix: Role of disorder and size
  17. Engineering Quantum Confined Silicon Nanostructures: Ab-Initio Study of the Structural, Electronic and Optical Properties
  18. Optical absorption spectra of doped and codoped Si nanocrystallites
  19. Novel optoelectronic properties of simultaneously n- and p-doped silicon nanostructures
  20. First-Principles Study of Silicon Nanocrystals: Structural and Electronic Properties, Absorption, Emission, and Doping
  21. Structural features and electronic properties of group-III-, group-IV-, and group-V-doped Si nanocrystallites
  22. Engineering silicon nanocrystals: Theoretical study of the effect of codoping with boron and phosphorus
  23. Ab-initio electronic and optical properties of low dimensional systems: From single particle to many-body approaches
  24. Doping in silicon nanocrystals
  25. Doping in silicon nanostructures
  26. Excitons in silicon nanocrystallites: The nature of luminescence
  27. Codoping goes Nano: Structural and Optical Properties of Boron and Phosphorus Codoped Silicon Nanocrystals
  28. Doping in silicon nanocrystals: An ab initio study of the structural, electronic and optical properties
  29. Understanding Doping In Silicon Nanostructures
  30. Screening in semiconductor nanocrystals:Ab initioresults and Thomas-Fermi theory
  31. Thomas-Fermi model of electronic screening in semiconductor nanocrystals
  32. Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties
  33. First-principles study ofn- andp-doped silicon n...
  34. Electronic, structural and optical properties of hydrogenated silicon nanocrystals: the role of the excited states
  35. Formation energies of silicon nanocrystals: role of dimension and passivation
  36. The electronic and optical properties of silicon nanoclusters: absorption and emission
  37. Ab-initio Calculations Of The Electronic Properties of Silicon Nanocrystals: Absorption, Emission, Stokes Shift
  38. Ab initiostructural and electronic properties of hydrogenated silicon nanoclusters in the ground and excited state
  39. Surface and confinement effects on the optical and structural properties of silicon nanocrystals
  40. Role of the interface region on the optoelectronic properties of silicon nanocrystals embedded in SiO 2
  41. Si nanostructures embedded in SiO 2 : electronic and optical properties
  42. Structural and Optical Properties of Silicon Nanocrystals Grown by Plasma-Enhanced Chemical Vapor Deposition
  43. Role of defects in Si/SiO2 quantum wells
  44. From Undulating Si Quantum Wires to Si Quantum Dots: A Model for Porous Silicon
  45. Symmetry and passivation dependence of the optical properties of nanocrystalline silicon structures
  46. P and B single- and co-doped silicon nanocrystals: formation and activation energies, electronic and optical properties