All Stories

  1. Exploration of ground state carbon-based halides properties: an ab. initio approach
  2. Computational preductions of ZrCl4 with density functional theory
  3. The structural, electronic, optical, mechanical and vibrational properties of Te2W with HSE03
  4. Computational modeling and predictions of CeO2 with DFT calculations
  5. Computational modelling and DFT simulations of AgNO3 compound
  6. Computational Predictions on TiS3 material with density functional theory
  7. Computational Simulations on Cuprous iodide (CuI) compound
  8. Computational calculations on Ag3X (X=S , Se) with ab. initio. methods
  9. Computational Predictions on Compound Sb2Se3
  10. Computational predictions on WO3
  11. Computational predictions on Boron oxide B2O3
  12. The DFT calculations of bulk and Te-doped SnSe2
  13. Computational predictions on Sn-doped Ga2O3 using density functional theory
  14. Computational predictions and descriptions on SnO materials.
  15. Computational predictions on Ga2O3
  16. Computational predictions on Arsenic-Selenium alloy compound
  17. Computational predictions of two-dimensional graphene-like GaN with density functional theory
  18. hexagonal h-ZnS with density functional theory
  19. The electronic and optical properties of SiO2–Al–SiO2 with density functional theory
  20. The optical and elastic properties of strained ZnO by first principle calculations
  21. Materials Research Express, October 2019, Institute of Physics Publishing
  22. The First Principle Study: Structural, Electronic, Optical, Phonon and Elastic Properties in Bulk and Monolayer Molybdenum Ditelluride
  23. The Structural, Electronic, Optical and Elastic Properties of ε-Type Gallium Selenide: A First Principle Study
  24. The electronic and structural properties in Ca2TiMnO6 double perovskite: The first principle study
  25. First Principle Study: Electronic Properties of Graphene on Boron Phosphide
  26. The bandgap distribution investigated across the strain-induced bending ZnO nanowire
  27. The first principle study of electronic and optical properties in rhombohedral BiAlO 3
  28. The first principle study: Electronic and optical properties in Bi2Se3
  29. Are InGaAs and InGaP Nanowires piezoelectric?
  30. Graphene/GaN diodes for ultraviolet and visible photodetectors
  31. Tunable band gap in germanene by surface adsorption
  32. Non-linear piezoelectricity in zinc blende GaAs and InAs semiconductors
  33. Non linear piezoelectricity in zincblende GaAs and InAs semiconductors
  34. Strain dependence of internal displacement and effective charge in wurtzite III-N semiconductors
  35. Opto-electronics, December 2011, Springer Science + Business Media
  36. Erratum: Second-order piezoelectricity in wurtzite III-N semiconductors [Phys. Rev. B84, 085211 (2011)]
  37. Investigating the effect of non linear piezoelectricity on the excitonic properties of III-N semiconductor quantum dots
  38. Physical Review B, August 2011, American Physical Society (APS)