All Stories

  1. Structural distortions and lone pair activity in SnSe: A charge density analysis of the phase transition
  2. Exploring Intermediate Bonding Interactions in Sesquioxides (M2O3, M = In, Y, Al) From Experimental Charge Density Analysis
  3. Crystal growth of Piperazine and a dual approach to electron density mapping and bonding insights
  4. Structure, charge density, and Hirshfeld surface analysis of proton transfer complex 2‐amino‐4‐methylpyridinium 2‐(3‐methylphenyl)‐acetate
  5. Three dimensional atomistic-scale electron density distribution analysis of ZnWO4: Sm phosphors
  6. Charge density of difluorides from synchrotron diffraction data and investigation of bonding in low valent binary fluorides
  7. Hirshfeld surface, charge density and site selectivity studies of 1-(2-Methyl-5-nitro-1H-imidazol-1-yl)-acetone
  8. A theoretical study of chemical bonding and topological and electrostatic properties of the anti-leprosy drug dapsone
  9. Aceclofenac and interactions analysis in the crystal and COX protein active site
  10. Experimental validation of bifurcated hydrogen bond of 2,5-lutidinium bromanilate and its charge density distribution
  11. Comprehensive study on the topological properties of 5-Amino-2-Methyl Benzene Sulfonamide involving inter and intra molecular hydrogen bonds
  12. X-ray derived experimental charge density distribution in two isostructural oxyfluorotellurates, FeTeO3F and GaTeO3F
  13. Origin of ferroelectricity in orthorhombic LuFeO3
  14. Analysis of oxygen bonding with metals of different oxidation states from experimental charge density distribution
  15. Photoluminescence study of (Sm0.95 Ce0.05)2O3 nanoparticles for LED applications
  16. Enhanced photoluminescence and charge density studies of novel (Sm1−x Gdx)2O3 nanophosphors for WLED applications
  17. A novel synthesis of orange-red emitting (Sm1−xCex)2O3nanophosphors for UV LEDs
  18. Investigation of topological and electrostatic properties of anti-inflammatory drug aceclofenac
  19. Understanding electronic and magnetic transitions in ball milled diluted magnetic semiconductor Si1-xNix through experimental electron density distribution
  20. Experimental charge density distribution and its correlation to structural and optical properties of Sm 3+ doped Nd 2 O 3 nanophosphors
  21. Crystal structures of 2-methylpyridinium hydrogen 2,3-bis(4-methylbenzoyloxy)succinate and bis-[4-methylpyridinium hydrogen 2,3-bis(4-methylbenzoyloxy)succinate] pentahydrate
  22. Testing the ability of rhodanine and 2, 4-thiazolidinedione to interact with the human pancreatic alpha-amylase: electron-density descriptors complement molecular docking, QM, and QM/MM dynamics calculations
  23. 2-Amino-4-methylpyridinium 4-methoxybenzoate dihydrate
  24. 2-Amino-3-methylpyridinium hydrogen phthalate
  25. High Resolution Synchrotron Diffraction Study on Charge Density Distribution of Ampicillin Trihydrate
  26. Charge density analysis of metformin chloride, a biguanide anti-hyperglycemic agent
  27. Information reconciliation schemes in physical-layer security: A survey
  28. Investigation of the van der Waals epitaxy gap in isostructural semiconducting germanium tellurides: HfGeTe 4 and ZrGeTe 4
  29. 2-Amino-4-methylpyridin-1-ium 2-(4-nitrophenyl)acetate
  30. 2-Amino-4-methylpyridinium 2-hydroxybenzoate
  31. 2-Amino-4-methylpyridinium 4-hydroxybenzoate
  32. 2-Amino-4-methylpyridinium 4-methylbenzoate
  33. X-ray derived experimental charge density distribution in GaF3 and VF3 solid systems
  34. 2-Amino-3-methylpyridinium 3,4-dimethoxybenzoate
  35. 2-Amino-4-methylpyridinium 2-(4-nitrophenyl)acetate
  36. Bis(2-amino-6-methylpyridinium) 3-nitrobenzene-1,2-dicarboxylate
  37. 2-Amino-3-methylpyridinium 4-methoxybenzoate
  38. 2-Methylpyridinium 2-carboxy-6-nitrobenzoate
  39. 2-Amino-4-methylpyridinium 2-(3-methylphenyl)acetate
  40. 3-Methylpyridinium 4-nitrobenzoate–4-nitrobenzoic acid (1/1)
  41. 2-Amino-6-methylpyridinium 2-hydroxybenzoate
  42. Picoline series
  43. Structure and stability of a silicon cluster on sequential doping with carbon atoms
  44. Structural, magnetic and charge-related properties of nano-sized cerium manganese oxide, a dilute magnetic oxide semiconductor
  45. Analysis on insulator–metal transition in yttrium doped LSMO from electron density distribution
  46. The analysis on the rearrangement of charge density distribution in response to magnetic behavior in Mn doped SnO2 nanoparticles
  47. Localized ferromagnetic charge ordering through charge density analysis in nano sized diluted magnetic semiconductor Co2+:ZnO
  48. Analysis on experimental valence charge density in germanium at RT and 200K
  49. Growth of novel-diluted magnetic semiconducting material Ge1−xMnx and X-ray characterization by the maximum entropy method (MEM) and pair distribution function (PDF)
  50. Electron density distribution in Si and Ge using multipole, maximum entropy method and pair distribution function analysis
  51. Electron density distribution and bonding in ZnSe and PbSe using maximum entropy method (MEM)
  52. Probabilistic electron density distribution in CdTe at RT and 200K
  53. Bonding in ZnTe at RT, 200 and 100K revealed by entropy maximized electron density distribution
  54. Bonding in fluorite compound CaF2 using MEM
  55. Electronic structure of InP at RT, 200 and 100K
  56. An investigation on the bonding in MgO, CaO, SrO and BaO from the MEM electron density distributions
  57. High resolution electron density mapping for LiF and NaF by maximum entropy method (MEM)
  58. Electronic charge distribution in the intermetallic compound MnHg
  59. X-ray structure of barium titanate – missed opportunities
  60. Charge transfer in GaP and InP
  61. Charge Transfer in ZnSe
  62. Debye‐Waller Factors in NaxC60
  63. f″ of silicon from linear absorption measurements