All Stories

  1. Conjugate addition between syringol and a captodative olefin catalyzed by BF3
  2. Influence of film thickness on the stability of free-standing Lennard-Jones fluid films
  3. Reactivity of Atomically Functionalized C-Doped Boron Nitride Nanoribbons and Their Interaction with Organosulfur Compounds
  4. Reducing uncertainty in simulation estimates of the surface tension through a two-scale finite-size analysis: thicker is better
  5. Interfacial properties of the ionic liquid [bmim][triflate] over a wide range of temperatures
  6. Desalination by dragging water using a low-energy nano-mechanical device of porous graphene
  7. The Intramolecular Pressure and the Extension of the Critical Point’s Influence Zone on the Order Parameter
  8. Interaction of Refractory Dibenzothiophenes and Polymerizable Structures
  9. Reactivity of Alkyldibenzothiophenes Using Theoretical Descriptors
  10. Frictional Properties of Mixed Fluorocarbon/Hydrocarbon Silane Monolayers: A Simulation Study
  11. Examining the frictional forces between mixed hydrophobic – hydrophilic alkylsilane monolayers
  12. Aged Natural and Synthetic Maya Blue-Like Pigments: What Difference Does It Make?
  13. Clean-up of wastes from the textile industry using anionic clays
  14. Tribological Durability of Silane Monolayers on Silicon
  15. Tuning the electronic properties of armchair carbon nanoribbons by a selective boron doping
  16. Rapid Transport of Water via a Carbon Nanotube Syringe
  17. The influence of phase and morphology of molybdenum nitrides on ammonia synthesis activity and reduction characteristics
  18. Evaluation of the chemical reactivity in lignin precursors using the Fukui function
  19. Interaction of Water with Cap-Ended Defective and Nondefective Small Carbon Nanotubes
  20. Polarizable contributions to the surface tension of liquid water
  21. Surface chemistry of tribochemical reactions explored in ultrahigh vacuum conditions
  22. Molecular Modeling of Thiophene in the Vapor–Liquid Equilibrium
  23. The oscillatory damped behaviour of incommensurate double-walled carbon nanotubes
  24. Oscillatory Behavior of Double-Walled Nanotubes under Extension:  A Simple Nanoscale Damped Spring
  25. Molecular simulations of liquid-liquid interfacial properties: Water–n-alkane and water-methanol–n-alkane systems
  26. Layering Behavior and Axial Phase Equilibria of Pure Water and Water + Carbon Dioxide Inside Single Wall Carbon Nanotubes
  27. Vapor–liquid equilibrium simulations of nitrogen and n-alkane binary mixtures
  28. Vapor–liquid equilibrium simulations of the SCPDP model of water
  29. Transport properties of nitrogen and n-alkane binary mixtures
  30. Force Field of Monoethanolamine
  31. Thermodynamic and transport properties of nitrogen and butane mixtures