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physical chemistry research
  
سال:2016 - دوره:4 - شماره:4
  
 
A Computational Study on the Stability of Dapdiamide D Conformers
- صفحه:567-581
  
 
A Theoretical Study of Nonlinear Optical Features of Alumina Nanostructures with the Groups III and VI Dopants
- صفحه:627-641
  
 
Adsorption of F-, Cl-, Li+ and Na+ on the Exterior Surface of Mg_12O_12 Nanocage in the Gas Phase and Water Media: A DFT Study
- صفحه:591-605
  
 
Computational Study on Reduction Potential of [CoP_4N-2(OH_2)_2]^2+ as a Super- Efficient Catalyst in Electrochemical Hydrogen Evolution
- صفحه:531-538
  
 
Cooperative and Diminutive Interplay between Halogen, Hydride and Cation-σ Interactions
- صفحه:583-589
  
 
DFT Study of Nitrous Oxide Adsorption on the Surface of Pt-Decorated Graphene
- صفحه:619-626
  
 
Electron Ionization of Serine and Threonine: a Discussion about Peak Intensities
- صفحه:539-551
  
 
Functionalization of the Single-walled Carbon Nanotubes by Sulfur Dioxide and Electric Field Effect, a Theoretical Study on the Mechanism
- صفحه:553-565
  
 
HNO Detection by Nanosized B_12N_12 Cage: A DFT/TDDFT Study
- صفحه:693-706
  
 
Measurement of Volumetric and Viscometric Properties of Binary Mixtures of Methyl Tert-butyl Ether (MTBE) + 1-Alcohol from 293.15 to 308.15 K and at Atmospheric Pressure
- صفحه:673-691
  
 
PVP-Assisted Synthesis of Cobalt Ferrite (CoFe_2O_4) Nanorods
- صفحه:655-662
  
 
QM/MM Study on the Mechanism of Aminophenol Oxidation by Functionalized β-Cyclodextrin as Oxidase Nanomimic
- صفحه:519-530
  
 
Ternary Phase Diagram Modeling of Chiral Medetomidine Salts Using NRTL-SAC Model
- صفحه:663-671
  
 
Theoretical Study on Glycosyl Group Effect on Antioxidant Ability of Chrysin Bioflavonoid
- صفحه:643-654
  
 
Understanding Hydrogen Adsorption in MIL-47-M (M = V and Fe) through Density Functional Theory
- صفحه:607-617
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