Journal of Physical & Theoretical Chemistry - Articles List

Volume & Issue: Volume 14, Issue 3, October 2017, Pages 187-293

Electronic Structure, Biological Activity, Natural Bonding Orbital (NBO) and Non-Linear Optical Properties (NLO) of Poly-Functions Thiazolo [3,2-a]Pyridine Derivatives. DFT Approach

Pages 187-209

Shimaa Hussien; hussien moustafa

DFT study of the intermolecular interaction of 3,4-dinitropyrazole (DNP) and H2O

Pages 229-236

Morteza Rouhani

A computational study of Nitramide adsorption on the surface of pristine and Ni functionalized (4,4) armchair Gallium nitride nanotubes

Pages 211-228

Mahdi Rezaei Sameti

Enhanced removal of Bismark Brown(BB) dye from aqueous solutions using activated carbon from raw Ziziphusspina-christi (ZSAC) Equilibrium, thermodynamic and kinetics

Pages 237-249

gholamhossein vatankhah; hossein koohmareh

Computational study of energetic, stability, and nuclear magnetic resonance of BN nanotube as a nanosensor

Pages 251-258

Elham Pournamdari

Enhanced removal of humic acids (HAs) from aqueous solutions using MWCNTs modified by N-(3-nitro-benzylidene)-N-trimethoxysilylpropyl-ethane-1,2-diamine on Equilibrium, thermodynamic and kinetics

Pages 259-270

nima karachi

Novel Quaternary ammonium modified-tragacanth gum hydrogels for drug delivery applications with antimicrobial activity and release kinetic study

Pages 271-282

Javid Monjezi; Rezvan Jamaledin; Mousa Ghaemy; Pooyan Majvandi

Reactivity and aromaticity of hexasiline derivatives Si6XH5 (X = H, F, Cl, Br, COOH, NO2, NH2, CH3 and tBu)

Pages 283-293

Mehdi Nabati

Journal of Physical & Theoretical Chemistry

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