Journal of Physical & Theoretical Chemistry - Articles List

1. Excited-State Parameters of One Intramolecular Cyclization by TD-DFT, CIS and ZINDO Methods

Pages 53-60

M. H. Ghorbani; R. Fazaeli; A. Ghoorchian

2. The Effect of Hydrogen Bonding and π–π Stacking to Stabilization of 3D Networks of a New Proton Compound, (a-6-mpyH)(Hpyzd) H2O

Pages 61-66

R. Mohammadinasab; M. Tabatabaee; M. A. Seyed Sadjadi

3. Experimental modeling of the adsorption kinetics of Cd (II) and Pb (II) ions by Calix [4] arene surface

Pages 67-76

O. Moradi; K. Zare; A. R. Zekri; A. Fakhri

4. Density Functional Theory Study of B6C4Si Cluster as a Novel Drug Carrier

Pages 77-85

P. Ardalan; H. Aghaie; M. Monajjemi; T. Ardalan

5. Evaluation of Physical Properties of B16N16 and B16N16-X(X=Cu, Cu+, Cu++)

Pages 87-95

M. SeyedHosseini; M. Monajjemi; K . Zare

6. Application of Electroactive Nano Composite Coated onto Wood Sawdust for the Removal of Malachite Green Dye from Textile Wastewaters

Pages 95-102

M. H. Fekri; M. Banimahd keivani; M. Darvishpour; H. Banimahd keivani

7. DFT Study and Comparison between B6C4Si and C16 Clusters as a Vitamin C Carrier

Pages 103-116

T. Ardalan; M. Monajjemi; H. Aghaie; P. Ardalan

8. Electronic Properties of Hydrogen Adsorption on the Silicon- Substituted C20 Fullerenes: A Density Functional Theory Calculations

Pages 117-123

F. R. Nikmaram; Jamshid Najafpour

9. Modeling of the adsorption kinetics of Basic Red 46 on single-walled carbon nanotube and carboxylate group functionalized single-walled carbon nanotube

Pages 125-133

D. Robati; A. Fakhri

Journal of Physical & Theoretical Chemistry

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