Main Subjects = Quantum Chemistry
Number of Articles: 13
1. Cooperative and Diminutive Interplay between Halogen, Hydride and Cation-σ Interactions

Volume 4, Issue 4, Autumn 2016, Pages 583-589

Mohammad Solimannejad; Seyyedeh Marziyeh Hosseini; Abedin Zebardasti

Cooperative and Diminutive Interplay between Halogen, Hydride and Cation-σ Interactions


3. Microsolvation of NO2+ in Helium: An Ab Initio Study on NO2+-Hen Clusters (n ≤ 7)

Volume 4, Issue 1, Winter 2016, Pages 109-117

Mohammad Solimannejad; Fatemeh Mohammadian; Mehdi D Esrafili

Microsolvation of NO2+ in Helium: An Ab Initio Study on NO2+-Hen Clusters (n ≤ 7)


5. Thermodynamic properties of polarized liquid 3He along different isentropic paths

Volume 2, Issue 2, Autumn 2014, Pages 217-228

Gholam Hossein Bordbar; S. Hosseini

Thermodynamic properties of polarized liquid 3He along different isentropic paths


7. Materials Based on Carbazole for Organic Solar Cells Applications. Theoretical Investigations

Volume 2, Issue 2, Autumn 2014, Pages 244-251

Mohammed Bouachrine; Fatima AGDA; Mostapha TALEB; Tayeb ABRAM

Materials Based on Carbazole for Organic Solar Cells Applications. Theoretical Investigations


8. Calculation of Thermodynamic Properties of the Quasi-one Dimensional Liquid 3He at Finite Temperature

Volume 2, Issue 2, Autumn 2014, Pages 252-259

Gholam Hossein Bordbar; M. A. Rastkhadiv

Calculation of Thermodynamic Properties of the Quasi-one Dimensional Liquid 3He at Finite Temperature


9. Conformational analysis of N- and C-terminally protected tripeptide model glycyl-isoleucine-glycyl: An ab initio and DFT study

Volume 2, Issue 1, Spring 2014, Pages 68-75

Behzad Chahkandi; Mohammad Chahkandi; Bentolhoda Ashrafi

Conformational analysis of N- and C-terminally protected tripeptide model glycyl-isoleucine-glycyl: An ab initio and DFT study


10. The DFT chemical investigations of optoelectronic and photovoltaic properties of short-chain conjugated molecules

Volume 2, Issue 1, Spring 2014, Pages 11-20

Mohammed Bouachrine; Najat Belghiti; Mohammed Nassiri Bennani; Simohamed Bouzzine; Mohamed Hamidi

The DFT chemical investigations of optoelectronic and photovoltaic properties of short-chain conjugated molecules


12. Thermodynamic properties of the ionized gas 3He

Volume 2, Issue 1, Spring 2014, Pages 90-95

Gholam Hossein Bordbar; N. Mashayekhizadeh

Thermodynamic properties of the ionized gas 3He