Programs

The seminar will begin on Tuesday 17 Bahman (6 Feb 2018) at 3:00 PM and end in the evening of Thursday 19 Bahman (8 Feb 2018)
 
Our welcome session and the initial speech by the president of CCERCI will start at 12:30 Tuesday 17 Bahman (Feb 6 ) 2018
It's our honor that the following speakers have agreed to participate.
 
1
Dr. Ali Maghari

University of Tehran

 
Dr. Afshin Shafiee

Dr. Afshin Shafiee

Sharif University of Technology

 
3
Dr. Reza Omidyan

University of Isfahan

Dr. Shant Shahbazian

Dr. Shant Shahbazian

Shahid Beheshti University

Dr. Fariba Nazari

Dr. Fariba Nazari

Institute for Advance Studies in Basic Sciences Zanjan

 

6
Dr. Alireza Shayesteh

University of Tehran

 
Dr. S. Mohammad Azami

Dr. S. Mohammad Azami

Yasuj University

 

8
Dr. Kiamars Eskandari

Isfahan University of Technology

9
Dr. Mohammad Hossein Karimi-Jafari

University of Tehran

 
Dr. Ali Sadeghi

Dr. Ali Sadeghi

Shahid Beheshti University

 

11-2
Dr. Shahab Naghavi

Shahid Beheshti University

12
Dr. Ali Nasimi

Sharif University of Technology

13

Dr. Zahra Jamshidi
Chemistry and Chemical Engineering Research Center of Iran

14

Dr. Amin Reza Zolghadr
Shiraz University

 

Tuesday 17 Bahman 1396

12:30 – 14:30

Registration

14:30 – 15:00

Opening

15:00 – 15:45

Dr. Maghari

Quantum Scattering Theory for Confined Particles via Complex Absorbing Potential Fields

15:45 – 16:30

Dr. Shafiee

A Review of Some Fundamental Questions in Science

16:30 – 17:00

Coffee Break

17:00 – 17:45

Dr. Nazari

Prediction of Many-Electron Wavefunctions Using Atomic Potentials

17:45 – 19:00

Poster Session 1

19:00 – 20:00

Dinner Break

Wednesday 18 Bahman 1396

9:00 – 9:45

Dr. Azami

Natural Orbitals for Chemical Valence

9:45 – 10:30

Dr. Shahbazian

Why bond critical points are not "bond"critical points?

10:30 – 11:00

Coffee Break

11:00 – 11:45

Dr. Jamshidi

A Theoretical Challenge in Structure Determination of Metal Cluster

11:45 – 12:30

Dr. Zolghadr

Metadynamics and Its Applications in Statistical Mechanics and Reaction Dynamics 

12:30 – 14:00

Lunch Break

14:00 – 14:45

Dr. Karimi-Jafari

The Curious Case of Protein-Ligand Interaction: Does Machine Learning Outperform Physical Chemistry?

14:45 – 15:30

Dr. Nasimi

Revisiting Slater Integrals

15:30 – 16:00

Coffee Break

16:00 – 16:45

Dr. Shayesteh

Excited Electronic States of Diatomic Molecules

16:45 – 17:30

Dr. Omidyan

Electronically Excited States of Neutral and Protonated Aromatic Systems: The Role of Conical Intersections

17:30 – 18:30

Poster Session 2

Thursday 19 Bahman 1396

9:00 – 9:45

Dr. Naghavi

Giant Onsite Electronic Entropy Enhances the Performance of Ceria for Water Splitting

9:45 – 10:30

Dr. Eskandari

Noncovalent Interactions; One model, One bond

10:30 – 11:00

Coffee Break

11:00 – 11:45

Dr. Sadeghi

Imaging Noncovalent Bonds; Over Interpretation Criticized by Simulations

11:45 – 12:10

 

Dr. Goli

Revisiting the “Peculiar” Extremes of Muonium Chemistry via Multicomponent Density Functional Theory

12:10 – 12:35

Dr. Motalebipour

Rovibrational perturbations in linear triatomic molecules: ZnH2 and BeH2

12:35– 14:05

Launch Break

14:05 – 14:30

Dr. Tirandaz

Quantum Effects in Biology: Dissipative Quantum Model of the Sense of Smell

14:30 – 14:55 Dr. Ashouri From simple to complex systems: Different challenges for practical consideration of non-covalent interactions
14:55– 15:20 Mr. Rasti Modelling phase diagrams of crystalline ice structures: a comparison of force fields and density functional theory
15:20– 16:30

Coffee Break - Closing