Provisional program:
September 26, 2021 (Morning Sessions)
- 08: 00 - 09: 00
Reception
- 09: 00 - 09: 30
Official Opening Ceremony: Inauguration By Rector of Blida University
TOPIC 01
TOPIC 02
TOPIC 03
- 09:30 - 10:00
Plenary 01: Professor Roberto Dovesi
- “The Superexchange mechanism in crystalline compounds. The case of KMF3 (M=Mn, Fe, Co, Ni) perovskites ”
- 10: 15 - 11: 00
Plenary 02: Professor Robert M. Hanson
- “Novel Visualization of Crystal Structure and Energetics”
- 11: 15 - 11: 45
Plenary 03: Professor Michel Rérat
- “Ab initio calculation of chirality in crystals”
- 12: 00 - 12: 30
Coffee Break
- 12: 15 - 12: 45
O 01:
- 13: 00 - 13: 15
O 02:
- 13: 30 - 14: 30
Lunch
September 26, 2021 (Afternoon Sessions)
TOPIC 01
TOPIC 02
TOPIC 03
- 14: 45 - 15: 15
Plenary 04: Professor Frédéric Labat
- “Continuum solvation for finite and infinite periodic systems in CRYSTAL”
- 15: 30 - 16: 00
Plenary 05: Professor Bennacer Badis
- “Lattice dynamics and thermal properties of materials”
- 16: 15 - 16: 30
Coffee Break
- 16: 30 - 18: 00
e-poster session
Closing the first day of the conference
September 27, 2021 (Morning Sessions)
TOPIC 01
TOPIC 02
TOPIC 03
- 09: 00 - 09: 30
Plenary 06: Professor Silvia Maria Casassa:
- “Crystal17: a modern tool for ab initio solid state chemistry & physics”
- 09: 45 - 10: 15
Plenary 07: Professor Andreas Savin
- “Looking at benchmarks for density functional calculations”
- 10:30 - 11:00
Plenary 08: Professor Maddalina D'Amore
- “Understanding structure and properties of MgCl2 supported Ziegler-Natta nanoclusters by DFT, spectroscopy and machine learning. How modeling uncovers the origin of industrial catalysis”
- 11: 15 - 11: 45
Coffee Break
- 12: 00 - 12: 15
O 03:
- 12: 30 - 12: 45
O 04:
- 13: 00 - 13: 15
O 05:
- 13: 30 - 14: 30
Lunch
September 27, 2021 (Afternoon Sessions)
TOPIC 03
- 14: 45 - 15: 15
Plenary 09: Professor Bouhafs Bachir
- “Magneticism and half-metallicity of solids from the spin polarization of p orbitals”
- 15: 30 - 16: 00
Plenary 10: Professor Baadji Nadjib
- “ENHANCED FIGURE OF MERIT IN MOLECULAR JUNCTIONS”
- 16: 10 - 16: 25
O 06:
- 16: 30 - 16: 25
O 07:
- 16: 50 - 17: 05
O 08:
- 17: 05 - 18: 30
e-poster session
Closing the Second day of the conference
September 28, 2021 (Morning Sessions)
TOPIC 04
- 09: 00 - 09: 30
Plenary 11: Professor Rudolf Shäfer
- “Intensity-based wide-field magneto-optical microscopy”
- 09: 45 - 10: 15
Plenary 12: Professor Jana K. Vejpravova
- “Boosting the performance of magnetic nanoparticles: magnetic field-assisted assembly and magnetic functionalization”
- 10: 30 - 11: 00
Plenary 13: Professor Martin Kalbac
- “Heterostructures Based on Functionalized Graphene and Free-standing Graphene Membranes”
- 11: 30 - 11: 45
O 09:
- 12: 00 - 12: 15
O 10:
- 12:30 - 12:45
O 11:
- 13: 00 - 13: 15
O 12:
Closing Ceremony
- 14: 00 - 15: 00