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TUESDAY, JULY 5th
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9.00-9.20
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A. Franciosi
Welcome and introduction
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9.20-10.00
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S. Baroni
Ab-initio computer modeling of materials @ DEMOCRITOS - What we can do and what we will learn to do
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10.00-10.30
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G. Rossi
Nanomagnetism
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10.30-11.00
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--- Break ---
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11.00-11.40
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M. Kiskinova
Surface reactivity and self-organization processes probed at micro and nano-scales
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11.40-12.20
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G. Senatore
Low dimensional electron gases in solid state devices
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12.20-12.50
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A. Morgante
Thin-organic films: geometrical and electronic structures
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12.50-14.00
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--- Lunch ---
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14.00-14.40
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M. Altarelli
Electronic structure calculations for the interpretation of synchrotron light experiments
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14.40-15.20
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A. Goldoni
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15.20-16.00
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P. Carloni
The computational biophysics activity @ DEMOCRITOS
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16.00-16.30
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--- Break ---
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16.30-17.00
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A. Franciosi
Low dimensional structures
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17.00-17.40
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A. Kivimaki
Atomic and molecular physics at the Elettra: experiments and needs for theory
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17.40-18.20
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R. Gebauer
Electrons in nanostructures out of equilibrium: some applications of TDDFT
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WEDNESDAY, JULY 6th - morning
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Magnetism
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9.00-9.15
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D. Alfe`
Non-collinear magnetic arrangment of Mn on the Fe(001) surface
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9.15-9.30
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C. Carbone
Low-dimensional structures and nanosystems: spectroscopic studies on electronic and magnetic properties
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Surface physics and catalysis
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9.30-9.50
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A. Baraldi and S. de Gironcoli
Surface Core Level Shift as a probe of local environment: experiments and theory
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9.50-10.10
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F. Esch and S. Fabris
Oxygen vacancy clusters on a ceria substrate: Electron localization controls their shape
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10.10-10.25
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R. di Monte and J. Kaspar
CO oxidation over CuOx-CeO2-ZrO2 catalysts: Transient behavior and role of copper clusters in contact with ceria
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10.30-11.00
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--- Break ---
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11.00-11.15
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C. Africh
Insigth into reaction mechanisms based on the interplay theory - STM time series
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11.15-11.30
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M. Rocca
Monitoring supersurface and subsurface oxygen Ag(210): subsurface diffusion, segregation, oxide nucleation and carbonate formation
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11.30-11.45
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G. Fratesi
Low temperature methanol synthesis on transition metal surface
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11.45-12.00
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E. Vesselli
Modeling of real hydrogenation reactions
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12.00-12.15
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N. Binggeli
One-dimensional Fe surface states confined by self-assembled carbon chains at the Fe(001) surface
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Semiconductor physics
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12.15-12.35
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S. Modesti and M. Peressi
Images and electronic structure of nanostructures in semiconductors and quasi 2D metals
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12.35-12.50
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G. Profeta
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13.00-14.00
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--- Lunch ---
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WEDNESDAY, JULY 6th - afternoon
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Organic chemistry
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14.00-14.15
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S. Turchini
Circular dicroism in the photoionization of proteins in the gas phase
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14.15-14.30
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S. Scandolo
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14.30-14.45
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M. Pedio
Experimental studies of the anchoring of large molecules on surfaces
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14.45-15.00
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J. Tobik
Vibrational effects of electron doping in metal phtalocianines
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Other electronic structure: photoemission, superconductivity, …
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15.00-15.20
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P. Decleva and M. de Simone
- Excitation and photoemission spectra in finite systems
- HR-XAS studies of metals in vapour phase: the titanium case
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15.20-15.35
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S. Nannarone
Photon-in/photon-out experiments
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15.35-15.50
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P. Paci
Superconductivity and zero-temperature phase transitions in strongly correlated electron systems
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15.50-16.05
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S. Yunoki
Low-lying excitations of a strongly correlated superconducting state: a variational Monte Carlo study
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16.05-16.20
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G. Scoles
Concluding remarks
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