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Monday 26 Sep 2005
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9:00
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P.Giannozzi
Introduction to the QUANTUM-ESPRESSO package
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10:30
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--- Break ---
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11:00
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P. Giannozzi
QUANTUM-ESPRESSO installation
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12:30
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--- Lunch ---
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14:00
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S. de Gironcoli
Input-output description
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15:30
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--- Break ---
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16:00
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G. Fratesi
Graphical User Interface (GUI)
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Tuesday 27 Sep 2005
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9:00
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P. Giannozzi
Pseudopotentials
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10:30
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--- Break ---
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11:00
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S. de Gironcoli
PWSCF - Simple examples
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12:30
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--- Lunch ---
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14:00
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G. Fratesi
XcryDens
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15:30
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--- Break ---
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16:00
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G. Fratesi
Post-processing and data analysis
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Wednesday 28 Sep 2005
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9:00
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C. Sbraccia
Structural Optimization
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10:30
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--- Break ---
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11:00
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A. Satta
Practical Exercises
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12:30
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--- Lunch ---
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14:00
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C. Cavazzoni
Introduction to the ab-initio MD
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15:30
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--- Break ---
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16:00
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C. Cavazzoni
Implementation of ab-initio MD in FPMD
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Thursday 29 Sep 2005
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9:00
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C. Cavazzoni
Ab-initio MD: examples
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10:30
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--- Break ---
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11:00
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C. Cavazzoni
Ab-initio MD: examples
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12:30
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--- Lunch ---
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14:00
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C. Sbraccia
NEB: kinetics of rare events
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15:30
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--- Break ---
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16:00
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R. Gebauer
Magnetic materials
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Friday 30 Sep 2005
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9:00
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A. Dal Corso
Phonons
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10:30
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--- Break ---
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11:00
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P. Giannozzi
Infrared spectra and electron-phonon coupling
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12:30
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--- Lunch ---
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14:00
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A. Dal Corso
Ab-initio ballistic conductance (Theory)
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15:30
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--- Break ---
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16:00
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A. Dal Corso
Complex band structures and ballistic conductance (Application)
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