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16 Nov 2015
17 Nov 2015
18 Nov 2015
19 Nov 2015
20 Nov 2015
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Exercise I: Getting started: struct file,...
Exercise I: The first steps with Turbomole:...
Exercise II: Further steps in Turbomole:...
Exercise II: Volume and structure optimization
Exercise III: Testing accuracy: RKmax and k-points
Exercise III: Transition metal compounds
Exercise IV: Intermolecular interactions
Exercise IV: Testing exchange potentials
Exercise V: Magnetism
Exercise V: Selected spectroscopies (NMR,...
Exercise VI: Hybrid-DFT
Exercise VI: Hybrid-DFT
Exercise VII: Core level spectroscopy (XSPEC)
Exercise VII: Core level spectroscopy (XSPEC)...
Introduction into Linux and computer cluster usage
Lecture I: Exploring Potential Energy Surface
Lecture II: Hartree-Fock method and beyond
Lecture III: Chemically biased introduction to...
Lecture IV: Introduction to Turbomole package
Registration
Registration
Turbomole: Introduction into Linux and...
WIEN2k Lecture I: Introduction to Density...
WIEN2k Lecture II: Introduction to WIEN2k package
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WIEN2k & Turbomole Workshop
from
Monday, 16 November 2015 (09:00)
to
Friday, 20 November 2015 (19:00)
Monday, 16 November 2015
09:00
09:00 - 10:00
Room: Auditorium Foyer
10:00
10:00 - 11:00
Room: Marie Curie
11:00
Coffee break
Coffee break
11:00 - 11:15
Room: Ground floor
11:15
11:15 - 13:00
Room: Marie Curie and Tesla rooms
13:00
Lunch
Lunch
13:00 - 14:00
Room: Cafeteria
14:00
14:00 - 16:00
Room: Marie Curie and Tesla rooms
16:00
Coffee break
Coffee break
16:00 - 16:30
Room: Ground floor
16:30
16:30 - 18:00
Room: Marie Curie and Tesla rooms
Tuesday, 17 November 2015
09:30
09:30 - 11:00
Room: Marie Curie and Tesla rooms
11:00
Coffee break
Coffee break
11:00 - 11:30
Room: Ground floor
11:30
11:30 - 13:00
Room: Marie Curie and Tesla rooms
13:00
Lunch
Lunch
13:00 - 14:00
Room: Cafeteria
14:00
14:00 - 16:00
Room: Marie Curie and Tesla rooms
16:00
Coffee break
Coffee break
16:00 - 16:30
Room: Ground floor
16:30
16:30 - 18:00
Room: Marie Curie and Tesla rooms
Wednesday, 18 November 2015
09:30
09:30 - 11:00
Room: Marie Curie and Tesla rooms
11:00
Coffee break
Coffee break
11:00 - 11:30
Room: Ground floor
11:30
11:30 - 13:00
Room: Marie Curie and Tesla rooms
13:00
Lunch
Lunch
13:00 - 14:00
Room: Cafeteria
14:00
14:00 - 16:00
Room: Marie Curie and Tesla rooms
16:00
Coffee break
Coffee break
16:00 - 16:30
Room: Ground floor
16:30
16:30 - 18:00
Room: Marie Curie and Tesla rooms
Thursday, 19 November 2015
09:00
09:00 - 10:00
Room: Auditorium Foyer
10:00
10:00 - 11:00
Room: Marie Curie and Tesla rooms
11:00
Coffee break
Coffee break
11:00 - 11:15
Room: Ground floor
11:15
11:15 - 12:10
Room: Marie Curie and Tesla rooms
12:10
12:10 - 13:00
Room: Marie Curie and Tesla rooms
13:00
Lunch
Lunch
13:00 - 14:00
Room: Cafeteria
14:00
14:00 - 15:00
Room: Marie Curie and Tesla rooms
15:00
15:00 - 16:00
Room: Marie Curie and Tesla rooms
16:00
Coffee break
Coffee break
16:00 - 16:30
Room: Ground floor
16:30
16:30 - 18:00
Room: Marie Curie and Tesla rooms
Friday, 20 November 2015
09:30
09:30 - 11:00
Room: Marie Curie and Tesla rooms
11:00
Coffee break
Coffee break
11:00 - 11:30
11:30
11:30 - 13:00
Room: Marie Curie and Tesla rooms
13:00
Lunch
Lunch
13:00 - 14:00
Room: Cafeteria
14:00
14:00 - 16:00
Room: Marie Curie and Tesla rooms
16:00
Coffee break
Coffee break
16:00 - 16:30
Room: 1st floor
16:30
16:30 - 18:00
Room: Marie Curie and Tesla rooms
