Understanding Many-Particle Systems with Machine Learning Tutorials - IPAM

Understanding Many-Particle Systems with Machine Learning Tutorials

Part of the Long Program Understanding Many-Particle Systems with Machine Learning
September 13 - 16, 2016

Schedule

All times in this Schedule are Pacific Time (PT)

Tuesday, September 13, 2016

Morning Session

08:00-09:00
Check-In/Light Breakfast (Hosted by IPAM)
09:00-10:15
Klaus-Robert Müller (Technische Universität Berlin)
Supervised Machine Learning
10:25-10:45
Break
10:45-12:00
Alexandre Tkatchenko (University of Luxembourg)
Electronic Structure theory 1

Afternoon Session

12:00-12:30
Core Orientation with IPAM Staff
12:30-14:00
Lunch (on your own)
14:00-14:45
Marina Meila (University of Waterloo)
Unsupervised ML 1
14:55-15:15
Break
15:15-16:00
Matthew Hirn (Michigan State University)
Wavelets 1
16:10-16:30
Break
16:30-17:15
Kieron Burke (University of California, Irvine (UCI))
DFT 1

Wednesday, September 14, 2016

Morning Session

08:00-09:00
Continental Breakfast
09:00-09:45
Alexandre Tkatchenko (University of Luxembourg)
Electronic Structure theory 2
09:55-10:15
Break
10:15-11:00
Eric Cances (École Nationale des Ponts-et-Chaussées)
Mathematical representations of quantum states 1
11:10-11:30
Break
11:30-12:15
Glenn Martyna (IBM Watson Research Center)
Stat Mech 1

Afternoon Session

12:30-14:00
Lunch (on your own)
14:00-14:45
Marina Meila (University of Waterloo)
Unsupervised ML 2
14:55-15:15
Break
15:15-16:00
Matthew Hirn (Michigan State University)
Wavelets 2
16:10-16:30
Break
16:30-17:15
Kieron Burke (University of California, Irvine (UCI))
DFT 2

Thursday, September 15, 2016

Morning Session

08:00-09:00
Continental Breakfast
09:00-09:45
Susan Sinnott (Pennsylvania State University)
Developing and Fitting Reactive Empirical Potentials to Enable Atomic-Scale Simulations
09:55-10:15
Break
10:15-11:00
Glenn Martyna (IBM Watson Research Center)
Stat Mech 2
11:10-11:30
Break
11:30-12:15
Eric Cances (École Nationale des Ponts-et-Chaussées)
Mathematical representations of quantum states 2

Afternoon Session

12:30-14:00
Lunch (on your own)
14:00-15:15
Alexander Shapeev (Skolkovo Institute of Science and Technology)
Coarse graining
15:25-15:45
Break
15:45-17:00
Gabor Csányi (University of Cambridge)
Gaussian Processes

Friday, September 16, 2016

Morning Session

08:00-09:00
Continental Breakfast
09:00-09:45
Susan Sinnott (Pennsylvania State University)
Material Surfaces, Grain Boundaries and Interfaces: Structure-Property Relationship Predictions
09:55-10:15
Break
10:15-11:00
Risi Kondor (University of Chicago & Flatiron Institute)
Representation theory, Fourier analysis, and invariants 1
11:00-11:15
Break
11:15-12:00
Risi Kondor (University of Chicago & Flatiron Institute)
Representation theory, Fourier analysis, and invariants 2

Afternoon Session

12:30-14:00
Lunch (on your own)
14:00-15:15
Matthias Rupp (Fritz-Haber-Institut der Max-Planck-Gesellschaft)
Practical Tutorial on Machine Learning for Electronic Structure Calculations
Printable Version