Lectures

← Previous
1
2
3
4
5
6
7
8
9
10
Next →

Prof. Emily A. Carter

Quantum Simulations of Sustainable Energy Materials

Watch More... Event Page Details

MARVEL NCCR
June 17, 2019
Watched 766 times.
Public Published
Stefano Baroni

Density-functional perturbation theory: forces, response functions, phonons, and all that (Part 1)

Watch More... Event Page Details

MARVEL NCCR
July 22, 2009
Watched 1002 times.
Public Published
Nicola Colonna

Notable failure of approximate DFT and possible remedies. Hybrids, vdW, ACFDT.

Watch More... Event Page Details

MARVEL NCCR
January 17, 2017
Watched 490 times.
Public Published
Prof. Steven G. Louie

The Fascinating Quantum World of Two-dimensional Materials: Interaction and Topological Effects

Watch More... Event Page Details

MARVEL NCCR
July 21, 2017
Watched 789 times.
Public Published
Marco Fornari

Structuring intuition with theory: The high-throughput way

Watch More... Event Page Details

MARVEL NCCR
May 31, 2017
Watched 603 times.
Public Published
Chris Pickard

Random search as high throughput computation

Watch More... Event Page Details

MARVEL NCCR
May 30, 2017
Watched 644 times.
Public Published
Stefano Sanvito

High-throughput electronic structure theory: do we need to calculate always everything?

Watch More... Event Page Details

MARVEL NCCR
May 30, 2017
Watched 569 times.
Public Published
Thomas Bligaard

Accelerating high-throughput simulations using machine learning methods

Watch More... Event Page Details

MARVEL NCCR
May 29, 2017
Watched 678 times.
Public Published
Prof. Annabella Selloni

Photocatalysis on TiO2: insights from simulations

Watch More... Event Page Details

MARVEL NCCR
May 16, 2017
Watched 721 times.
Public Published
Stefano Baroni

DFT fundamentals: from theory to practice.

Hohenberg-Kohn-Sham theory; variational principle; Hellman-Feynman theorem and energy derivatives

Watch More... Event Page Details

MARVEL NCCR
January 16, 2017
Watched 3281 times.
Public Published
Oliviero Andreussi

Solvent and Environment Effects: Continuum Models

Watch More... Event Page Details

MARVEL NCCR
January 24, 2017
Watched 1887 times.
Public Published
Andrea Ferretti

Spectroscopies: Many-Body Perturbation Theory

Watch More... Event Page Details

MARVEL NCCR
January 23, 2017
Watched 748 times.
Public Published
Ralph Gebauer

Spectroscopies: Time-Dependent DFPT

Watch More... Event Page Details

MARVEL NCCR
January 23, 2017
Watched 897 times.
Public Published
Michele Ceriotti

Advanced Molecular Dynamics.

Thermostats, Barostats and Nuclear Quantum Effects

Watch More... Event Page Details

MARVEL NCCR
January 23, 2017
Watched 768 times.
Public Published
Giovanni Pizzi

Introduction to AiiDA, the ADES model and the concept of provenance

Watch More... Event Page Details

MARVEL NCCR
January 24, 2017
Watched 684 times.
Public Published
Carlo Cavazzoni

Evolution of Present and Future HPC Architectures

Watch More... Event Page Details

MARVEL NCCR
January 27, 2017
Watched 623 times.
Public Published
Andrea Marini

Many-Body Perturbation Theory Using the Yambo code

Watch More... Event Page Details

MARVEL NCCR
January 23, 2017
Watched 798 times.
Public Published
Stefano De Gironcoli, Paolo Giannozzi

Levels & Hierrachy of Parallelism in QE

Watch More... Event Page Details

MARVEL NCCR
January 26, 2017
Watched 665 times.
Public Published
Lorenzo Paulatto

Vibrational & Magnetic Spectroscopies in QE

IR and RAMAN

Watch More... Event Page Details

MARVEL NCCR
January 20, 2017
Watched 895 times.
Public Published
Carlo Cavazzoni

Evolution of Parallel Programming Paradigms for Exascale Computing Platforms

Watch More... Event Page Details

MARVEL NCCR
January 27, 2017
Watched 658 times.
Public Published