Invited talk: Workshop - Machine Learning at Interfaces, June
4 - 8, 2018, CECAM-HQ-EPFL, Lausanne, Switzerland - Machine Learning
for Materials Stability: Are we ML-predicted-Phase Diagram
ready?[Workshop
link]
Co-organizer: Workshop - Open Databases Integration for
Materials Design, June 11-15, 2018, CECAM-HQ-EPFL, Lausanne,
Switzerland - The high-throughput toolkit and the open materials
database: recent developments and the OPTiMaDe API.[Workshop
link]
Co-organizer: Workshop - Frontiers in Molecular Dynamics:
Machine Learning, Deep
Learning and Coarse Graining, October 10 - 15, 2018,
CECAM-ISR, Tel Aviv, Israel - Machine Learning for Materials
Stability: Are we ML-predicted-Phase Diagram ready?[Workshop
link]
Invited talk: Conference - Game of Materials, October 30 -
November 2, 2018, Dubrovnik, Croatia - Materials Design on Three
Fronts: Fundamental Theory, Automation, and Artificial
Intelligence[Conference link]
2017
Invited talk: Workshop - International Workshop on Machine
Learning for Materials Science, March 9, 2017, Aalto University,
Finland - Materials Design on Three Fronts: Fundamental Theory,
Automation, and Machine Learning.[Workshop
link]
Contributed talk: Application Expert Meeting, April 4 - 5, NSC,
Linköping University, Sweden - The Heffa Hadoop Cluster - and -
Machine Learning for Materials Design.
Talk: Meeting - SeRC sattelite meeting: Electronic Structure
Community, May 12, 2017, Sigtunahöjden, Sigtuna - Machine Learning
for DFT-quality formation energies + more.
Lecture: Public Trial Lecture for Appointment as Associate Professor
(Universitetslektor / Senior Lecturer), May 23, 2017, Linköping
University, Sweden - Computational Materials Design.
Invited talk: Conference - 17th International Conference
on Density-Functional Theory and its Applications (DFT2017),
Tällberg, Sweden, August 21 - 25 - Semi-Local Functionals with
Non-vanishing Asymptotic Potentials: Beyond the AK13[Conference
link]
Organizer: Minisymposium in connection to the dissertation of
Alexander Lindmaa: Theoretical Prediction of Properties of Atomistic
Systems: Methods and Applications, Linköping University,
Sweden, September 7 (half day).
2016
Invited talk: Workshop - Exploring Chemical Space with Machine
Learning and Quantum Mechanics, May 30 - June 3, 2016, CECAM-ETHZ,
Zurich, Switzerland - Exploring Data-Driven Methods for Materials
Design.
[Abstract]
Invited seminar: June 7, 2016 - Group Seminar THEOS-MARVEL, EPFL,
Lausanne, Switzerland - Materials Design on Three Fronts:
Fundamental Theory, Automation, and Artificial Intelligence[Seminar
link]
Invited talk: Conference - Platform for Advanced Scientific
Computing (PASC) 2016, June 8 - 10, Lausanne, Switzerland -
Designing New Materials with the High-Throughput Toolkit[Conference
link]
Invited seminar: Group seminar at Physikalische Chemie, Uni Basel,
October 5, 2016, Switzerland: Materials Design on Three Fronts:
Fundamental Theory, Automation, and Artificial Intelligence.
Invited talk: Workshop - Open Databases Integration for
Materials Design, October 24 - 28, Lorentz Center, Leiden,
Netherlands - The high-throughput toolkit (httk) and the open
materials database (omdb).
Invited seminar: Group seminar at Materiefysik, Royal Insitute of
Technology (KTH), November 23, 2016, Stockholm, Sweden - Materials
Design on Three Fronts: Fundamental Theory, Automation, and
Artificial Intelligence.
2015
Lecture: Docent Lecture in Theoretical Physics and Computational
Physics, April 20, 2015, Linköping University, Sweden - Designing
new materials with supercomputers: theory development and practical
application.
Invited talk: Workshop - From Many-Body Hamiltonians to Machine
Learning and Back, May 13, 2015, CECAM-DE-MM1P, Dahlem, Berlin,
Germany - Crystal Structure Representations For Machine Learning
Models of Formation Energies.[Confrence
link]
Contributed talk: Psi-k 2015 Conference, September 6 - 10, 2015,
Donostia-San Sebastian, Kursaal Congress Centre, Spain - The AK13
exchange functional and beyond.[Conference
link]
2014
Contributed poster: August 20-21, 2014, AFM2014 Conference on
Advanced Functional Materials, Vildmarkshotellet Kolmården,
Norrköping, Sweden - Poster: Challenges and Opportunities for
Energy Materials Design with High-Throughput Computational
Screening.
Contributed talk: March 21 - 25, 2011 - Conference - APS March
meeting, Dallas, Texas, USA - Talks: Quantum oscillations in the
kinetic energy density: Gradient corrections from the Airy gas
(given in place of Alexander Lindmaa)
[Abstract],
and High-Throughput Screening of Perovskite Alloys for Piezoelectric
Performance and
Formability[Abstract]
(Also credited on talks: Possible reasons for low open circuit
voltage in pyrite
(FeS2))
Talk: December 17, 2014 - Seminar - Theory and Modelling Christmas
Conference, Linköping University, Sweden - Talk: Designing New
Materials for Fun and Profit Using High-Throughput Computing.
2013
Invited seminar: Seminar - Bayreuth University, December 8 - 11,
Bayreuth, Germany - An Exchange Energy Functional with a Derivative
Discontinuity: Orbital Localization, Charge Transfer, and Band Gaps
in Semi-Local Density Functional Theory
Invited seminar: Seminar - Fritz-Haber-Institut, October 16 - 19,
Berlin, Germany - An Exchange Energy Functional with a Derivative
Discontinuity: Orbital Localization, Charge Transfer, and Band Gaps
in Semi-Local Density Functional Theory
Poster: Conference - DFT2013, September 9 - 13, Durham UK - An
Exchange Energy Functional with a Derivative Discontinuity: Orbital
Localization, Charge Transfer, and Band Gaps in Semi-Local Density
Functional Theory[Conference
link]
Invited seminar: Group Seminar, Helsinki University, August 21 - 23,
Finland - Talk: Talk: An Exchange Energy Functional with a
Derivative Discontinuity: Orbital Localization, Charge Transfer, and
Band Gaps in Semi-Local Density Functional Theory
Contributed poster: Conference - Nordic Physics Days, June 12 - 14,
Lund, Sweden - Poster: An Exchange Energy Functional with a
Derivative Discontinuity: Orbital Localization, Charge Transfer, and
Band Gaps in Semi-Local Density Functional Theory
Contributed talk : Conference - APS March meeting, March 18 -
22, 2013, Baltimore, MD, USA - An Exchange Energy Functional with a
Derivative Discontinuity: Orbital Localization, Charge Transfer, and
Band Gaps in Semi-Local Density Functional Theory.
2012
(Credited on talk: February 27 - March 2, 2012 - Conference - APS
March meeting, Boston, Massachusetts, USA - Interpolation schemes
for high-throughput prediction of new piezoelectric
alloys[Abstract])
Seminar: Linnaeus seminar organized by Linköping Linnaeus Initiative
for Novel Functional Materials, May 23, 2012, Linköping University,
Sweden - Saving the World With Computational Physics?: How
High-Throughput Energy Material Design with Improved DFT Functionals
can Help Address the Energy Crisis
Invited seminar - Department Seminar at Central Michigan University,
February 10, 2011, Michigan, USA - Saving the World with Density
Functional Theory.
Invited talk:International Conference of Computational Methods
in Sciences and Engineering, September 25 - 30, 2008, Hotel
Belvedere Imperial, Hersonissos, Crete, Greece - Calculating the
Response of Molecular Chains with Semi-Local Density Functional
Theory.[Conference
paper][Conference
link].
2007
Contributed poster: Minerva-Gentner Symposium on: Time-Dependent
Density-Functional Theory and Applications, December 16 -
21, 2007, Hilton Queen of Sheba, Eilat, Israel - Ultra
non-local response from a semi-local functional.[Conference
link]
Contributed poster: Conference - 16th Annual Workshop on Recent
Developments in Electronic Structure Methods, May 27 - 30, 2004,
Rutgers University, New Brunswick, NJ, USA - Recent developments of
subsystem functionals: Solving the subsystem functional puzzle.
2003
Contributed talk: Conference - APS March meeting, March 12 - 16,
2003, Austin, TX, USA - Talk: Subsystem functionals
in Density Functional Theory Towards a New Class of
Exchange-Correlation
Functionals[Abstract]
2002
Attended: Workshop -Sandia National Laboratories workshop on Quantum
Mechanical Techniques: Exchange-Correlation Functionals in Density
Functional Theory, August 15 - 16, 2002, Wyndham Hotel at the
International Sunport, Albuquerque, NM, USA. [Workshop
link].
Contributed talk: Conference - Atomics, Sweden: Subsystem
functionals, a viable way of extending DFT to even more complicated
systems.
2001
Contributed talk: Conference - APS March meeting, March 12 - 16,
2001, Seattle, WA - Investigation of the Inverse Radius of the
Exchange Hole (a Local Exchange Energy Density) for Two Simple
Systems."[Abstract].
Contributed talk: Conference International Conference on Applied
Density Functional Theory (DFT2001), January 14-17, 2001,
Vienna/Austria - Investigation of the Inverse Radius of the Exchange
Hole (a Local Exchange Energy Density) for Two Simple
Systems.[Conference
link]