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start [2025/07/22 18:22] tsauestart [2025/10/16 17:29] (current) tsaue
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 This project (HAMP-vQED) has received funding from the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation programme (grant agreement No 101019907) [01/10/2021-30/09/2026]//  This project (HAMP-vQED) has received funding from the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation programme (grant agreement No 101019907) [01/10/2021-30/09/2026]// 
  
 +//* Oct 16 2025:// Ryan gave a lecture entitled //Vacuum polarization in a Gaussian finite basis// at the THEO group meeting.
 +{{ ::ryan_theo2025.jpg?direct&600 |}}
 +
 +//* Oct 7 - 8 2025:// Jan was invited to the NVIDIA Atomistic Simulation Summit 2025 in Santa Clara, California and contributed a poster entitled //Multi-node multi-GPU tensor contractions in higher-order coupled cluster//.
 +{{ ::jan_nvidia1.jpeg?direct&600 |}}{{ ::jan_nvidia2.jpeg?direct&600 |}}
 +
 +//* Sep 29 - Oct 3 2025:// Trond has been co-organizing, with [[https://www.kth.se/profile/panor|Patrick Norman]] and [[https://en.uit.no/ansatte/person?p_document_id=41020|Kenneth Ruud]], the [[https://bit.ly/mrpss-2025|Molecular Response Properties Summer School (MRPSS 2025)]] at [[https://nordita.org/|Nordita]] in Stockholm.
 +{{ ::mrpss25offphoto.jpg?direct&600 |}}
 +
 +//* Sep 17 2025:// The first day of the [[https://tensor.sciencesconf.org/|second Toulouse tensor workshop]] was a clear success.
 +{{ ::tensor2025a.jpg?direct&600 |}} 
 +We have about 35 participants covering tensor library users and developers as well as industry.
 +{{ ::tensor2025c.jpg?direct&600 |}}
 +Breakout sessions
 +{{ ::tensor2025d.jpg?direct&600 |}}
 +Panel discussions
 +
 +* //Sep 16 2025// The HAMP group will host [[https://en.uit.no/ansatte/person?p_document_id=792319|Quntin Pitteloud]], PhD-student from The Arctic University of Norway (Tromsø) until Dec 19. Quentin works on relativistic quantum chemical calculations using multiwavelets.
 +{{ ::quentin_arrival.jpg?direct&600 |}}
 +
 +* //Sep 4 2025//  //"...zum Raum wird hier die Zeit"//. Trond is teaching relativistic quantum chemistry at the [[https://mwm.dcci.unipi.it/|MWM summer school]] in Pisa, here with one of the organizers, Jürgen Gauss. 
 +{{ ::mwm2025rel.jpg?direct&600 |}}
 +
 +* //Aug 20 2025// Trond gave a plenary lecture entitled //Towards Highly Accurate Calculations of Molecular Properties// at the ACS Fall 2025 Global Virtual Symposium [[https://www.acs.org/events/fall/presenters/global-virtual-symposia/theoretical-methods-algorithms-applications.html|Development of Theoretical Methods, Algorithms and Applications to Relevant Chemical Problems]]
 +
 +*//July 22 2025// New publication: Trond Saue, //Does chemistry need more physics?//, Pure and Applied Chemistry, 2025 [[https://doi.org/10.1515/pac-2025-0497|DOI:10.1515/pac-2025-0497]]
  
 *//July 18 2025// New publication: Jan Brandejs, Johann Pototschnig and Trond Saue, //Generating Coupled Cluster Code for Modern Distributed-Memory Tensor Software//, The Journal of Chemical Theory and Computation (2025) Article ASAP [[https://doi.org/10.1021/acs.jctc.5c00219|DOI:10.1021/acs.jctc.5c00219]] *//July 18 2025// New publication: Jan Brandejs, Johann Pototschnig and Trond Saue, //Generating Coupled Cluster Code for Modern Distributed-Memory Tensor Software//, The Journal of Chemical Theory and Computation (2025) Article ASAP [[https://doi.org/10.1021/acs.jctc.5c00219|DOI:10.1021/acs.jctc.5c00219]]
 {{ ::tenpi_toc.png?direct&600 |}} {{ ::tenpi_toc.png?direct&600 |}}
 +
 +*//July 17 2025//Zewen Sun, PhD-student in the group of [[https://www.mpi-hd.mpg.de/mpi/de/forschung/abteilungen-und-gruppen/theoretische-quantendynamik-und-quantenelektrodynamik/exotic-quantum-systems|Natalia S. Oreshkina ]] at the Max Planck Institute for Nuclear Physics in Heidelberg, visited us for discussions.
 +{{ ::sewen_july2025.jpg?direct&400 |}}
  
 *//July 11 2025// New publication: Gabriele Fabbro, Jan Brandejs and Trond Saue, //Highly Accurate Expectation Values Using High-Order Relativistic Coupled Cluster Theory//, The Journal of Physical Chemistry A (2025) Article ASAP [[https://doi.org/10.1021/acs.jpca.5c02844|DOI: 10.1021/acs.jpca.5c02844]] *//July 11 2025// New publication: Gabriele Fabbro, Jan Brandejs and Trond Saue, //Highly Accurate Expectation Values Using High-Order Relativistic Coupled Cluster Theory//, The Journal of Physical Chemistry A (2025) Article ASAP [[https://doi.org/10.1021/acs.jpca.5c02844|DOI: 10.1021/acs.jpca.5c02844]]
start.1753201336.txt.gz · Last modified: 2025/07/22 18:22 by tsaue