DIRAC

ZOOM. To participate you must register in advance on: Registration for Dirac2020 zoom

After your registration has been approved, you will receive a confirmation email containing information about how to join the meeting.

The DIRAC meeting is a family reunion for DIRAC developers and DIRAC friends. Dirac users are very welcome to participate, it is a nice opportunity to meet the people behind the DIRAC code. There is no registration fee but you need to register on the link above to get access to the online meeting over zoom.

We will discuss science, but a significant part of the program is reserved to discuss the future of the DIRAC code, programming, code maintenance, release planning, as well as for programming task groups.

The meeting program is self-organised, simply add talks and discussion points to the program. (Send an e-mail to Hans Jørgen using hjj at sdu.dk if you do not have editing permission to this page.)

1. Hans Jørgen Aa. Jensen, Odense
2. Trond Saue, Toulouse
3. Andre Gomes, Lille
4. Xiang Yuan, Lille
5. Loic Halbert, Lille (partially)
6. Gabriel Cesar Pereira, Lille
7. Wilken Misael, Lille
8. Richard Opoku, Lille
9. Lucas Visscher, Amsterdam
10. Agustín Aucar, Corrientes
11. Elke Fasshauer, Aarhus
12. Paul Bagus, UNT Texas
13. Johann Pototschnig, Amsterdam
14. Ayaki Sunaga, Osaka
15. Gosia Olejniczak, Warsaw
16. Pi Haase, Groningen
17. Erik Hedegård, Lund (on-and-off due to student projects)
18. Miroslav Iliaš, Banská Bystrica
19. Stan Papadopoulos, Mülheim an der Ruhr
20. Martin van Horn, Amsterdam
21. Avijit Shee, Ann Arbor
22. Radovan Bast, Tromsø
23. Malaya K. Nayak, Mumbai
24. Eugene Gvozdetsky, Amsterdam
25. Ephraim Eliav, Tel Aviv
26. Alexander Oleynechenko, Moscow
27. Andrey Zaitsevsky, Moscow
28. Chima Chibueze, Amsterdam
29. Juan J. Aucar, Corrientes
30. Yuly Chamorro Mena, Groningen
31. Andy Zapata, Corrientes

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• Go through issue list on dirac-gitlab
• Discuss public release of Dirac in 2020, when and how
• Codata (move to 2018 version)
• Add missing information to DFCOEF (or possibly a new restart file)

• Testing and Merging of EXACORR

Please sign up for your presentation (one or possibly two, if different topics) in one of the free 30 min time slots below, you can also add it here if you will let the organizers determine your time slot. Plan you presentation to 20 min, leaving 7 min for discussion and 3 min for changing speaker.

“Technical talks” refer to talks about development tools, “how to” etc.

• (name, title, anytime on Thursday)

• 13:30 – 13:45 – Opening, discussion of meeting program (Hans Jørgen)
• 13:45 – 14:15 – Introduction round (everybody)
• 14:15 – 14:45 – Overview of current and planned DIRAC developments by node leaders
• 14:45 – 15:00 – Task group formation, planning of collaborative work.
• 15:00 – 15:30 – Coffee/tea/mate break

• 15:30 – 16:00 – Johann Pototschnig, Lucas Visscher: The ExaCorr module.
• 16:00 – 16:30 – Dmitry Lyakh: The ExaTensor library.
• 16:30 – 17:00 – Andre Gomes, Loic Halbert : Developments for ground and excited states, first applications with exacorr (and some EOM-CC results with RELCCSD)

* 09:30 – 12:00 Collaborative work (issue fixing, discussions of new methods in Dirac, documentation, tutorials, joint papers, etc.) NOTE: new start time.

• 12:00 – 13:30

• 13:30 – 14:00 – Update on task groups/issues
• 14:00 – 14:30 – Codata and DIRAC
• 14:30 – 15:00 –
• 15:00 – 15:30 – Coffee/tea/mate break
• 15:30 – 16:00 – Trond Saue - Beyond the electric dipole approximation: on the convergence of multipole expansions
• 16:00 – 16:30 – Maen Salman - Charge conjugation symmetry in the finite basis approximation of the Dirac equation
• 16:30 – 17:00 – Ayaki Sunaga - Relativistic correlated calculations with effective QED potentials

• 09:30 – 12:00 Collaborative work.

• 12:00 – 13:30

• 13:30 – 14:00 – Update on task groups/issues
• 14:00 – 14:30 – Radovan: transition to LGPL and branch cleanup (as basis for collaborative work for Sat June 6)
• 14:30 – 15:00 – Discussion about Dirac2020 release.
• 15:00 – 15:30 – Coffee/tea/mate break
• 15:30 – 16:00 – Bruno Senjean: The ROSE (Reduction of Orbital Space Extent) code
• 16:00 – 16:30 – Dmitry Lyakh: CC with automated generation of diagrams
• 16:30 – 17:00 – Andrei Zaitsevskii, Alexander Oleynichenko: Fock Space Relativistic Coupled Clusters for Molecular Excited States. Problems and Workarounds, Relativistic Fock Space Coupled Cluster beyond CCSD: Theory and Implementation

• 09:00 – 17:00 Collaborative work (joint papers, joint programming efforts).