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meeting2019 [2019/03/14 14:44]
hjaaj [Participants (please add yourself)]
meeting2019 [2019/05/21 09:36] (current)
miro_ilias added my contribution to DWG2019
Line 72: Line 72:
   - Timo Fleig, Toulouse   - Timo Fleig, Toulouse
   - Anna Kristina Schnack-Petersen,​ Copenhagen   - Anna Kristina Schnack-Petersen,​ Copenhagen
 +  - Sasan Moradi, Iran
 +  - Gosia Olejniczak, Warsaw
 +  - Erik Kjellgren, Odense
 +  - Peter Reinholdt, Odense
 +  - Eugene Gvozdetsky, Amsterdam
 ---- ----
 ==== Work tasks (please add tasks) ==== ==== Work tasks (please add tasks) ====
  
   * Evaluating and (possibly) improving/​updating cmake setup structure   * Evaluating and (possibly) improving/​updating cmake setup structure
- +  * Finish ExaCorr-ReSpect interface (Stan, Michal) 
 +  * Work on Incite proposal 
 +  * Problems with documentation build: Could not import extension matplotlib.sphinxext.only_directives (exception: No module named '​matplotlib.sphinxext.only_ 
 +  * Testing set up (more runners, only test master)
  
 ==== Possible items for the meeting, to be scheduled later ==== ==== Possible items for the meeting, to be scheduled later ====
Line 110: Line 118:
 === Science with DIRAC === === Science with DIRAC ===
  
-  * 09:00 -- 09:30  +  * 09:00 -- 09:30 Andre Gomes - Partition EOM-CC 
-  * 09:30 -- 10:00  +  * 09:30 -- 10:00 Pi Haase - Finite field results for hyperfine constants with CC and FSCC 
-  * 10:00 -- 10:30 +  * 10:00 -- 10:30 Marta L. Vidal - CVS-EOM-CC to Study X-Ray Spectroscopy
   * 10:30 -- 11:00 coffee break   * 10:30 -- 11:00 coffee break
-  * 11:00 -- 11:40  +  * 11:00 -- 11:30 Stan Papadopoulos - Coupled Cluster with ExaTensor/​TALSH 
-  * 11:40 -- 12:10 +  * 11:30 -- 12:00 Johann Pototschnig - Towards Coupled Cluster for Lanthanides
    
 === Lunch  === === Lunch  ===
  
   * 12:10 -- 13:30   * 12:10 -- 13:30
 +
 +=== Science with DIRAC (afternoon)===
 +
 +  * 13:30 -- 14:00 Miroslav Iliaš - Theoretical Study of Molecular and Adsorption Properties of Group 6, 7 and 8 Heavy and Super-heavy Metal Carbonyls ​
  
 === Technical issues (discussion sessions) === === Technical issues (discussion sessions) ===
  
-  * 13:30 -- 14:30 +  * 14:00 -- 14:30 Use of BLAS/LAPACK (technical / licensing issues)
   * 14:30 -- 15:00    * 14:30 -- 15:00 
   * 15:00 -- 15:30    * 15:00 -- 15:30 
   * 15:30 -- 16:00 Break   * 15:30 -- 16:00 Break
-  ​* 16:00 -- 16:30 + 
 + 
 +=== Coupled Cluster in DIRAC === 
 +  ​* 16:00 -- 17:00 Discussion on synchronizing our efforts (Avijit Shee also joins via skype)
  
 === Meeting dinner === === Meeting dinner ===
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 ==== Tuesday May 28 ==== ==== Tuesday May 28 ====
  
-  * 09:00 -- 10:00  +  * 09:00 -- 09:30 "​T-violating weak interaction in closed-shell atoms",​ Timo Fleig 
-  * 10:00 -- 10.30  +  * 09:30 -- 10:00 "​Molecular calculations with effective QED potentials",​ Ayaki Sunaga 
-  * 11:00 -- 11:30  +  * 10:00 -- 10.30 "​Free-particles and charge conjugation in the finite basis approximation",​ Maen Salman 
-  * 11:30 -- 12:00 +  * 11:00 -- 11:30 "From the Dirac equation to QED:, Alexander Efremov 
 +  * 11:30 -- 12:00 "​Visualization in chemistry - the Topological Data Analysis perspective",​ Gosia Olejniczak
  
   * 13:30 -- 14:00    * 13:30 -- 14:00 
meeting2019.1552571058.txt.gz · Last modified: 2019/03/14 14:44 by hjaaj