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meeting2017 [2017/06/06 12:31] – [Friday June 9] visschermeeting2017 [2017/06/08 10:31] (current) – [Thursday June 8] miro_ilias
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 === Technical issues (discussion sessions) === === Technical issues (discussion sessions) ===
  
-  * 13:30 -- 14:00 Composable libraries for quantum chemistry (Radovan) +  * 13:30 -- 14:00 [[http://cicero.xyz/v3/remark/0.14.0/github.com/bast/dirac-meeting-2017/master/composable-libraries.md/|Composable libraries for quantum chemistry]] (Radovan) 
-  * 14:00 -- 14:30 Limitations of the Simple Coulombic corrections (Trond+  * 14:00 -- 14:30 CAAR Skype break (HJ, Luuk, Andre, Radovan
-  * 14:30 -- 15:00 Relativistic polarizable embedding (current status; Erik+  * 14:30 -- 15:00 Limitations of the Simple Coulombic corrections (Trond
-  * 15:00 -- 15:30 Comments on Lowdin Elimination of Near Linear Dependence (Bagus)+  * 15:00 -- 15:30 Relativistic polarizable embedding (current status; Erik)
   * 15:30 -- 16:00 Break   * 15:30 -- 16:00 Break
   * 16:00 -- 17:00 Status of EOM-CC (Avijit via skype, Trond, Andre, Luuk)   * 16:00 -- 17:00 Status of EOM-CC (Avijit via skype, Trond, Andre, Luuk)
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 ==== Thursday June 8 ==== ==== Thursday June 8 ====
  
-  * 09:00 -- 10:00 Collaborative code review exercise (Radovan)+  * 09:00 -- 10:00 [[http://cicero.xyz/v3/remark/0.14.0/github.com/bast/dirac-meeting-2017/master/exercise.md/|Collaborative code review exercise]] (Radovan)
   * 10:00 -- 10.30 Relativistic SOPPA (Elke)   * 10:00 -- 10.30 Relativistic SOPPA (Elke)
   * 11:00 -- 11:30 Performance analysis of DIRAC (Trond)   * 11:00 -- 11:30 Performance analysis of DIRAC (Trond)
-  * 11:30 -- 12:00 Relativistic Calculations on Group-VI and Group-VIII Carbonyls​ (Miro, via internet)+  * 11:30 -- 12:00 [[https://1drv.ms/p/s!AmkMwbGEWxbNuQY1JCfMe7piSuj5|Relativistic Calculations on Group-VI and Group-VIII Carbonyls]]​ (Miro, via internet)
  
-  * 13:30 -- 14:00 Discussion: Improved basis set handling (Luuk) +  * 13:30 -- 14:00 Comments on Lowdin Elimination of Near Linear Dependence (Bagus) 
-  * 14:00 -- 14.30 Dirac Release: Define new feature List+  * 14:00 -- 14:30 Experience with OpenMP (Ben) 
 +  * 14:30 -- 15:00 Discussion: Improved data structures (Luuk) 
 +  * 15:00 -- 15.30 Dirac Release: Define new feature List
  
 ==== Friday June 9 ==== ==== Friday June 9 ====
  
   * 09:00 -- 17:30 Collaborative session (joint papers, joint programming efforts).    * 09:00 -- 17:30 Collaborative session (joint papers, joint programming efforts). 
meeting2017.1496745096.txt.gz · Last modified: 2017/06/06 12:31 by visscher

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