meeting2018
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meeting2018 [2018/05/11 21:09] – [Participants (please add yourself)] hjaaj | meeting2018 [2018/05/28 10:11] – tsaue | ||
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* Loic Halbert, Lille | * Loic Halbert, Lille | ||
* Yongliang Hao, Groningen | * Yongliang Hao, Groningen | ||
- | * Andreas Nyvang, Århus | + | |
+ | * Gosia Olejniczak, Warsaw | ||
+ | | ||
+ | * Jeppe Olsen, Århus (Tuesday) | ||
+ | * Ayaki Sunaga, Toulouse | ||
+ | * Elke Fasshauer, Aarhus (Tuesday) | ||
---- | ---- | ||
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* Arrival | * Arrival | ||
- | * 19:00 [[http:// | + | * 19:00 [[http:// |
---- | ---- | ||
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* 09:00 -- 09:30 The CAAR coupled cluster reimplementation. L. Visscher | * 09:00 -- 09:30 The CAAR coupled cluster reimplementation. L. Visscher | ||
* 09:30 -- 10:00 EOMCC in Dirac, current status and future directions. A. Shee + A. Gomes | * 09:30 -- 10:00 EOMCC in Dirac, current status and future directions. A. Shee + A. Gomes | ||
- | * 10:00 -- 10:30 | + | * 10:00 -- 10:30 Electronic structure and properties of MAu and MOH (M=Tl,Nh). M.Iliaš |
* 10:30 -- 11:00 coffee break | * 10:30 -- 11:00 coffee break | ||
- | * 11:00 -- 11:30 Predicting the photoionization | + | * 11:00 -- 11:40 Calculating |
- | * 11:30 -- 12:00 | + | * 11:40 -- 12:10 Solvent effects on NMR shielding of molybdate ions via relativistic Frozen Density Embedding. Loic Halbert |
=== Lunch === | === Lunch === | ||
- | * 12:00 -- 13:30 | + | * 12:10 -- 13:30 |
=== Technical issues (discussion sessions) === | === Technical issues (discussion sessions) === | ||
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* 15:00 -- 15:30 Code peer review. Experiences with the CI/CD set up and the available runners. | * 15:00 -- 15:30 Code peer review. Experiences with the CI/CD set up and the available runners. | ||
* 15:30 -- 16:00 Break | * 15:30 -- 16:00 Break | ||
- | * 16:00 -- 17:00 | + | * 16:00 -- 16:30 CI services for private repos in service of DIRAC. M.Iliaš |
=== Meeting dinner === | === Meeting dinner === | ||
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* 09:00 -- 10:00 Start guess and SCF convergence - Luuk | * 09:00 -- 10:00 Start guess and SCF convergence - Luuk | ||
- | * 10:00 -- 10.30 | + | * 10:00 -- 10.30 Beyond the electric dipole approximation: |
- | * 11:00 -- 11:30 | + | * 11:00 -- 11:30 Magnetic properties visualized - Gosia |
* 11:30 -- 12:00 | * 11:30 -- 12:00 | ||
meeting2018.txt · Last modified: 2018/05/30 14:46 by hjaaj