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VERSION:2.0
PRODID:icalendar-ruby
CALSCALE:GREGORIAN
BEGIN:VEVENT
DTSTAMP:20260807T223738Z
UID:7b07fad6-f3bb-4a82-90b4-2fc0d52cf1bf
DTSTART:20150610T070000Z
DTEND:20150611T150000Z
DESCRIPTION:This workshop is a joint event between the French PATC and the 
 Ile-de-France CECAM center (CECAM-FR-IdF). It is aimed at presenting a cri
 tical review of the codes used on Curie@TGCC (and more generally on the Ti
 er-0 machines) in the field of atomic and molecular calculations.  This 
 will cover mainly but not exclusively electronic structure calculations an
 d ab-initio and classical molecular dynamics. Selected specialists of the 
 different codes available on Curie will present the best practices and the
  best performances that can be gained from them\, as well as the grand sci
 entific challenges that they make possible to address in the framework the
  current HPC machines. The meeting will end with a collective reflection o
 n the evolution of the methods and of the codes in the next years\, in ord
 er to identify the ones that should be supported and promoted by the commu
 nity for future development and applications on highly parallel machines.\
 n\nLearning outcome:\n\nKnowledge of the capabilities of the atomic and mo
 lecular calculation codes available on the Tier-0 machines and best practi
 ce to get the maximum from them.\n\nPrerequisite:\n\nThe participants shou
 ld be familiar with computational approaches in chemistry\, in particular 
 ab-initio and/or molecular modelling methods.\n\nhttps://events.prace-ri.e
 u/event/371/
SUMMARY:Atomic and molecular calculation software on massively parallel mac
 hines: present and future@MDS/TGCC
URL;VALUE=URI:https://events.prace-ri.eu/event/371/
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