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SUMMARY:[ONLINE] Computational Chemistry in Qiskit: A Practical Overview o
 f Current Approaches
DTSTART:20260312T120000Z
DTEND:20260312T160000Z
DTSTAMP:20260422T110700Z
UID:indico-event-380@events.it4i.cz
CONTACT:training@it4i.cz
DESCRIPTION:\nAnnotation\nComputational chemistry is among the most resour
 ce-intensive domains in high-performance computing\, making it a natural f
 rontier for quantum and hybrid quantum–classical algorithms. This traini
 ng session will introduce the most discussed quantum algorithms for chemis
 try\, highlighting their principles\, practical implementations\, and typi
 cal application areas. Through hands-on demonstrations using the Qiskit so
 ftware development kit\, participants will explore how methods such as VQE
 \, QPE\, and other variational or perturbative hybrids can be applied to m
 olecular problems. Particular attention will be given to the scaling of qu
 antum and classical resource requirements\, current hardware limitations\,
  and the practical usability of these approaches in real-world chemical si
 mulations.\nBenefits for the attendees: what will they learn\nParticipants
  will gain a clear overview of the current landscape of quantum and hybrid
  algorithms for computational chemistry\, including practical examples of 
 how these methods are applied. They will also learn to critically assess t
 he feasibility\, resource requirements\, and real-world usability of these
  approaches.\nLevel\nIntermediate\nLanguage\nEnglish\nPrerequisites\nBasic
  knowledge of Qiskit\, computational chemistry\, and quantum computing.\nT
 echnical requirements\nInstalled libraries according to the announcement o
 ne week prior to the training.\nTutor\nMichal Belina is a postdoctoral res
 earcher at the Quantum Computing Laboratory within the IT4Innovations Nati
 onal Supercomputing Center. He earned his Ph.D. in computational chemistry
  from the University of Chemistry and Technology in Prague. His doctoral w
 ork focused on modelling relaxation processes following electronic excitat
 ion or ionisation\, including core-level ionisation. He is focused on hydr
 ogen-bonded systems ranging from several atoms to crystal structures\, wit
 h periodic boundary conditions.\nAcknowledgements\n\nThis project has rece
 ived funding from the European High-Performance Computing Joint Undertakin
 g (JU) under grant agreement No 101101903. The JU receives support from th
 e Digital Europe Programme and Germany\, Bulgaria\, Austria\, Croatia\, Cy
 prus\, Czech Republic\, Denmark\, Estonia\, Finland\, Greece\, Hungary\, I
 reland\, Italy\, Lithuania\, Latvia\, Poland\, Portugal\, Romania\, Sloven
 ia\, Spain\, Sweden\, France\, Netherlands\, Belgium\, Luxembourg\, Slovak
 ia\, Norway\, Türkiye\, Republic of North Macedonia\, Iceland\, Montenegr
 o\, Serbia. This project has received funding from the Ministry of Educati
 on\, Youth and Sports of the Czech Republic.\n\n \n\nThis course was supp
 orted by the Ministry of Education\, Youth and Sports of the Czech Republi
 c through the e-INFRA CZ (ID:90254).\n \nAll presentations and educationa
 l materials of this course are provided under the Creative Commons Attribu
 tion-ShareAlike 4.0 International (CC BY-SA 4.0) license.\n\nhttps://event
 s.it4i.cz/event/380/
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LOCATION:ONLINE 
URL:https://events.it4i.cz/event/380/
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