10:00 - 10:25

• Walk-in

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  Time	Program
  10:00-10:25	Walk-in + coffee/tea
  10:25-10:30	Welcome
  10:30-11:00	Invited speaker 1: Daria Gamilberti (RU) “Being fast without cutting corners in free energy calculations and spectroscopy.”
  11:00-11:30	Invited speaker 2: Olivier Bequignon (UL)
  11:30-11:45	Contributed talk 1
  11:45-12:00	Contributed talk 2
  12:00-13:30	Lunch and posters (Atrium, ground floor)
  13:00-13:30	General assembly CTC members
  13:30-14:00	Invited speaker 3: Thomas Jansen (RUG)
  14:00-14:30	Invited speaker 4: David Araripe (RUG)
  14:30-14:45	Contributed talk 3
  14:45-15:00	Contributed talk 4
  15:00-15:30	Coffee/tea
  15:30-15:45	Contributed talk 5
  15:45-16:15	Invited speaker 5: Sofia Calero (TUE) "Bridging Simulation and Reality: From Molecular Insight to Sustainable Materials Design”
  16:15-17:30	Drinks and snacks

10:25 - 10:30

• Welcome

10:30 - 11:00

• Invited speaker: Daria Gamilberti (RU)

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  Being fast without cutting corners in free energy calculations and spectroscopy

11:00 - 11:30

• Invited speaker: Olivier Bequignon (UL)

11:30 - 11:45

• Contributed talk: Mike Pauls

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  A Theoretical Perspective on Photocatalytic Chiral Resolution via Hydrogen Atom and Energy Transfer

11:45 - 12:00

• Contributed talk: Daria Babushkina

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  Fast and generalizable generation of transition state guess structures via system-specific force fields
  

12:00 - 13:30

• Lunch + Posters

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  Atrium, ground floor

  13.00-13.30 GENERAL ASSEMBLY CTC MEMBERS

13:30 - 14:00

• Invited speaker: Thomas Jansen (RUG)

14:00 - 14:30

• Invited speaker: David Araripe (RUG)

14:30 - 14:45

• Contributed talk: Alexander Kolganov

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  Origin of the 31P NMR Chemical Shift in Lewis Acid Adducts of Triethylphosphine Oxide. Does the Gutmann-Beckett Method Relate to Lewis Acid Strength?

14:45 - 15:00

• Contributed talk: Emiel Slootman

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  QMCkl: Software Strategies for Accelerating Quantum Monte Carlo

15:00 - 15:30

• Coffee/tea

15:30 - 15:45

• KNCV/CTC Prize

15:45 - 16:15

• Invited speaker; Sofia Calero (TUE)

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  'Bridging Simulation and Reality: From Molecular Insight to Sustainable Materials Design'

16:15 - 17:30

• Drinks & Snacks