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Q-Chem workshop

Speaker: Q-Chem
Speaker Link: https://www.q-chem.com/
Time: 17:00 CET 09-Feb-2023

Getting ready for the Q-Chem workshop

 

Detailed schedule for the Q-Chem workshop

 
 
APPROXIMATE DURATION
TOPIC
PRESENTER
17:00-17:45 CET
Introduction to Q-Chem
Shirin Faraji
17:45-18:30 CET
Introduction to IQmol
Shannon Houck
18:30-18:45 CET Break -
18:45-19:45 CET Density Functional Theory Overview Martin Head-Gordon
19:45-20:30 CET
Geometry Optimization in Q-Chem
Peter McLaughlin
20:30-21:15 CET Refreshment Break  
21:15-21:45 CET
Energy Decomposition Analysis Yuezhi Mao
21:45-22:30 CET
Spectral Analysis Techniques using DFT and TDDFT Martin Head-Gordon
22:30-22:45 CET
Break
-
22:45-23:15 CET
Solvent Models John Herbert
23:15-00:15 CET
Coupled-Cluster Methods for Excited States to Model Spectroscopy in UV/Vis & X-Ray Regimes Anna Krylov
00:15-0030 CET Break -
00:30-01:00 CET New Features in Q-Chem 6 Q-Chem Team
01:00-01:45 CET
Q&A Session
Q-Chem Team

Introduction to Q-Chem - Shirin Faraji

Introduction to IQmol - Shannon Houck

Density Functional Theory Overview - Martin Head-Gordon

Geometry Optimization in Q-Chem - Peter McLaughlin

Geometry Energy Decomposition Analysis - Yuezhi Mao

Spectral Analysis Techniques using DFT and TDDFT - Martin Head-Gordon

Exercises 1

Solvent Models - John Herbert

Coupled-Cluster Methods for Excited States to Model Spectroscopy in UVVis and X-Ray Regimes - Anna Krylov

Exercises 2

Exercises 3

New Features in Q-Chem 6 - Q-Chem Team

5 thoughts on “Q-Chem workshop”

  1. Friday, 10 February 2023 00:00

    Is there any certificate provided who complete the workshop?

  2. Thursday, 09 February 2023 11:55

    The parts of the workshop will be recorded and available after on this page after the event is over...

  3. Thursday, 09 February 2023 09:44

    it could be great to have the workshop available for future need. Please, if you could consider it, I will really appreciate it :)

  4. Wednesday, 08 February 2023 16:36

    Hello, will this workshop be registered to watch part of that in a second moment?

    1. Sunday, 12 February 2023 15:10

      Yes, we are working on providing individual section videos instead of a giant 7-hour piece. Stay tuned.