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Introduction

Key features of the workshop:

The workshop will be aimed at complete beginners and will consist of a mixture of lectures and problem-oriented practical sessions. New PhD students and experimentalists are particularly encouraged to attend.

The workshop will cover the basics of setting up input files and interpreting output files and the use of the Graphical User Interface GaussView. Participants will also be given the opportunity to consult with experts in the field.

Topics covered:

• Energies and geometries
• Basis sets
• Reaction mechanisms and barriers
• Orbitals and bonding
• Spectroscopy
• Solvent effects
• Modelling larger molecules

Deadlines

• Sep 02 2016
  Standard registration deadline

  

Useful links

Speakers

• Prof Michael Bearpark Imperial College London, United Kingdom
• Prof Hrant P Hratchian University of California, Merced, United States
• Dr Lee M Thompson University of California, Merced, United States

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Sponsorship & supporting organisations

Imperial College London

Venue

Imperial College London

Imperial College London, Imperial College London, South Kensington, London, SW7 2AZ, United Kingdom

Useful links

Organised by

NSCCS

Contact information

Dr Alexandra Simperler
NSCCS/Imperial College London
Contact us by email

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