QTC news

IQTC Internal Seminar June 14
Monday, 11 June 2018
On Thursday 14th of June we have the next session of the IQTC internal seminars. It will take place as usual at the Sala d'Actes of the Department of Material Sciences and Physical Chemistry at 12h....
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Talk: Description of quantum tunneling rates in single molecule magnets from multireference ab initio calculations
Monday, 11 June 2018
Today, Monday 11th June at 12h at Aula 202, Daniel Aravena (Universidad de Santiago de Chile) will give the Talk: Description of quantum tunneling rates in single molecule magnets from...
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Talk: 'Tools to analyze calculated activity of homogeneous and heterogeneous catalysts'
Tuesday, 05 June 2018
Dr. Sergey Kozlov (KAUST, Saudi Arabia) is visiting Francesc Illas next week and will deliver the talk entitled 'Tools to analyze calculated activity of homogeneous and heterogeneous catalysts' on...
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Talk: "Electron microscopy lab at CIC nanoGUNE: a guided tour”
Monday, 04 June 2018
Next Friday 22nd June 2018 at 15h at Aula QF there will be the talk by Prof. Dr. Andrey CHUVILIN from CIC nanoGUNE, San Sebastián (http://www.ikerbasque.net/eu/andrey-chuvilin) entitled: "Electron...
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IMAGE Researchers discover a new effect to reduce carbon monoxide emissions in automotive catalytic converters
Tuesday, 29 May 2018
A team of researchers from the University of Barcelona and the Vienna University of Technology have discovered a new catalytic effect that can make automotive catalytic converters more effective and...
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The Institute of Theoretical and Computational Chemistry of the Universitat de Barcelona (IQTCUB) is integrated by more than 60 researchers, experts in several fields of the Theoretical and Computational Chemistry. The research activity carried out at the IQTCUB covers methods and computational tools development, application of several techniques of electronic structures and simulation to problems in materials science, the study of reactivity and reaction dynamics in chemical reactions as well as of biological systems and soft-matter.

The main goal is to generate synergies between researchers encouraging the interdisciplinary activities that allow to tackle new challenges. Another important goal is to share expertise in handling the computational resources, which are the main tools in this type of research.

See the IQTCUB director's welcome.

For a more detailed information see the 2017 IQTCUB Scientific Activity Report and the XRQTC disseminating video.

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IX IQTCUB Symposium

02-05-2018
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Curs d'Introducció a la Química Computacional

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