kc2l.kaust.edu.sa

Computational Chemistry Laboratory - King Abdullah University of Science and Technology

Welcome to the Cavallo Group. Understanding (and possibly solving) chemical problems, especially of industrial relevance, is our main activity. Our areas of interest range from clarifying structure/function relationships in organometallic compounds to unraveling the mechanics of homogeneous and heterogeneous catalysts at work. We are not shy to tackle systems of biological interest. In all cases we try to interact as much as possible with experimentalists. When unsatisfied with the availa...What can NMR ...

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Computational Chemistry Laboratory - King Abdullah University of Science and Technology | kc2l.kaust.edu.sa Reviews

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Welcome to the Cavallo Group. Understanding (and possibly solving) chemical problems, especially of industrial relevance, is our main activity. Our areas of interest range from clarifying structure/function relationships in organometallic compounds to unraveling the mechanics of homogeneous and heterogeneous catalysts at work. We are not shy to tackle systems of biological interest. In all cases we try to interact as much as possible with experimentalists. When unsatisfied with the availa...What can NMR ...

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1 computational chemistry laboratory

2 research

3 people

4 publications

5 teaching

6 collaborators

7 news

8 our team

9 our publications

10 professor luigi cavallo

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Computational Chemistry Laboratory - King Abdullah University of Science and Technology | kc2l.kaust.edu.sa Reviews

https://kc2l.kaust.edu.sa

Welcome to the Cavallo Group. Understanding (and possibly solving) chemical problems, especially of industrial relevance, is our main activity. Our areas of interest range from clarifying structure/function relationships in organometallic compounds to unraveling the mechanics of homogeneous and heterogeneous catalysts at work. We are not shy to tackle systems of biological interest. In all cases we try to interact as much as possible with experimentalists. When unsatisfied with the availa...What can NMR ...

INTERNAL PAGES

kc2l.kaust.edu.sa

1

Computational Chemistry Laboratory - News

https://kc2l.kaust.edu.sa/Pages/News.aspx

New postdoc arrived. Welcome Luis! New postdoc arrived. Welcome Luis! New paper on ACS Catalysis accepted! New paper on ACS Catalysis accepted. New postdoc arriving, welcome Ida! A new JACS paper accepted! A new JACS paper accepted! Http:/ pubs.acs.org/doi/abs/10.1021/jacs.6b07974. Structural Stability, Acidity and Halide Selectivity of the Fluoride Riboswitch Recognition Site. M Chawla, R.Credendino, A. Poater, R. Oliva, L. Cavallо. J Am Chem. Soc., 137 (1), pp 299 306, (2015). The beginning and end dat...

2

Computational Chemistry Laboratory - Join Us

https://kc2l.kaust.edu.sa/Pages/JoinUs.aspx

If you are interested in joining the group, please contact us. Only applicants with the following qualifications will be considered:. A recent Ph.D. degree in Computational Physics, Chemistry, Bioinformatics or a related field. Proficiency in at least one programming language. Working experience in compiling and running programs in Linux environment. If your CV matches the above, please send it to us, including two reference names.

3

Computational Chemistry Laboratory - Teaching

https://kc2l.kaust.edu.sa/Pages/Teaching.aspx

Advanced Physical Chemstry I: Thermodynamics and Kinetics (ChemS 360). Advanced Physical Chemstry I: Thermodynamics and Kinetics (ChemS 360). Computational and Theoretical Chemistry (ChemS 370). Computational and Theoretical Chemistry (ChemS 370). The beginning and end dates for each internship will be agreed upon between the Faculty and the Intern. Visa processing time will be a determining factor in actual start date. Minimum period is three months. Maximum period is six months.

4

Computational Chemistry Laboratory - People

https://kc2l.kaust.edu.sa/Pages/People.aspx

Luigi Cavallo, PhD. Computational Chemistry Laboratory (KC2L). Associate Professor of Chemical Science. KAUST Catalysis Center (KCC). Physical Sciences and Engineering Division (PSE). Abdesslem Jedidi, PhD. Surface chemistry, Catalysis, Density functional theory. Edrisse Chermak, PhD. Biorefining, Enzymatic catalysis, Renewable biofuels. Laura Falivene, PhD. Catalysis, Computational modeling. Sai V C. Vummaleti, PhD. Stefania Evoli, PhD. Yury Minenkov, PhD. Zhen Cao, PhD. Miasser M. Alghamdi.

5

Computational Chemistry Laboratory - Dr. Luigi Cavallo

https://kc2l.kaust.edu.sa/Pages/Cavallo.aspx

Luigi Cavallo, PhD. Computational Chemistry Laboratory (KC2L). Associate Professor of Chemical Science. KAUST Catalysis Center (KCC). Physical Sciences and Engineering Division (PSE). Breaking the regioselectivity rule for acrylate insertion in the Mizoroki Heck reaction. P Wucher, L. Caporaso, P. Roesle, F. Ragone, L. Cavallo, S. Mecking, I. Göttker-Schnetmann. Proc Natl. Acad. Sci., 108, 8955-8959, (2011). A Poater, F. Ragone, R. Mariz, R. Dorta, L. Cavallo. Chem Eur. J., 16, 14348, (2010). Golden Caro...

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Computational Chemistry Laboratory - King Abdullah University of Science and Technology

Welcome to the Cavallo Group. Understanding (and possibly solving) chemical problems, especially of industrial relevance, is our main activity. Our areas of interest range from clarifying structure/function relationships in organometallic compounds to unraveling the mechanics of homogeneous and heterogeneous catalysts at work. We are not shy to tackle systems of biological interest. In all cases we try to interact as much as possible with experimentalists. When unsatisfied with the availa...What can NMR ...

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