|CCL 19.04.16 PostDoc in Computational Chemistry in Dijon (France)|
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Date: Tue Apr 16 08:50:29 2019
Subject: 19.04.16 PostDoc in Computational Chemistry in Dijon (France)
Duration: 1 year Deadline for application: 15.07.2019 Net salary: about 2000/month after tax Start date: from July 2019 A postdoctoral position in Computational Chemistry is available in the group of Pr. Paul Fleurat-Lessard (http://pfleurat.free.fr/index.php) in Dijon at the Institut de Chimie Molculaire (http://www.icmub.com/en/) in the Bourgogne Franche Comt University (France). The successful candidate will apply electronic structure theory, DFT methods to investigate organometallic chemistry mechanism. More specifically, this project corresponds to the theoretical study associated to the ALCATRAS ANR. The ALCATRAS project is a fundamental research project aimed at developing innovative catalytic tools for CH functionalization of heteroaromatics and CO2 activation. The aim of the post-doctoral project is to help designing new ligands for new selectivity in CH activation. For this, we will analyse the electronic structure of the ligands and catalysts with AIM, ELF and NCI approaches to find chemical descriptors of the target reactions.[1,2] In parallel, we will also study the mechanism of the CH activation using our home code to find the transition states.[3,4] Requirements - PhD in theoretical or computational chemistry or physics - some knowledge of organometallic chemistry (especially with palladium) - Be a curious and self-driven person - Experience in mechanistic studies - Some programming skills would be a plus.  Dalton Transactions, 2018, 47, 11203-11218. doi:10.1039/C8DT02364F  Inorg. Chem. 2016, 55, 10907-10921. doi:10.1021/acs.inorgchem.6b01318  Adv. Synth. Catal. 2019, 361,151 - 159. doi:10.1002/adsc.201801225  ACS Catalysis 2018, 8, 30673075. doi:10.1021/acscatal.8b00544; ACS Catal. 2017, 7, 84938501. doi:10.1021/acscatal.7b03186
Interested applicants should send a cover letter outlining their skill set and their research and career goals, a CV, and the contact details for two academic references. Please submit the requested information by e-mail to: Paul.Fleurat-Lessard-$-u-bourgogne.frNOTE THAT E-MAIL ADDRESSES HAVE BEEN MODIFIED!!!
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