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DFT plus U
Person
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Person
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Thibault Terencio Ph.D.
External person at Faculty of Science
4 publications
Publications
publication
Chemoselectivity in the Oxidation of Cycloalkenes with a Non-Heme Iron(IV)-Oxo-Chloride Complex: Epoxidation vs. Hydroxylation Selectivity
2019 |
Faculty of Science
publication
A Comparative IRMPD and DFT Study of Fe3+ and UO22+ Complexation with N-Methylacetohydroxamic Acid
2018 |
Faculty of Science
publication
Palladium-Catalyzed C-H Activation: Mass Spectrometric Approach to Reaction Kinetics in Solution
2017 |
Faculty of Science
publication
Chasing the Evasive Fe═O Stretch and the Spin State of the Iron(IV)-Oxo Complexes by Photodissociation Spectroscopy
2017 |
Faculty of Science, Central Library of Charles University
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