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Journal of Chemical Theory and Computation
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October 7, 2016
Ligand NMR Chemical Shift Calculations for Paramagnetic Metal Complexes: 5f<sup>1</sup> vs 5f<sup>2</sup> Actinides
Frédéric Gendron, Jochen Autschbach
The Journal of Physical Chemistry Letters
|
January 24, 2017
Puzzling Lack of Temperature Dependence of the PuO<sub>2</sub> Magnetic Susceptibility Explained According to Ab Initio Wave Function Calculations
Frédéric Gendron, Jochen Autschbach
The Journal of Physical Chemistry Letters
|
August 13, 2015
Calculating NMR Chemical Shifts for Paramagnetic Metal Complexes from First-Principles
Frédéric Gendron, Kamal Sharkas, Jochen Autschbach
Inorganic Chemistry
|
November 27, 2014
Magnetic properties and electronic structures of Ar3U(IV)–L Complexes with Ar = C5(CH3)4H(–) or C5H5(–) and L = CH3, NO, and Cl
Frédéric Gendron, Boris Le Guennic, Jochen Autschbach
Physical Chemistry Chemical Physics : PCCP
|
February 16, 2022
Near-infrared circular dichroism of the ytterbium DOTMA complex: an <i>ab initio</i> investigation
Frédéric Gendron, Maxime Grasser, Boris Le Guennic
The Journal of Physical Chemistry Letters
|
January 30, 2018
Calculation of Dipole-Forbidden 5f Absorption Spectra of Uranium(V) Hexa-Halide Complexes
Yonaton N Heit, Frédéric Gendron, Jochen Autschbach
Chemical Science
|
August 21, 2018
Similar ligand-metal bonding for transition metals and actinides? 5f<sup>1</sup> U(C<sub>7</sub>H<sub>7</sub>)<sub>2</sub><sup>-</sup><i>versus</i> 3d <sup></sup> metallocenes
Dumitru-Claudiu Sergentu, Frédéric Gendron, Jochen Autschbach
Inorganic Chemistry
|
July 31, 2014
Magnetic resonance properties of actinyl carbonate complexes and plutonyl(VI)-tris-nitrate
Frédéric Gendron, Ben Pritchard, Hélène Bolvin, et al.
Dalton Transactions (Cambridge, England : 2003)
|
October 30, 2015
Single-ion 4f element magnetism: an ab-initio look at Ln(COT)2(-)
Frédéric Gendron, Benjamin Pritchard, Hélène Bolvin, et al.
Inorganic Chemistry
|
December 20, 2018
Magnetic Coupling in the Ce(III) Dimer Ce<sub>2</sub>(COT)<sub>3</sub>
Frédéric Gendron, Jochen Autschbach, Jean-Paul Malrieu, et al.
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Search research articles
Search
Showing results (1-10 of 35) with videos related to
Sort By:
Page
of 4
Journal of Chemical Theory and Computation
|
October 7, 2016
Ligand NMR Chemical Shift Calculations for Paramagnetic Metal Complexes: 5f<sup>1</sup> vs 5f<sup>2</sup> Actinides
Frédéric Gendron, Jochen Autschbach
The Journal of Physical Chemistry Letters
|
January 24, 2017
Puzzling Lack of Temperature Dependence of the PuO<sub>2</sub> Magnetic Susceptibility Explained According to Ab Initio Wave Function Calculations
Frédéric Gendron, Jochen Autschbach
The Journal of Physical Chemistry Letters
|
August 13, 2015
Calculating NMR Chemical Shifts for Paramagnetic Metal Complexes from First-Principles
Frédéric Gendron, Kamal Sharkas, Jochen Autschbach
Inorganic Chemistry
|
November 27, 2014
Magnetic properties and electronic structures of Ar3U(IV)–L Complexes with Ar = C5(CH3)4H(–) or C5H5(–) and L = CH3, NO, and Cl
Frédéric Gendron, Boris Le Guennic, Jochen Autschbach
Physical Chemistry Chemical Physics : PCCP
|
February 16, 2022
Near-infrared circular dichroism of the ytterbium DOTMA complex: an <i>ab initio</i> investigation
Frédéric Gendron, Maxime Grasser, Boris Le Guennic
The Journal of Physical Chemistry Letters
|
January 30, 2018
Calculation of Dipole-Forbidden 5f Absorption Spectra of Uranium(V) Hexa-Halide Complexes
Yonaton N Heit, Frédéric Gendron, Jochen Autschbach
Chemical Science
|
August 21, 2018
Similar ligand-metal bonding for transition metals and actinides? 5f<sup>1</sup> U(C<sub>7</sub>H<sub>7</sub>)<sub>2</sub><sup>-</sup><i>versus</i> 3d <sup></sup> metallocenes
Dumitru-Claudiu Sergentu, Frédéric Gendron, Jochen Autschbach
Inorganic Chemistry
|
July 31, 2014
Magnetic resonance properties of actinyl carbonate complexes and plutonyl(VI)-tris-nitrate
Frédéric Gendron, Ben Pritchard, Hélène Bolvin, et al.
Dalton Transactions (Cambridge, England : 2003)
|
October 30, 2015
Single-ion 4f element magnetism: an ab-initio look at Ln(COT)2(-)
Frédéric Gendron, Benjamin Pritchard, Hélène Bolvin, et al.
Inorganic Chemistry
|
December 20, 2018
Magnetic Coupling in the Ce(III) Dimer Ce<sub>2</sub>(COT)<sub>3</sub>
Frédéric Gendron, Jochen Autschbach, Jean-Paul Malrieu, et al.
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