Mickaël Profeta

Centre National de la Recherche Scientifique — France

Chemistry · Physical Sciences

9h-index1.3kcitations14works0.02yr avg
OpenAlex↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Advanced NMR Techniques and Applications(12), Solid-state spectroscopy and crystallography(9), Glass properties and applications(5), Zeolite Catalysis and Synthesis(2), NMR spectroscopy and applications(2)

Publications14 total

Combined First-Principles Computational and Experimental Multinuclear Solid-State NMR Investigation of Amino Acids
The Journal of Physical Chemistry A·2005· 177 cited
First-principles calculation of the O-17 NMR parameters of a calcium aluminosilicate glass
HAL (Le Centre pour la Communication Scientifique Directe)·2005· 1 cited
First-Principles Calculation of the <sup>17</sup>O NMR Parameters of a Calcium Aluminosilicate Glass
The Journal of Physical Chemistry B·2005· 98 cited
Cluster and periodic approaches for ab-initio calculation of NMR parameters in silicates and zeolites
SPIRE - Sciences Po Institutional REpository·2005
Ab initio Calculations of NMR Parameters of Highly Coordinated Oxygen Sites in Aluminosilicates.
ChemInform·2004
First-Principles Calculation of the <sup>17</sup>O NMR Parameters in Ca Oxide and Ca Aluminosilicates:  the Partially Covalent Nature of the Ca−O Bond, a Challenge for Density Functional Theory
Journal of the American Chemical Society·2004· 107 cited
Ab Initio Calculations of NMR Parameters of Highly Coordinated Oxygen Sites in Aluminosilicates
The Journal of Physical Chemistry B·2004· 59 cited
Theoretical Investigation of Oxygen-17 NMR Shielding and Electric Field Gradients in Glutamic Acid Polymorphs
The Journal of Physical Chemistry A·2004· 88 cited
First-Principles Calculation of <sup>17</sup>O, <sup>29</sup>Si, and <sup>23</sup>Na NMR Spectra of Sodium Silicate Crystals and Glasses
The Journal of Physical Chemistry B·2004· 184 cited
Combined <i>ab initio</i> computational and experimental multinuclear solid‐state magnetic resonance study of phenylphosphonic acid
Magnetic Resonance in Chemistry·2004· 94 cited
Solid state magnetic resonance from first principles: applications to silicates
AGUFM·2003
Accurate First Principles Prediction of <sup>17</sup>O NMR Parameters in SiO<sub>2</sub>:  Assignment of the Zeolite Ferrierite Spectrum
Journal of the American Chemical Society·2002· 418 cited
Theory of resonant Raman scattering of tetrahedral amorphous carbon
Physical review. B, Condensed matter·2001· 33 citedOpen Access
Extensive Oedema Surrounding Meningioma
Rivista di Neuroradiologia·1998

Frequent Co-authors

Francesco Mauri(13), Chris J. Pickard(11), Christel Gervais(4), Magali Benoit(3), Florence Babonneau(3), R. Dupree(2), Christian Bonhomme(2), Mark E. Tuckerman(2), Thibault Charpentier(1), Simona Ispas(1), Kevin J. Pike(1), Vincent Lafond(1), Thierry Azaïs(1), P. Hubert Mutin(1), Jonathan R. Yates(1), Mike C. Payne(1), Sylvain Cristol(1), Jean‐Paul Amoureux(1), Sridevi L. Ganapathy(1), Jean‐François Paul(1)