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Éric Brémond
Éric Brémond
Université Paris Cité
Verified email at u-paris.fr
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Cited by
Cited by
Year
Seeking for parameter-free double-hybrid functionals: The PBE0-DH model
E Brémond, C Adamo
The Journal of chemical physics 135 (2), 2011
2992011
Benchmarking density functionals on structural parameters of small-/medium-sized organic molecules
É Brémond, M Savarese, NQ Su, ÁJ Pérez-Jiménez, X Xu, ...
Journal of chemical theory and computation 12 (2), 459-465, 2016
2032016
Communication: Double-hybrid functionals from adiabatic-connection: The QIDH model
É Brémond, JC Sancho-García, ÁJ Pérez-Jiménez, C Adamo
The Journal of chemical physics 141 (3), 2014
1872014
Communication: One third: A new recipe for the PBE0 paradigm
CA Guido, E Brémond, C Adamo, P Cortona
The Journal of Chemical Physics 138 (2), 2013
1632013
TD-DFT vibronic couplings in anthraquinones: from basis set and functional benchmarks to applications for industrial dyes
D Jacquemin, E Brémond, A Planchat, I Ciofini, C Adamo
Journal of Chemical Theory and Computation 7 (6), 1882-1892, 2011
1352011
Doubly hybrid density functional xDH-PBE0 from a parameter-free global hybrid model PBE0
IY Zhang, NQ Su, EAG Bremond, C Adamo, X Xu
The Journal of chemical physics 136 (17), 2012
1272012
Nonempirical double-hybrid functionals: An effective tool for chemists
E Bremond, I Ciofini, JC Sancho-García, C Adamo
Accounts of chemical research 49 (8), 1503-1513, 2016
1182016
Communication: Rationale for a new class of double-hybrid approximations in density-functional theory
J Toulouse, K Sharkas, E Brémond, C Adamo
The Journal of chemical physics 135 (10), 2011
1172011
DFT and proton transfer reactions: a benchmark study on structure and kinetics
GF Mangiatordi, E Bremond, C Adamo
Journal of chemical theory and computation 8 (9), 3082-3088, 2012
1092012
Geometrically faithful homeomorphisms between the electron density and the bare nuclear potential
PLA Popelier, ÉAG Brémond
International Journal of Quantum Chemistry 109 (11), 2542-2553, 2009
1052009
Accuracy of TD-DFT geometries: a fresh look
E Bremond, M Savarese, C Adamo, D Jacquemin
Journal of chemical theory and computation 14 (7), 3715-3727, 2018
982018
Impact of vibronic couplings on perceived colors: two anthraquinones as a working example
D Jacquemin, E Brémond, I Ciofini, C Adamo
The journal of physical chemistry letters 3 (4), 468-471, 2012
952012
Range-separated hybrid density functionals made simple
É Brémond, ÁJ Pérez-Jiménez, JC Sancho-García, C Adamo
The Journal of Chemical Physics 150 (20), 2019
842019
The nature of vertical excited states of dyes containing metals for DSSC applications: insights from TD-DFT and density based indexes
T Le Bahers, E Brémond, I Ciofini, C Adamo
Physical Chemistry Chemical Physics 16 (28), 14435-14444, 2014
682014
Studies on the enantioselective iminium ion trapping of radicals triggered by an electron-relay mechanism
A Bahamonde, JJ Murphy, M Savarese, E Brémond, A Cavalli, ...
Journal of the American Chemical Society 139 (12), 4559-4567, 2017
632017
Range-separated double-hybrid functional from nonempirical constraints
E Bremond, M Savarese, ÁJ Pérez-Jiménez, JC Sancho-García, C Adamo
Journal of Chemical Theory and Computation 14 (8), 4052-4062, 2018
582018
In silico assessment of drug substances chemical stability
J Kieffer, É Brémond, P Lienard, G Boccardi
Journal of Molecular Structure: THEOCHEM 954 (1-3), 75-79, 2010
572010
Is there still room for parameter free double hybrids? Performances of PBE0-DH and B2PLYP over extended benchmark sets
D Bousquet, E Bremond, JC Sancho-Garcia, I Ciofini, C Adamo
Journal of Chemical Theory and Computation 9 (8), 3444-3452, 2013
492013
Convenient general asymmetric synthesis of roche ester derivatives through catalytic asymmetric hydrogenation: steric and electronic effects of ligands
C Pautigny, S Jeulin, T Ayad, Z Zhang, JP Genêt, ...
Advanced Synthesis & Catalysis 350 (16), 2525-2532, 2008
472008
A reliable method for fitting TD-DFT transitions to experimental UV–visible spectra
ÉAG Brémond, J Kieffer, C Adamo
Journal of Molecular Structure: THEOCHEM 954 (1-3), 52-56, 2010
462010
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