Julien Pilmé

QTAIM Analysis in the Context of Quasirelativistic Quantum Calculations

Julien Pilmé, Éric Renault, Fadel Bassal et al. · Journal of Chemical Theory and Computation · 2014 · 87 citations

Natural Sciences, Chemistry, Nuclear Medicine +14

Gas-Phase Folding of a Two-Residue Model Peptide Chain: On the Importance of an Interplay between Experiment and Theory

Eric Gloaguen, Benoît de Courcy, Jean‐Philip Piquemal et al. · Journal of the American Chemical Society · 2010 · 86 citations

Natural Sciences, Chemistry, Physics +17

Structure and Stability of M−CO, M = First-Transition-Row Metal:  An Application of Density Functional Theory and Topological Approaches

Julien Pilmé, Bernard Silvi, M. E. Alikhani · The Journal of Physical Chemistry A · 2003 · 85 citations

Natural Sciences, Chemistry, Physics +17

Experimental and theoretical evidences of the influence of hydrogen bonding on the catalytic activity of a series of 2-hydroxy substituted quaternary ammonium salts in the styrene oxide/CO2 coupling reaction

Catarina Carvalho Rocha, Thomas Onfroy, Julien Pilmé et al. · Journal of Catalysis · 2015 · 75 citations

Natural Sciences, Chemical Engineering, Chemistry +16

An Electron Localization Function Study of the Geometry of d⁰Molecules of the Period 4 Metals Ca to Mn

R. J. Gillespie, Stéphane Noury, Julien Pilmé et al. · Inorganic Chemistry · 2004 · 72 citations

Natural Sciences, Chemistry, Physics +17