Bernard Silvi

According to our database, Bernard Silvi authored at least 11 papers between 1998 and 2019.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of five.

2019

Nine questions on energy decomposition analysis.

Juan Andrés, Paul W. Ayers, Roberto Álvarez Boto, Ramon Carbó-Dorca, Henry Chermette, Jerzy Cioslowski, Julia Contreras-Garcia, David L. Cooper, Gernot Frenking, Carlo Gatti, Farnaz Heidar-Zadeh, Laurent Joubert, Ángel Martín Pendás, Eduard Matito, István Mayer, Alston J. Misquitta, Yirong Mo, Julien Pilmé, Paul L. A. Popelier, Martin Rahm, Eloy Ramos-Cordoba, Pedro Salvador, W. H. Eugen Schwarz, Shant Shahbazian, Bernard Silvi, Miquel Solà, Krzysztof Szalewicz, Vincent Tognetti, Frank Weinhold, Émilie-Laure Zins

J. Comput. Chem., 2019

2016

Theoretical strategies toward stabilization of singlet remote N-heterocyclic carbenes.

Bitupon Borthakur, Bernard Silvi, Rian D. Dewhurst, Ashwini K. Phukan

J. Comput. Chem., 2016

2012

Electronic fluxes during diels-alder reactions involving 1, 2-benzoquinones: mechanistic insights from the analysis of electron localization function and catastrophe theory.

Patricio González-Navarrete, Luis R. Domingo, Juan Andrés, Slawomir Berski, Bernard Silvi

J. Comput. Chem., 2012

2007

New insights on the bridge carbon-carbon bond in propellanes: A theoretical study based on the analysis of the electron localization function.

Victor Polo, Juan Andrés, Bernard Silvi

J. Comput. Chem., 2007

2005

Energetic and topological analyses of the oxidation reaction between Mon (n = 1, 2) and N2O.

Maria Del Carmen Michelini, Nino Russo, Mohammad Esmaïl Alikhani, Bernard Silvi

J. Comput. Chem., 2005

2004

Energetic and topological analysis of the reaction of Mo and Mo2 with NH3, C2H2, and C2H4 molecules.

Maria Del Carmen Michelini, Nino Russo, Mohammad Esmaïl Alikhani, Bernard Silvi

J. Comput. Chem., 2004

2000

Determination of substitutional sites in heterocycles from the topological analysis of the electron localization function (ELF).

Franck Fuster, Alain Sevin, Bernard Silvi

J. Comput. Chem., 2000

1999

Topological analysis of electron density in depleted homopolar chemical bonds.

Rosa Llusar, Armando Beltrán, Juan Andrés, Stéphane Noury, Bernard Silvi

J. Comput. Chem., 1999

Electron localization function comparative study of ground state, triplet state, radical anion, and cation in model carbonyl and imine compounds.

Isabelle Fourré, Bernard Silvi, Patrick Chaquin, Alain Sevin

J. Comput. Chem., 1999

Computational Tools for the Electron Localization Function Topological Analysis.

Stéphane Noury, Xénophon Krokidis, Franck Fuster, Bernard Silvi

Comput. Chem., 1999

1998

DFT-predicted structural, vibrational, and bonding properties of XSiO and X2SiO (X=F, Cl, or Br) molecules.

Mohammad Esmaïl Alikhani, Bernard Silvi

J. Comput. Chem., 1998