| 2007 |
|---|
| 8 | EE | Victor Polo,
Juan Andrés,
Bernard Silvi:
New insights on the bridge carbon-carbon bond in propellanes: A theoretical study based on the analysis of the electron localization function.
Journal of Computational Chemistry 28(5): 857-864 (2007) |
| 2005 |
|---|
| 7 | EE | Maria Del Carmen Michelini,
Nino Russo,
Mohammad Esmaïl Alikhani,
Bernard Silvi:
Energetic and topological analyses of the oxidation reaction between Mon (n = 1, 2) and N2O.
Journal of Computational Chemistry 26(12): 1284-1293 (2005) |
| 2004 |
|---|
| 6 | EE | Maria Del Carmen Michelini,
Nino Russo,
Mohammad Esmaïl Alikhani,
Bernard Silvi:
Energetic and topological analysis of the reaction of Mo and Mo2 with NH3, C2H2, and C2H4 molecules.
Journal of Computational Chemistry 25(13): 1647-1655 (2004) |
| 2000 |
|---|
| 5 | EE | Franck Fuster,
Alain Sevin,
Bernard Silvi:
Determination of substitutional sites in heterocycles from the topological analysis of the electron localization function (ELF).
Journal of Computational Chemistry 21(7): 509-514 (2000) |
| 1999 |
|---|
| 4 | EE | Stéphane Noury,
Xénophon Krokidis,
Franck Fuster,
Bernard Silvi:
Computational Tools for the Electron Localization Function Topological Analysis.
Computers & Chemistry 23(6): 597-604 (1999) |
| 3 | EE | Rosa Llusar,
Armando Beltrán,
Juan Andrés,
Stéphane Noury,
Bernard Silvi:
Topological analysis of electron density in depleted homopolar chemical bonds.
Journal of Computational Chemistry 20(14): 1517-1526 (1999) |
| 2 | EE | Isabelle Fourré,
Bernard Silvi,
Patrick Chaquin,
Alain Sevin:
Electron localization function comparative study of ground state, triplet state, radical anion, and cation in model carbonyl and imine compounds.
Journal of Computational Chemistry 20(9): 897-910 (1999) |
| 1998 |
|---|
| 1 | EE | Mohammad Esmaïl Alikhani,
Bernard Silvi:
DFT-predicted structural, vibrational, and bonding properties of XSiO and X2SiO (X=F, Cl, or Br) molecules.
Journal of Computational Chemistry 19(11): 1205-1214 (1998) |
