- idUS
- Listar por autor
Listar por autor "Guihéry, Nathalie"
Mostrando ítems 1-2 de 2
-
Artículo
Direct generation of local orbitals for multireference treatment and subsequent uses for the calculation of the correlation energy
Maynau, Daniel; Evangelisti, Stefano; Guihéry, Nathalie; Jiménez Calzado, Carmen; Malrieu, J.P. (American Institute of Physics Publising LLC, 2002)We present a method that uses the one-particle density matrix to generate directly localized orbitals dedicated to ...
-
Artículo
Physical analysis of the through-ligand long-distance magnetic coupling: Spin-polarization versus Anderson mechanism
Terencio, T.; Bastardis, R.; Suaud, N.; Maynau, Daniel; Bonvoisin, J.; Malrieu, J. P.; Jiménez Calzado, Carmen; Guihéry, Nathalie (Royal Society of Chemistry, 2011)The physical factors governing the magnetic coupling between two magnetic sites are analyzed and quantified as functions ...