| 2008 |
|---|
| 4 | EE | C. M. Zicovich-Wilson,
F. J. Torres,
Fabien Pascale,
L. Valenzano,
Roberto Orlando,
Roberto Dovesi:
Ab initio simulation of the IR spectra of pyrope, grossular, and andradite.
Journal of Computational Chemistry 29(13): 2268-2278 (2008) |
| 3 | EE | Mauro Ferrero,
Michel Rérat,
Roberto Orlando,
Roberto Dovesi:
The calculation of static polarizabilities of 1-3D periodic compounds. the implementation in the crystal code.
Journal of Computational Chemistry 29(9): 1450-1459 (2008) |
| 2004 |
|---|
| 2 | EE | Fabien Pascale,
C. M. Zicovich-Wilson,
F. López Gejo,
Bartolomeo Civalleri,
Roberto Orlando,
Roberto Dovesi:
The calculation of the vibrational frequencies of crystalline compounds and its implementation in the CRYSTAL code.
Journal of Computational Chemistry 25(6): 888-897 (2004) |
| 2003 |
|---|
| 1 | EE | Clovis Darrigan,
Michel Rérat,
Giuseppe Mallia,
Roberto Dovesi:
Implementation of the finite field perturbation method in the CRYSTAL program for calculating the dielectric constant of periodic systems.
Journal of Computational Chemistry 24(11): 1305-1312 (2003) |
