| 1 |
Segmented all-electron Gaussian basis sets of double and triple zeta qualities for Fr, Ra, and Ac
Campos CT, de Oliveira AZ, Ferreira IB, Jorge FE, Martins LSC
Chemical Physics Letters, 675, 1, 2017 |
| 2 |
All-electron double zeta basis sets for the lanthanides: Application in atomic and molecular property calculations
Jorge FE, Martins LSC, Franco ML
Chemical Physics Letters, 643, 84, 2016 |
| 3 |
All-electron double zeta basis sets for the most fifth-row atoms: Application in DFT spectroscopic constant calculations
Neto AC, Jorge FE
Chemical Physics Letters, 582, 158, 2013 |
| 4 |
GAUSSIAN basis set of sextuple zeta quality for hydrogen through argon
Campos CT, Ceolin GA, Neto AC, Jorge FE, Pansini FNN
Chemical Physics Letters, 516(4-6), 125, 2011 |
| 5 |
Basis set convergence on optical rotation DFT calculations
Campos CT, Jorge FE, Silva TP, Coppo MR
Chemical Physics Letters, 494(4-6), 170, 2010 |
| 6 |
Augmented Gaussian basis set of quintuple zeta valence quality for H and from Li to Ar: Applications in DFT calculations of molecular electric properties
de Oliveira PJP, Jorge FE
Chemical Physics Letters, 463(1-3), 235, 2008 |
| 7 |
Gaussian basis sets of 5 zeta valence quality for correlated wave functions
Jorge FE, Sagrillo PS, de Oliveira AR
Chemical Physics Letters, 432(4-6), 558, 2006 |
| 8 |
On the origin of optical activity in tris-diamine complexes of Co(III) and Rh(III): A simple model based on time-dependent density function theory
Jorge FE, Autschbach J, Ziegler T
Journal of the American Chemical Society, 127(3), 975, 2005 |
| 9 |
Density functional calculations on electronic circular dichroism spectra of chiral transition metal complexes
Autschbach J, Jorge FE, Zlegler T
Inorganic Chemistry, 42(9), 2867, 2003 |
| 10 |
On the origin of the optical activity in the d-d transition region of tris-bidentate Co(III) and Rh(III) complexes
Jorge FE, Autschbach J, Ziegler T
Inorganic Chemistry, 42(26), 8902, 2003 |
