| 1 |
Monte Carlo-Quantum Mechanics Study of Magnetic Properties of Hydrogen Peroxide in Liquid Water
Caputo MC, Provasi PF, Benitez L, Georg HC, Canuto S, Coutinho K
Journal of Physical Chemistry A, 118(32), 6239, 2014 |
| 2 |
NMR Chemical Shielding and Spin-Spin Coupling Constants of Liquid NH3: A Systematic Investigation using the Sequential QM/MM Method
Gester RM, Georg HC, Canuto S, Caputo MC, Provasi PF
Journal of Physical Chemistry A, 113(52), 14936, 2009 |
| 3 |
Sum rules for invariance of the fourth-rank hypermagnetisability in a gauge translation
Pagola GI, Caputo MC, Ferraro MB, Lazzeretti P
Chemical Physics Letters, 408(4-6), 403, 2005 |
| 4 |
Effects of strong magnetic fields on the electron distribution and magnetisability of rare gas atoms
Pagola GI, Caputo MC, Ferraro MB, Lazzeretti P
Chemical Physics Letters, 400(1-3), 133, 2004 |
| 5 |
Calculation of the fourth-rank molecular hypermagnetizability of some small molecules
Pagola GI, Caputo MC, Ferraro MB, Lazzeretti P
Journal of Chemical Physics, 120(20), 9556, 2004 |
| 6 |
Calculation of third-rank molecular hypermagnetizabilities by continuous transformation of the origin of the current density
Caputo MC, Lazzeretti P
Journal of Chemical Physics, 116(22), 9611, 2002 |
| 7 |
On the theoretical determination of the static dipole polarizability of intermediate size silicon clusters
Bazterra VE, Caputo MC, Ferraro MB, Fuentealba P
Journal of Chemical Physics, 117(24), 11158, 2002 |
| 8 |
Resolution of molecular polarizabilities of CH3-X and CH3-CH2-X derivatives into atomic terms
Zitto ME, Caputo MC, Ferraro MB, Lazzeretti P
Journal of Chemical Physics, 114(9), 4053, 2001 |
| 9 |
Modeling NMR chemical shifts: crystal potential derived point charge (CPPCh) model to calculate solid state effects on 31P chemical shifts tensors
Schneider DM, Caputo MC, Ferraro MB, Facelli JC
International Journal of Molecular Sciences, 1(4), 75, 2000 |
| 10 |
Shielding polarizabilities via continuous transformation of the origin of the current density in the set of small molecules: H2O2, F-2, H2C2, H2CO, NH3, HCN, and HNC
Caputo MC, Ferraro MB, Lazzeretti P
Journal of Chemical Physics, 112(14), 6141, 2000 |
