| 1 |
Dipole moment of nonrigid molecular systems: The dipole moment of hydrochloric dimers
Naaman R, Vager Z
Journal of Chemical Physics, 110(1), 359, 1999 |
| 2 |
Ab initio calculations on uracil-water
van Mourik T, Price SL, Clary DC
Journal of Physical Chemistry A, 103(11), 1611, 1999 |
| 3 |
Theoretical study of the effect of a Lewis acid on hydrogen exchange coupling in a trihydride metallocene : The Cp2NbH3.AlH3 system
Camanyes S, Maseras F, Moreno M, Lledos A, Lluch JM, Bertran J
Inorganic Chemistry, 37(10), 2334, 1998 |
| 4 |
A theoretical study of the isotope effects on the fluorescence excitation spectrum of 5-aminotropolone
Paz JJ, Moreno M, Lluch JM
Journal of Chemical Physics, 108(19), 8114, 1998 |
| 5 |
The generator coordinate method for a reaction coordinate coupled to a harmonic oscillator bath
Cruz FFDS, Ruzzi M, Schmidt ACK
Journal of Chemical Physics, 109(10), 4028, 1998 |
| 6 |
Effect of large-amplitude vibrations on the thermodynamics of malondialdehyde
Nino A, Munoz-Caro C
Journal of Physical Chemistry A, 102(7), 1177, 1998 |
| 7 |
Density functional theory calculations on hydrogen-bonded Tropolone-(H2O)(2) clusters
Mo O, Yanez M
Journal of Physical Chemistry A, 102(42), 8174, 1998 |
| 8 |
Simulations of H2O solid, liquid, and clusters, with an emphasis on ferroelectric ordering transition in hexagonal ice
Buch V, Sandler P, Sadlej J
Journal of Physical Chemistry B, 102(44), 8641, 1998 |
| 9 |
Synthesis and Spectroscopic Properties of Dihydrogen Isocyanide Niobocene (Nb(Eta(5)-C5H4Sime3)(2)(Eta(2)-H-2)(CNR))(+) Complexes - Experimental and Theoretical-Study of the Blocked Rotation of a Coordinated Dihydrogen
Antinolo A, Carrillohermosilla F, Fajardo M, Garciayuste S, Otero A, Camanyes S, Maseras F, Moreno M, Lledos A, Lluch JM
Journal of the American Chemical Society, 119(26), 6107, 1997 |
| 10 |
Hydrogen-Transfer in Vibrationally Relaxing Benzoic-Acid Dimers - Time-Dependent Density-Matrix Dynamics and Infrared-Spectra
Scheurer C, Saalfrank P
Journal of Chemical Physics, 104(8), 2869, 1996 |
