Publicaciones en las que colabora con JUAN JESÚS LÓPEZ GONZÁLEZ (15)

2006

  1. Theoretical, ab initio and DFT, study of the structure and vibrational analysis of Raman, IR and INS spectra of (CH3)3SiNCO

    Chemical Physics, Vol. 330, Núm. 1-2, pp. 26-42

2005

  1. Structural and vibrational study of isochroman

    Chemical Physics, Vol. 313, Núm. 1-3, pp. 279-291

2004

  1. Intermolecular charge transfer and hydrogen bonding in solid furan

    Journal of the American Chemical Society, Vol. 126, Núm. 46, pp. 15087-15095

2002

  1. A reinvestigation of the ν7 and ν10 modes of pyridazine on the basis of the inelastic neutron scattering spectrum analysis

    Chemical Physics Letters, Vol. 361, Núm. 5-6, pp. 483-491

2001

  1. Measurement and ab initio modeling of the inelastic neutron scattering of solid melamine: Evidence of the anisotropy in the external modes spectrum

    Chemical Physics, Vol. 266, Núm. 1, pp. 1-17

2000

  1. Vibrational analysis of the inelastic neutron scattering spectrum of pyridine

    Chemical Physics, Vol. 261, Núm. 1-2, pp. 239-247

1999

  1. A set of force constants common for SIH3-X molecules

    Journal of Molecular Structure

  2. Inelastic Neutron Scattering Spectrum and Quantum Mechanical Calculations on the Internal Vibrations of Pyrimidine

    Journal of Physical Chemistry A, Vol. 103, Núm. 29, pp. 5833-5840

1997

  1. Evaluation of ab initio calculations using INS. A test case: Azines

    Physica B: Condensed Matter, Vol. 241-243, pp. 247-254

  2. Symmetrised quantum-mechanical force-fields and INS spectra: S-triazine, trichloro-s-triazine and pyrazine

    Chemical Physics, Vol. 216, Núm. 3, pp. 323-335

  3. Test of vibrational eigenvectors from different ab initio levels for the pyrimidine molecule using inelastic neutron scattering

    Physica B: Condensed Matter, Vol. 241-243, pp. 475-477

  4. The force field of the triazinic ring C3N3

    Vibrational Spectroscopy, Vol. 13, Núm. 2, pp. 187-194

1996

  1. The force field of bromoform: A theoretical and experimental investigation

    Journal of Physical Chemistry, Vol. 100, Núm. 40, pp. 16058-16065

  2. Vibrational spectra of s-triazine and its halogenated derivatives. Harmonic scaled ab initio force fields for s-triazine, trifluoro-s-triazine and trichloro-s-triazine

    Journal of Molecular Structure, Vol. 376, Núm. 1-3, pp. 353-362

1995

  1. Vibrational analysis of the inelastic neutron scattering spectrum of s-triazine and trichloro-s-triazine

    Chemical Physics, Vol. 200, Núm. 3, pp. 395-403