Publicaciones en las que colabora con MANUELA MERCHAN BONETE (17)

2005

  1. A theoretical study on the low-lying excited states of 2,2′:5′, 2″-terthiophene and 2,2′:5′,2″:5″,2‴- quaterthiophene

    ChemPhysChem, Vol. 6, Núm. 7, pp. 1357-1368

  2. Theoretical study of the electronic excited states of tetracyanoethylene and its radical anion

    ChemPhysChem, Vol. 6, Núm. 3, pp. 503-510

2003

  1. The Low-Lying Excited States of 2,2′-Bithiophene: A Theoretical Analysis

    ChemPhysChem, Vol. 4, Núm. 12, pp. 1308-1315

2002

  1. Electronic transitions in tetrathiafulvalene and its radical cation: A theoretical contribution

    Journal of Physical Chemistry A, Vol. 106, Núm. 4, pp. 631-640

2001

  1. Electronic spectra of 2,2′-bithiophene and 2,2′:5′,2″-terthiophene radical cations: A theoretical analysis

    Journal of Physical Chemistry A, Vol. 105, Núm. 42, pp. 9788-9794

2000

  1. A theoretical determination of the low-lying electronic states of the p- benzosemiquinone radical anion

    Journal of the American Chemical Society, Vol. 122, Núm. 25, pp. 6067-6077

1999

  1. Theoretical study of the electronic spectrum of p-benzoquinone

    Journal of Chemical Physics, Vol. 110, Núm. 19, pp. 9536-9546

1996

  1. A theoretical study of the electronic spectrum of terthiophene

    Chemical Physics Letters, Vol. 248, Núm. 5-6, pp. 321-328

1995

  1. A theoretical study of the electronic spectrum of biphenyl

    Chemical Physics Letters, Vol. 234, Núm. 4-6, pp. 373-381

  2. A theoretical study of the electronic spectrum of bithiophene

    The Journal of Chemical Physics, Vol. 102, Núm. 9, pp. 3580-3586

  3. The internal rotational barrier of biphenyl studied with multiconfigurational second-order perturbation theory (CASPT2)

    Theoretica Chimica Acta, Vol. 91, Núm. 1-2, pp. 17-29

  4. Theoretical study of the electronic spectra of the biphenyl cation and anion

    Journal of Physical Chemistry, Vol. 99, Núm. 41, pp. 14980-14987

1994

  1. A theoretical study of the electronic spectrum of naphthalene

    Chemical Physics, Vol. 179, Núm. 3, pp. 395-409

  2. Ground state free base porphin: C2v or D2h symmetry? A theoretical contribution

    Chemical Physics Letters, Vol. 221, Núm. 1-2, pp. 136-144

  3. Theoretical determination of the electronic spectrum of free base porphin

    Chemical Physics Letters, Vol. 226, Núm. 1-2, pp. 27-36

1987

  1. A Cl study of the CuCO and CuCO+ complexes

    The Journal of Chemical Physics, Vol. 87, Núm. 3, pp. 1690-1700

  2. Theoretical approach to the molecular conformation of nonfused biheterocycles. Bifurans and furylpyrroles

    Journal of Physical Chemistry, Vol. 91, Núm. 3, pp. 545-551