Publicaciones en las que colabora con Jose Vicente Pitarch Ruiz (23)

2011

  1. Electronic spectrum of F2CO: Theoretical calculations of vertical excitation energies and intensities

    Theoretical Chemistry Accounts, Vol. 129, Núm. 1, pp. 53-61

2010

  1. A theoretical study of the rotational structure of the ε(0,0) band of NO

    International Journal of Quantum Chemistry, Vol. 110, Núm. 3, pp. 505-512

  2. High-Spin states in tetrahedral X4 Clusters (X = H, Li, Na, K)

    International Journal of Quantum Chemistry, Vol. 110, Núm. 4, pp. 874-884

2009

  1. Rydberg, valence and mixed states in the vertical spectrum of HF

    Chemical Physics Letters, Vol. 476, Núm. 4-6, pp. 151-156

  2. Theoretical study of spectral intensities of formaldehyde in the discrete and continuum regions.

    The journal of physical chemistry. A, Vol. 113, Núm. 25, pp. 7155-7160

2008

  1. Full configuration interaction calculation of BeH adiabatic states

    Journal of Chemical Physics, Vol. 129, Núm. 5

  2. Full configuration interaction calculation of the low lying valence and rydberg states of BeH

    Journal of Computational Chemistry, Vol. 29, Núm. 4, pp. 523-532

  3. Full configuration-lnteraction study on the tetrahedral Li cluster

    Journal of Chemical Theory and Computation, Vol. 4, Núm. 3, pp. 404-413

  4. Low-lying rydberg states of HCl

    Journal of Physical Chemistry A, Vol. 112, Núm. 14, pp. 3275-3280

  5. Theoretical study of the discrete and continuum spectrum of BeH

    Chemical Physics Letters, Vol. 462, Núm. 4-6, pp. 344-347

2007

  1. Excitation energies and photoabsorption oscillator strengths of the rydberg series in CF3Cl. A linear response and quantum defect study

    Journal of Physical Chemistry A, Vol. 111, Núm. 17, pp. 3321-3325

2006

  1. Lower Rydberg series of methane: A combined coupled cluster linear response and molecular quantum defect orbital calculation

    Journal of Chemical Physics, Vol. 124, Núm. 12

2005

  1. Multistate active spaces from local CAS-SCF molecular orbitals: The photodissociation of HFCO as an example

    Journal of Computational Chemistry, Vol. 26, Núm. 12, pp. 1254-1262

2004

  1. MRSDCI vertical excitation energies and MQDO intensities for electronic transitions to Rydberg states in H2S

    Journal of Physical Chemistry A, Vol. 108, Núm. 32, pp. 6724-6729

2003

  1. The vertical spectrum of H2CO revisited: (SC)2-CI and CC calculations

    Molecular Physics, Vol. 101, Núm. 3, pp. 483-494

  2. Vertical spectrum of the C2H2+ system. An open shell (SC)2-CAS-SDCI study

    Journal of Computational Chemistry, Vol. 24, Núm. 5, pp. 609-617

2002

  1. Reducing CAS-SDCI space. Using selected spaces in configuration interaction calculations in an efficient way

    Journal of Computational Chemistry, Vol. 23, Núm. 12, pp. 1157-1165

  2. Vertical excitation energies and ionization potentials of H2S. A size-consistent self-consistent singles and doubles configuration interaction (SC)2-MR-SDCI calculation

    Journal of Physical Chemistry A, Vol. 106, Núm. 27, pp. 6508-6514

2001

  1. Excitation energies and molecular quantum defect orbital transition intensities for Rydberg states of ArH

    Journal of Physical Chemistry A, Vol. 105, Núm. 42, pp. 9637-9642

  2. The effect of correcting the size-extensivity error in singles and doubles configuration interaction excitation energies

    Journal of Molecular Structure: THEOCHEM, Vol. 537, Núm. 1, pp. 79-87