Collect. Czech. Chem. Commun. 1986, 51, 2057-2062
https://doi.org/10.1135/cccc19862057

Vibrational energies of H3+ and Li3+ based on the diatomics-in-molecules potentials

Jan Vojtíka, Vladimír Špirkoa and Per Jensenb

a The J. Heyrovský Institute of Physical Chemistry and Electrochemistry, Czechoslovak Academy of Sciences, 121 38 Prague 2, Czechoslovakia
b Department of Chemistry, Aarhus University, Langelandsgade 140, DK-8000 Aarhus C, Denmark

Individual author index pages


Other CCCC articles of these authors

  • Ota Bludský, Petr Nachtigall and Vladimír Špirko*
    Vibrational dynamics of adsorbed CO2: Separability of the CO2 asymmetric stretching mode
    2011, Vol. 76, Issue 6, pp. 669–682 [Abstract]
  • Vladimír Špirko*, Xiangzhu Li and Josef Paldus
    Potential energy curve of N2 revisited
    2011, Vol. 76, Issue 4, pp. 327–341 [Abstract]
  • Vladimír Špirko, Ota Bludský and Wolfgang P. Kraemer*
    Energies and Electric Dipole Moments of the Bound Vibrational States of HN2+ and DN2+
    2008, Vol. 73, Issue 6-7, pp. 873–897 [Abstract]
  • Vladimír Špirko
    Potential Energy Curve of N2 in Its Ground Electronic State
    2005, Vol. 70, Issue 6, pp. 731–739 [Abstract]
  • Veronika Horká, Svatopluk Civiš*, Vladimír Špirko and Kentarou Kawaguchi
    The Infrared Spectrum of CN in Its Ground Electronic State
    2004, Vol. 69, Issue 1, pp. 73–89 [Abstract]
  • Michal Juřek, Vladimír Špirko and Wolfgang P. Kraemer
    Expectation Values of Quasibound States: Nuclear Quadrupole Coupling Constants of BH in the X1 Σ+ and B1 Σ+ States
    1998, Vol. 63, Issue 9, pp. 1309–1320 [Abstract]
  • Jan Vojtík and Richard Kotal
    Convergence Properties of Quasiclassical Trajectory Calculations on Dynamics of Autoionization Event in He(23S)-D2 Penning Ionization
    1997, Vol. 62, Issue 2, pp. 154–171 [Abstract]
  • Andrzej J. Sadlej, Ota Bludský and Vladimír Špirko
    Vibrational Dynamics of the H2O . HF Complex. Potential Energy and Electric Dipole Moment Surfaces
    1993, Vol. 58, Issue 12, pp. 2813–2830 [Abstract]
  • Ladislav Češpiva, Vlasta Bonačič-Koutecký, Jaroslav Koutecký, Per Jensen, Vojtěch Hrouda, Petr Čársky, Vladimír Špirko and Pavel Hobza
    Ab initio Calculations of the Rotation-Vibration Spectrum of Na3+
    1993, Vol. 58, Issue 1, pp. 24–28 [Abstract]
  • Per Jensen
    The potential energy surface for the C3 molecule determined from experimental data. Evidence for a bent equilibrium structure
    1989, Vol. 54, Issue 5, pp. 1209–1218 [Abstract]
  • Rudolf Polák and Jan Vojtík
    Assessment of atoms-in-molecules approaches to the diatomic input data generation for the diatomics-in-molecules method
    1988, Vol. 53, Issue 10, pp. 2353–2365 [Abstract]
  • Per Jensen and Manfred Winnewisser
    Prediction of higher inversion energy levels for isocyanamide H2NNC
    1986, Vol. 51, Issue 7, pp. 1373–1381 [Abstract]
  • Jan Vojtík, Jiří Šavrda and Jiří Fišer
    Monte Carlo quasiclassical trajectory study of a 2D model of chemisorption of H2 on a metallic cluster surface
    1985, Vol. 50, Issue 9, pp. 2028–2040 [Abstract]
  • Vladimír Špirko, Svatopluk Civiš, Stanislav Beran, Petr Čársky and Jürgen Fabian
    Reduced double-minimum potential curves for XY3 pyramidal molecules
    1985, Vol. 50, Issue 7, pp. 1519–1536 [Abstract]
  • Jan Vojtík, Alena Krtková and Rudolf Polák
    Nonadiabatic coupling in the Li2-Li2+ system
    1985, Vol. 50, Issue 5, pp. 1010–1021 [Abstract]
  • Rudolf Polák and Jan Vojtík
    Case studies of some atoms-in-molecules formulations
    1983, Vol. 48, Issue 7, pp. 1799–1809 [Abstract]
  • Ivan Kozák, Vladimír Špirko and Petr Čársky
    Ab initio calculations of the ground state potential function of the hydroxyl anion by means of the many-body Rayleigh-Schrödinger perturbation theory
    1981, Vol. 46, Issue 11, pp. 2595–2599 [Abstract]