Collect. Czech. Chem. Commun. 1984, 49, 1731-1735
https://doi.org/10.1135/cccc19841731

Study of potential curves by UHF type methods. Inversion and dissociation of NH3 molecule

Viliam Klimo and Jozef Tiňo

Polymer Institute, Center of Chemical Research, Slovak Academy of Sciences, 842 36 Bratislava

Individual author index pages


Other CCCC articles of these authors

  • Martina Bittererová, Stanislav Biskupič, Hans Lischka and Viliam Klimo
    Ab initio Study of the Potential Curves for CO (X1Σ+), CH (X2Π) and OH (X2Π)
    1994, Vol. 59, Issue 6, pp. 1241–1250 [Abstract]
  • Viliam Klimo, Martina Bittererová, Stanislav Biskupič, Ján Urban and Miroslav Micov
    Temperature Dependences in the O + OH → O2 + H Reaction. Quasiclassical Trajectory Calculation
    1993, Vol. 58, Issue 2, pp. 234–243 [Abstract]
  • Ján Urban, Viliam Klimo and Jozef Tiňo
    Quasiclassical trajectory study of the CH2 + O2 reaction
    1987, Vol. 52, Issue 2, pp. 535–540 [Abstract]
  • Viliam Klimo and Jozef Tiňo
    Study of potential curves by UHF type methods. CH4 molecule and its dissociation products
    1986, Vol. 51, Issue 4, pp. 731–737 [Abstract]
  • Josef Bartoš and Jozef Tiňo
    A study of the mechanism of decay of alkyl macroradicals in isotactic polypropylene
    1985, Vol. 50, Issue 6, pp. 1391–1401 [Abstract]
  • Viliam Klimo and Jozef Tiňo
    Study of potential curves by UHF-type methods. Linearized coupled cluster methods with double substitution
    1985, Vol. 50, Issue 5, pp. 995–1000 [Abstract]
  • Ján Urban, Viliam Klimo and Jozef Tiňo
    Quantum chemical modelling of reactions in hydrocarbon combustion. Study of the CH4 + O2 reactions
    1984, Vol. 49, Issue 6, pp. 1440–1447 [Abstract]
  • Ján Urban, Viliam Klimo and Jozef Tiňo
    Quantum chemical modelling of the reactions participating in hydrocarbon combustion. Production of the H atoms
    1984, Vol. 49, Issue 6, pp. 1432–1439 [Abstract]
  • Viliam Klimo and Jozef Tiňo
    Study of potential curves by UHF-type methods. Homonuclear diatomics of second row atoms
    1981, Vol. 46, Issue 13, pp. 3171–3178 [Abstract]
  • Viliam Klimo and Jozef Tiňo
    Study of potential curves by UHF type methods. Potential curve of F2 molecule
    1981, Vol. 46, Issue 6, pp. 1365–1369 [Abstract]
  • Jozef Tiňo, Viliam Klimo and Michael M. Mestechkin
    A simple way of calculation of spin densities from RHF wave function
    1980, Vol. 45, Issue 12, pp. 3283–3286 [Abstract]
  • Jozef Tiňo, Wilfried Kühnel and Viliam Klimo
    Problem of spin contamination and basis set in ab initio UHF spin density calulations
    1978, Vol. 43, Issue 1, pp. 30–36 [Abstract]