Collect. Czech. Chem. Commun. 1975, 40, 1112-1118
https://doi.org/10.1135/cccc19751112

Calculation of the least energy path on the energy hypersurface

J. Pancíř

Individual author index pages


Other CCCC articles of these authors

  • Hanspeter Huber, J. Pancíř and P. Čársky
    Effective search for minima on the ab initio SCF energy hypersurfaces
    1977, Vol. 42, Issue 9, pp. 2767–2771 [Abstract]
  • J. Pancíř and R. Zahradník
    Theoretical study of physical properties of activated complexes and metastable intermediates
    1977, Vol. 42, Issue 7, pp. 2054–2059 [Abstract]
  • J. Pancíř
    Formaldehyde-hydroxycarbene rearrangement
    1977, Vol. 42, Issue 1, pp. 16–27 [Abstract]
  • J. Pancíř
    Equilibrium geometry and vibrational characteristics computations by semiempirical methods
    1975, Vol. 40, Issue 9, pp. 2726–2732 [Abstract]
  • J. Pancíř and J. Kopecký
    Properties of pyridine N-oxide in excited states. A model study of microsomal hydroxylations
    1974, Vol. 39, Issue 12, pp. 3608–3612 [Abstract]
  • J. Pancíř, I. Matoušek and R. Zahradník
    A critical reexamination of semiempirical parameters used in π-electronic methods of the PPP-type
    1973, Vol. 38, Issue 10, pp. 3039–3066 [Abstract]
  • V. Rejholec, J. Pancíř, P. Čársky and R. Zahradník
    Electronic spectra and semiempirical calculations on dinegative ions of acenaphthylene, fluoranthene and aceheptylene
    1972, Vol. 37, Issue 6, pp. 1978–1982 [Abstract]
  • R. Zahradník, I. Tesařová and J. Pancíř
    Experimental and theoretical (HMO and LCI-SCF) study of singlet-triplet transitions in conjugated hydrocarbons and their derivatives
    1971, Vol. 36, Issue 8, pp. 2867–2880 [Abstract]
  • R. Zahradník, J. Pancíř and A. Kröhn
    Electronic structure of non-alternant hydrocarbons, their analogues and derivatives. XIX. A note on the electronic spectra of the fluorenylium cation and its benzo derivatives
    1969, Vol. 34, Issue 9, pp. 2831–2832 [Abstract]
  • R. Zahradník, A. Kröhn, J. Pancíř and J. Šnobl
    Physical properties and chemical reactivity of alternant hydrocarbons and related compounds. XVIII. Electronic spectra of arylmethyl cations
    1969, Vol. 34, Issue 9, pp. 2553–2567 [Abstract]
  • R. Zahradník, J. Michl and J. Pancíř
    Electronic structure of non-alternant hydrocarbons, their analogues and derivatives. III. Ions of the polyenylcyclopentadienyl type
    1965, Vol. 30, Issue 9, pp. 2891–2899 [Abstract]