The B̃-X̃ laser-induced-fluorescence spectrum of jet-cooled isopropoxy radical (i-C3H7O[middle dot]) has been recorded. Using an isolated state model the observed rotational and fine structure of the origin band has been well simulated to determine rotational constants for both the X̃ and B̃ states and the electron spin-rotation constants of the X̃ state. The line intensities are well simulated with...

Three electronic absorption systems for C5 at 511, 445, and 232 nm and one for C6, C8, and C9 centered at 228, 259, and 288 nm have been observed in the gas phase. The C5 chain was produced in both discharge and ablation sources and detected using resonant two-color two-photon ionization spectroscopy involving 10.5 eV photons. The decay of the excited singlet electronic states indicates fast in...

Two-dimensional Fourier transform electronic spectra were recorded for the LH3 light harvesting complex. The spectra reveal the weak coupling between B800 molecules, the ultrafast dynamics within B820 and energy flow from B800 to B850.

Metal complexes of 5-carboxy-2-thiouracil with Mn(ll), Co(ll), Ni(ll), Cu(ll), Zn(ll) and Cd(ll) ions were synthesized, characterized, and subjected to a screening system for evaluation of antitumour activity against Sarcoma-180 (S-180) tumour cells. The complexes were characterized by elemental analysis, infrared, electronic spectra, room temperature magnetic measurements and powder X-ray diff...

The character of the electronic transitions in the ultraviolet-visible-near infrared (UV-vis-NIR) spectra of platinum-bis(alkynyl) bridged, bis-triarylamine mixed-valence systems trans-[Pt(C≡CC6H4NAr2)2 (PR3)2](n+) (R = ethyl, Ar = C6H4CH3-4 (1) or C6H4OCH3-4 (2); R = Ph, Ar = C6H4CH3-4 (3) or C6H4OCH3-4 (4), n = 0, 1, 2) has been determined from a combination of spectroscopic measurement and d...

Five new homoleptic [NiX(4)](2-) compounds have been prepared with the fluorinated ligands OC(6)F(5) (OAr(F)), OC(6)H(3)(CF(3))(2) (OAr'), and OC(4)F(9) (OR(F)) and characterized with X-ray crystallography, magnetic susceptibility, and elemental analysis. Electronic spectral studies show that these ligands engender a ligand-field environment similar to that of fluoride and thus act electronical...

In this paper we explore the use of the novel relativistic intermediate Hamiltonian Fock-space coupled-cluster method in the calculation of the electronic spectrum for small actinyl ions (NpO2+, NpO2(2+), and PuO2(2+)). It is established that the method, in combination with uncontracted double-zeta quality basis sets, yields excitation energies in good agreement with experimental values, and be...

The observation of long-lived electronic quantum coherence in a photosynthetic light harvesting system [Engel et al. Nature 2007, 446, 782] has led to much effort being devoted to elucidation of the quantum mechanisms of the photosynthetic excitation energy transfer. In this paper we examine the question of whether the decay of the coherent beating signal is due to quantum mechanical decoherenc...

The Hilbert-Huang transform is applied to analyze single-particle Lagrangian velocity data from numerical simulations of hydrodynamic turbulence. The velocity trajectory is described in terms of a set of intrinsic mode functions C(i)(t) and of their instantaneous frequency ω(i)(t). On the basis of this decomposition we define the ω-conditioned statistical moments of the C(i) modes, named q-orde...