Search results for "diatom"
showing 10 items of 156 documents
Collisional line broadening and line shifting in N2-CO2 mixture studied by inverse Raman spectroscopy
1990
Abstract Collisional effects in the Raman Q-branch of N 2 perturbed by CO 2 have been studied by high-resolution stimulated Raman spectroscopy. The Raman spectra recorded in the 0.3–1.0 atm and 295–1000 K pressure and temperature ranges are fitted with a theoretical profile taking into account line broadening, frequency shift and line mixing due to rotational energy transfers. The data at low density are used as basic data for the modeling of rotationally inelastic rates through sets of adjustable parameters. We have used in this study the two main models developed in the last decade and known as modified exponential gap (MEG) and energy corrected sudden (ECS) laws. Experimental spectra rec…
A MRCI PS and CASSCF study of the ground state MgO dissociation energy
1991
Abstract Ab initio calculations at CASSCF and MRCI PS levels are used to determine the dissociation energy for the X 1 Σ + state of MgO, which adiabatically dissociates to the ground state 1 S g of magnesium and to the excited 1 D g state of oxygen, as well as other spectroscopic parameters. Emphasis is placed upon the problem of properly selecting an adequate active space in CASSCF calculations and upon the improvements obtained in MRCI by selecting perturbatively the most important contributions to the total wavefunction and evaluating the remaining ones only by perturbational method. Through a procedure based on stabilizing the computed dissociation energy, values of 3.87 eV (MRCI PS) an…
A mutliconfigurational study of low-lying electronic states of KO
1992
Abstract Potential energy curves and spectroscopic parameters of several electronic states of the KO molecule have been calculated using multi-configurational methods. The KO B 2Π state, first time theoretically described, presents a strong avoided crossing with the A 2Π state, and allows for the explanation of the observed fluorescence of the KO molecule. Eleven electronic states have been studied at all the internuclear distances. Effects of complete active space and basis set selections on the results are also analyzed.
Theoretical spectroscopic parameters of the alkali monofluorides LiF, NaF and KF
1992
Abstract Multireference configuration interaction and second-order perturbation theory are used to determine accurate spectroscopic parameters for the ground state of the alkali monofluorides from LiF to KF. Systematic saturation of the spdf subspaces of the atomic basis sets for the electron affinity of fluorine and the ionization potential of the metals have been shown to be more efficient than for the approximate dissociation energies in the molecule. the calculated rotational and vibrational constants and transitions for the three systems show excellent agreement with the expeirmental data.
MCSCF determination of the KO molecule ground state.
1992
Abstract Ab initio calculations at the MC/CASSCF level are used to determine in an accurate way the nature and position of the ground state of the KO molecule. The characteristic 2 Π and 2 Σ + alkali monoxide ionic states show a theoretical energy separation of about 0.04 eV, which produces opposite results by authors in favour of one or the other symmetry. We test the basis set dependence and active space dependence of the calculated energetical ordering of both states, with an extensive study of the active orbitais selection; the results show a ground state of 2 Σ + symmetry.
Electrodes for REMPI spectroscopy in static gases and calculation of REMPI intensities: Application to molecular oxygen
1994
Resonance-enhanced multiphoton ionization (REMPI) of 16 O 2 X 3 Σ g − (ν = 0) through (3sσ g ) d'Π g (ν = 0) by using (2 + 1) one-colour photons is reported. This REMPI process, already observed and analysed by other authors at low pressure and low rotational temperature with mass spectrometry detection, is used to test our first detector of ionizations. Experimental difficulties have led to the design of an original arrangement of electrodes to collect electrons at room temperature and 1 Torr pressure of static molecular oxygen. A calculated spectrum is compared with the observed REMPI spectrum. The calculation uses the polarizability tensor and takes into account the competition between i…
Electric field induced alignment-orientation conversion in diatomic molecules: analysis and observation for NaK
1999
This article reports the observation of the molecular fluorescence circularity under irradiation with linearly polarised light. This alignment-orientation conversion phenomenon arises as a result of partial transformation from alignment of the ensemble of 1 P state molecular angular momenta into their orientation under the effect of non-linear dc Stark effect. Circularity rate up to 0.12 was observed in D 1 P! X 1 S fluorescence of 23 Na 39 K molecules in agreement with the theoretically predicted value.
Yeast β-glucans and microalgal extracts modulate the immune response and gut microbiome in Senegalese sole (Solea senegalensis)
2019
One bottleneck to sustainability of fish aquaculture is the control of infectious diseases. Current trends include the preventive application of immunostimulants and prebiotics such as polysaccharides. The present study investigated how yeast β-glucan (Y), microalgal polysaccharide-enriched extracts (MAe) and whole Phaeodactylum tricornutum cells (MA) modulated the gut microbiome and stimulated the immune system in Senegalese sole (Solea senegalensis) when administered by oral intubation. Blood, intestine and spleen samples were taken at 3 h, 24 h, 48 h and 7 days after treatment. The short-term response (within 48 h after treatment) consisted of up-regulation of il1b and irf7 expression in…
Periphyton growth and diatom community structure in a cooling water pond
1982
Periphyton (Aufwuchs) accumulation was measured on artificial substrates in a pond in central Finland which receives warm cooling-water effluent from a power plant. The growth of periphyton was generally more rapid on the substrates during the first two weeks of colonization near the inflow of the warm water effluent than in the middle of the pond. The maximum accumulation of periphyton was in spring and autumn (dry weight maximum at warm effluent was in spring 3.5 mg DW cm−2,2.65 mg AFDW cm−2; chlorophyll a maximum 3.96 µg cm−2 was found in autumn at pond-middle station). During mid-winter months the growth was strongly limited by solar radiation, but the growth was also slow at both stati…
Phytoplankton primary production in a eutrophic cooling water pond
1984
The seasonal variation of phytoplankton photosynthesis was measured with 14C-method in a warmed ice-free pond in central Finland. Simultaneously with in situ measurements the photosynthesis was also measured in an incubator with different water temperatures and constant light (ca. 16 W m−2). The total annual photosynthesis was 57.2 C m−2 a−1. The portion of the winter and spring production of the annual photosynthesis was 18.4%, that of the autumn production ws 17.4%. Thus 64.3% of the total annual phytoplankton photosynthesis occurred in the three summer months. The range of the daily integrated photosynthesis per unit area was 1.9—563 mg C m−2d−1. The photosynthetic rate per unit chloroph…