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81.
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Robert Bukowski Bogumi Jeziorski Robert Moszyski Wodzimierz Koos 《International journal of quantum chemistry》1992,42(2):287-319
A variational method is used to evaluate Bethe logarithm for the ground electronic state of the hydrogen molecular ion. The trial function employed in the calculations analytically represents the singular behavior of the exact solution of the variational problem for high virtual photon energies. This ensures that the accuracy of six significant figures can be obtained with basis sets not exceeding 70 functions. For the equilibrium internuclear separation of 2.0 bohr, the calculated value of the Bethe logarithm, equal to 2.31936, lies outside the bounds 2.35 and 2.56, representing the best previous estimation of this quantity. The accurate values of the Bethe logarithm for internuclear separations ranging from 0.6 to 6.0 bohr are tabulated and used to calculate the radiative corrections to the rovibrational energy levels of H2+, HD+, and D2+. The influence of these corrections on the transition and dissociation energies is also examined. 相似文献
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85.
Jacek Goc Alina Dudkowiak Zygmunt Gryczyński Ignacy Gryczyński Bogumil Zelent Danuta Frąckowiak 《Journal of fluorescence》2001,11(1):53-63
Polarized absorption and fluorescence spectra of bacteriochlorophyll c and green photosynthetic bacterium Prostheecochloris aestuarii cells and cell fragments embedded in stretched polymer film were measured. In pigment samples the artificial oligomers of bacteriochlorophyll c (with absorption about 750 nm) and other forms of this pigment and bacteriopheophytin (with absorption at 670 nm) were present. In bacteria samples, embedded in polymer, oligomers were in high degree disaggregated and as a result the absorption about 670 nm was observed. Previously for similar sets of samples the decay of fluorescence excited only at one wavelength was analyzed on three exponential components, but exact lifetime values of these components for various samples were different. The aim of present paper was to check if these differences occur because of various contributions to decay from three well defined forms or if they were related to the existence of several pigment forms with slightly different lifetimes. The global analysis of data obtained for various excitation and observation wavelengths of fluorescence were done. From this analysis it follows that the second situation occurs. For a model system containing artificial oligomers the largest component of decay has a 4 of about 0.183 ns or 0.136 ns depending on observation wavelength. For the bacteria sample, in which the emission at 680 nm is the superposition from various pigments, global analysis done for various excitation wavelengths shows also that the values differ depending on the regions of fluorescence observation. From polarized spectra, it follows that in the model system the pigments absorbing at 670 nm are randomly distributed whereas oligomers are highly oriented. In bacteria fragments absorbing at 670 nm pigment molecules can be divided into two groups: one oriented along the axis of film stretching and the second practically randomly distributed. In living organisms, under some conditions, small amount of 670 nm pigments can be present and can work as excitation energy traps or as antenna transferring the excitation. Present results show that the role of various pools of 670 nm absorbing pigments can be different because of their differing orientation. 相似文献
86.
Bogumil Eugene Brycki Adrianna Szulc Iwona Kowalczyk Anna Kozirg Ewelina Sobolewska 《Molecules (Basel, Switzerland)》2021,26(19)
Due to their large possibility of the structure modification, alkylammonium gemini surfactants are a rapidly growing class of compounds. They exhibit significant surface, aggregation and antimicrobial properties. Due to the fact that, in order to achieve the desired utility effect, the minimal concentration of compounds are used, they are in line with the principle of greenolution (green evolution) in chemistry. In this study, we present innovative synthesis of the homologous series of gemini surfactants modified at the spacer by the ether group, i.e., 3-oxa-1,5-pentane-bis(N-alkyl-N,N-dimethylammonium bromides). The critical micelle concentrations were determined. The minimal inhibitory concentrations of the synthesized compounds were determined against bacteria Escherichia coli ATCC 10536 and Staphylococcus aureus ATCC 6538; yeast Candida albicans ATCC 10231; and molds Aspergillus niger ATCC 16401 and Penicillium chrysogenum ATCC 60739. We also investigated the relationship between antimicrobial activity and alkyl chain length or the nature of the spacer. The obtained results indicate that the synthesized compounds are effective microbicides with a broad spectrum of biocidal activity. 相似文献