This study reports the size‐resolved characterization of the chromophores in atmospheric particulate matter in Linfen, a typical coal‐burning city in China. The optical properties of both the water‐soluble and water‐insoluble chromophores in atmospheric particulates are studied using excitation‐emission matrix spectroscopy and follow the parallel factor analysis of excitation‐emission matrix data. The mass absorption efficiency and normalized fluorescence volume by mass concentration of the organic carbon in methanol‐soluble matter in the particulate samples are stronger than that of the water‐soluble matter. We found that the total absorption (Abs), fluorescence volume (FV), mass absorption efficiency, and normalized fluorescence volume of particle extracts with sizes less than 10 μm increased with the decreasing particle size. The total concentration of the selected seven polycyclic aromatic hydrocarbons was positively correlated with the Abs365 and FV of both the water‐soluble matter and methanol‐soluble matter, but the average contribution of the selected polycyclic aromatic hydrocarbons to the total Abs and FV was very small (<3%). This study is the first to report a size‐resolved characterization of the chromophores in atmospheric particulate matter. Humic‐like substances tend to be present in small particles, and tryptophan‐like and tyrosine‐like components tend to increase with increasing particle size.
The pressure fluctuations and runner loads on a pump-turbine runner during runaway process are very violent and the corresponding flow evolution is complicated. To study these phenomena and their correlations in depth, the runaway processes of a model pump-turbine at four guide vane openings (GVOs) were simulated by three-dimensional computational fluid dynamics (3D-CFD). The results show that the flow structures around runner inlet have regular development and transition patterns—the reverse flow occurs when the trajectory moves to the turbine-brake region and the main reverse velocity shifts locations among the hub side, the shroud side and the midspan as the trajectory comes forward and backward in the S-shape region. The locally distributed reverse flow vortex structures (RFVS) enhance the local rotor–stator interaction (RSI) and make the pressure fluctuations in vaneless space at the corresponding section stronger than at the rest sections along the spanwise direction. The transitions of RFVS, turning from the hub side to midspan, facilitate the inception and development of rotating stall, which propagates at approximately 45–72% of the runner rotation frequency. The evolving rotating stall induces asymmetrical pressure distribution on the runner blade, resulting in intensive fluctuations of runner torque and radial force. During the runaway process, the changing characteristics of the reactive axial force are dominated by the change rate of flow discharge, and the amplitude of low frequency component of axial force is in proportion to the amplitude of discharge change rate.
The properties of stratiform and the convective precipitation of tropical cyclones (TCs) over the northwest Pacific are examined using the Tropical Rainfall Measuring Mission data for 1998–2013. TCs are classified into inner core (IC), inner rainband (IB), and outer rainband (OB) regions, and the results show that TCs are dominated by stratiform precipitation, which accounts for more than 78% of the total raining area. The highest fraction of the stratiform raining area exists in the IB region and increases as the TC intensity increases (from 80% to 93%). Strong convective signatures generally occur in the IC region, less often in the IB region, and least often in the OB region. Stratiform precipitation in the IC region generally has comparable or even stronger ice scattering signatures and higher 20 dBZ radar echo heights than the convective precipitation in the IB and OB regions. Weak convection decreases significantly as the TC intensity increases, which leads to increased convective intensity. Stratiform (convective) precipitation accounts for 61% (39%) of the total TC volumetric rain and 25% (75%) of the total TC lightning flash, respectively. Moreover, stratiform precipitation's contribution to the total TC volumetric rain and lightning flash increases as the TC intensity increases, which indicates that stronger TCs are favorable for maintaining more stratiform precipitation. The stratiform and convective precipitation properties in different TC regions and intensities cooperatively change with the enhanced ascending branch in the IC region and the radial outflow at the upper levels of the secondary circulation.
The 1:1 benzofuran–formaldehyde complex has been chosen as model system for analyzing π→π* interactions in supramolecular organizations involving heteroaromatic rings and carbonyl groups. A joint “rotational spectroscopy–quantum chemistry” strategy unveiled the dominant role of π→π* interactions in tuning the intermolecular interactions of such adduct. The exploration of the intermolecular potential energy surface led to the identification of 14 low‐energy minima, with 4 stacked isomers being more stable than those linked by hydrogen bond or lone‐pair→π interactions. All energy minima are separated by loose transition states, thus suggesting an effective relaxation to the global minimum under the experimental conditions. This expectation has been confirmed by the experimental detection of only one species, which was unambiguously assigned owing to the computation of accurate spectroscopic parameters and the characterization of 11 isotopologues. The large number of isotopic species opened the way to the determination of the first semi‐experimental equilibrium structure for a molecular complex of such a dimension.
The
conformational isomerism of isopropylamine and n-propylamine
has been investigated by means of an integrated strategy combining
high-level quantum-chemical calculations and high-resolution rotational
spectroscopy. The equilibrium structures (and thus equilibrium rotational
constants) as well as relative energies of all conformers have been
computed using the so-called “cheap” composite scheme,
which combines the coupled-cluster methodology with second-order Møller–Plesset
perturbation theory for extrapolation to the complete basis set. Methods
rooted in the density functional theory have been instead employed
for computing spectroscopic parameters and for accounting for vibrational
effects. Guided by quantum-chemical predictions, the rotational spectra
of isopropylamine and n-propylamine have been investigated between
2 and 400 GHz with Fourier transform microwave and frequency-modulation
millimeter/submillimeter spectrometers. Spectral assignments confirmed
the presence of several conformers with comparable stability and pointed
out possible Coriolis resonance effects between some of them.
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