Electron Density In Region Research Articles

Dissolved organic matter-mediated adsorption behavior of benzophenones on functionalized covalent triazine frameworks

Adsorption is a highly efficacious technique for the remediation of organic micropollutants (OMPs). However, the presence of dissolved organic matter (DOM) frequently impedes adsorbent process, with insufficient attention given to this influence. This study systematically evaluates the adsorption performance of covalent triazine frameworks (CTFs) functionalized with electron-donating or electron-withdrawing groups for benzophenones (BPs). The adsorption capacities of SO3H-CTF, OH-CTF, and NH2-CTF for BPs were 512.11 μmol/g, 1356.27 μmol/g, and 1421.85 μmol/g, respectively. The adsorption mechanism is predominantly governed by π-π electron donor–acceptor (EDA) interactions, supplemented by hydrogen bonding, particularly in hydroxyl-containing BPs, with electrostatic interactions being relatively negligible. Functionalization with − OH and − NH2 groups increased the electron density in π-conjugated regions, enhancing BPs adsorption capacity, whereas − SO3H modification, due to its electron-withdrawing nature, acted as a π electron acceptor. Importantly, the mediating role of humic acid (HA) in the adsorption process was investigated. The CTF-BPs-HA ternary system can either inhibit/enhance π-π EDA interactions between π-electron donor/acceptor and BPs by adsorbing onto the CTF materials. The HA-mediated system primarily affects the film diffusion stage, with minimal impact on pore diffusion and inner surface adsorption. The oxygenated functional groups in HA slightly enhanced hydrogen bonding within the adsorption system, with negligible influence on electrostatic interactions. In the presence of HA, the overall adsorption capacity of SO3H-CTF decreased by 67.0 %, while that of OH-CTF and NH2-CTF increased by 120.9 % and 55.3 %, respectively. This study elucidates the electronic behavior modifications of functionalized CTFs during BPs adsorption and underscores the significant role of HA in interaction mechanisms, providing theoretical guidance for the design of advanced adsorbents to enhance pollutant removal efficiency.

Spectral behavior and expansion dynamics of Gd plasma generated by dual-pulse laser irradiation

Laser-produced gadolinium plasma (Gd-LPP) emerges as a promising candidate for next-generation nanolithography light sources. In this study, a dual laser pulse scheme was implemented to achieve a narrow spectral peak. By varying the pre-main pulse delay and pre-pulse laser energy, optimal conditions of 40 ns delay and 50 mJ energy were identified to improve spectral purity. Radiation hydrodynamics simulations revealed that the improved spectral purity stems from a flatter density gradient at the ablation front and a lower average electron density in the EUV emission region. Additionally, reheating the pre-formed plasma with a short main pulse mitigated plasma squeezing, resulting in an even lower electron density and thus improved spectral purity. Our findings suggest that spectral narrowing in the dual-pulse scheme, essential for better matching with multilayer reflection bandwidths, can be optimized through precise control of pre-pulse energy, pre-main delay, and main-pulse duration.

Electron Densities in H ii Regions from Observation of [N ii] 205 μm Fine Structure and Radio Recombination Lines

We employ observations of the 205 μm [N ii] fine structure (FS) line and radio recombination line (RRL) emission to derive the electron density in 10 well-known H ii regions. The combination of these two spectral lines (the RRL–FS line method) provides a sensitive probe of electron density in regions with n(e) ≥ 30 cm−3 without requiring knowledge of the size of the ionized region. By using H54α data from the Green Bank Telescope and 205 μm data from the SOFIA Airborne Observatory, we have almost identical 18″ beamwidths, removing a significant source of error for observations of H ii regions due to nonuniform density across the sources observed. The electron densities vary widely among the sources observed, from 2600 to 36,000 cm−3, with two low-density outliers at 94 and 520 cm−3. On average, these densities are a factor of 4 greater than the highest-resolution single-antenna data and a factor of almost 13 greater than the 182″ angular resolution single-antenna data having more sources in common. The total 1σ fractional uncertainties in n(e) are in the range 0.15–0.29. In the RRL–FS line method, the observationally determined quantity is proportional to ∫n 2(z)dz / ∫n(z)dz. For a Gaussian density distribution much more extended than its 1/e radius, this is equal to n0/2 , where n 0 is the peak electron density. The high values of electron density found are plausibly the result of the RRL–FS line technique sampling the peak of a centrally condensed density distribution.

Plasma discharge experiments of a Faraday shieldless driver for high-power and long-pulse radio frequency ion source for NBI application.

Due to the high stability and less maintenance, the radio frequency (RF) driven ion source is preferred for the neutral beam injection (NBI) system. In a popular design of the RF ion source for NBI application, a Faraday shield (FS) is installed inside the RF plasma driver to protect the discharge tube. However, the FS also brings some drawbacks, such as lowering the RF power transfer and increasing the processing difficulty. A prototype of the RF plasma driver without FS and with mature manufacturing technology has been developed by using a water-cooled discharge tube. After basic testing, this prototype was further tested under the RF plasma discharge experiments in views of high power, long pulse, and long term. The reliability and its plasma characteristics were the focus of these experiments, also for the hidden issues. The results show that the prototype could generate stable and high-density plasma without any damage or sputtering mark. An RF plasma discharge of 50 kW and 20s has been achieved. The expected frequency tuning was equally effective on the prototype. Moreover, compared to the RF plasma driver with FS, the prototype could produce higher electron density in the extraction region under the same RF power. Of course, some of the shortcomings of the prototype have also been exposed in the experiments and will be improved in subsequent experiments.

Synthesis, spectral characterization, anti-cancer activity evaluation, and molecular docking of substituted 1,2-bis(3-butyl-2,6-diphenylpiperidin-4-ylidiene)hydrazone derivatives

A series of 1,2-bis(3‑butyl‑2,6-diphenylpiperidin-4-ylidiene)hydrazone derivatives of the substituted compounds 1–7, were confirmed by the characterization of IR & 1H-, NMR spectrum, together with X-ray crystallography and Mass spectroscopy also incredibly revealed. Docking analysis of the synthesized compounds employed under the protein from PDB code as 5cqh1, 4i40, 5fan, 7nud, 6Ya1 offers more inhibition values from 2D and 3D structures of the compounds, followed by Anti-cancer activity of the carcinoma cell line displayed that, highly potent to be active in nature. The in-vitro performance of -Cl substituted compound 6 (high anticancer activity) was in good correlation with its protein binding behaviour (strong binding). The increasing order of anticancer effect was 5>7>1>2>4>3>6 and the increasing order of binding ability on proteins were 7>3>4>1>2>5>6. The computational investigations were aligned with experimental techniques using Density Functional Theory (DFT) with a 6–31 G (d, p) basis set. Calculated Highest Occupied Molecular Orbital (HOMO) and Lowest Unoccupied Molecular Orbital (LUMO) energies revealed Mulliken charges and charge transfer phenomena occurring within the molecule. Analysis of the Molecular Electrostatic Potential (MEP) unveiled reactive sites, with high electron density regions depicted in red and low electron density regions in blue.

The dominant roles of “electron-density-mechanism” and “chemical-bonding-mechanism” for hydrogen in molybdenum and lithium

Using first-principles calculations, we have systematically studied structures and thermodynamic stability of interstitial H as well as the H-vacancy interaction in molybdenum (Mo) and lithium (Li). Single H atom prefers to occupy tetrahedral interstitial position (TIP) and octahedral interstitial position (OIP) in Mo and Li, respectively, and the solution energies are 0.87 eV and −0.66 eV, respectively. In Mo, mono-vacancy can capture as many as seven H atoms and each H atom prefers to bind onto an isosurface of valence electron density. However, H atoms detach from vacancy to occupy the OIPs outside vacancy in Li. Based on these results, we reveal that the electron-density-mechanism (EDM) and chemical-bonding-mechanism (CBM) cause different properties of H in Mo and Li, respectively. In Mo, since the valence electron density everywhere in interstitial lattice is much high, H atom has to search a place where the valence electron density must be suitable. Accordingly, vacancy can provide an optimal valence electron density region for H dissolution, and the optimal valence electron density is 0.10 electron/Å3 at vacancy. In Li, H atom exhibits the negative solution energy in the interstitial lattice, which promotes H atom to form ionic bond with neighboring Li atom. H atoms do not combine inside vacancy but stay at the OIPs outside vacancy to form ionic bonds with neighboring Li atoms. We believe that the EDM and CBM can be generalized to other transition metals and other alkali metals, respectively.

Design of a low frequency, density profile reflectometer system for the MAST-U spherical tokamak.

Validated and accurate edge profiles (temperature, density, etc.) are vitally important to the Mega Ampere Spherical Tokamak Upgrade (MAST-U) divertor and confinement effort. Density profile reflectometry has the potential to significantly add to the measurement capabilities currently available on MAST-U (e.g., Thomson scattering and Langmuir probes). This work presents the diagnostic requirements, problems, and solutions facing profile reflectometry in spherical tokamaks and MAST-U in particular. Requirements include density measurements near zero electron density in the scrape off layer region, coverage for a broad range of MAST-U plasma parameters, high time (≤10microseconds) and spatial resolutions (≤1cm), reliability, and identification of the plasma start frequency.

Pyrazine-bridged polymetallic copper-iridium clusters.

Single crystals of the mol-ecular compound, {Cu20Ir6Cl8(C21H24N2)6(C4H4N2)3]·3.18CH3OH or [({Cu10Ir3}Cl4(IMes)3(pyrazine))2(pyrazine)]·3.18CH3OH [where IMes is 1,3-bis-(2,4,6-trimethylphen-yl)imidazol-2-yl-idene], with a unique heterometallic cluster have been prepared and the structure revealed using single-crystal X-ray diffraction. The mol-ecule is centrosymmetric with two {Cu10Ir3} cores bridged by a pyrazine ligand. The polymetallic cluster contains three stabilizing N-heterocyclic carbenes, four Cl ligands, and a non-bridging pyrazine ligand. Notably, the Cu-Ir core is arranged in an unusual shape containing 13 vertices, 22 faces, and 32 sides. The atoms within the trideca-metallic cluster are arranged in four planes, with 2, 4, 4, 3 metals in each plane. Ir atoms are present in alternate planes with an Ir atom featuring in the peripheral bimetallic plane, and two Ir atoms featuring on opposite sides of the non-adjacent tetra-metallic plane. The crystal contains two disordered methanol solvent mol-ecules with an additional region of non-modelled electron density corrected for using the SQUEEZE routine in PLATON [Spek (2015 ▸). Acta Cryst. C71, 9-18]. The given chemical formula and other crystal data do not take into account the unmodelled methanol solvent mol-ecule(s).

Using radio occultation-based electron density profiles for studying sporadic E layer spatial and temporal characteristics

An improved method for identifying sporadic E (Es) layer properties from radio occultation (RO) electron density profiles (EDPs) is presented. The data used are sourced from COSMIC-1 RO EDPs collected between 2006 and 2019, which cover altitudes from 75 to 145 km. Initially, we evaluate the reliability of EDPs using the International Reference Ionosphere 2016 (IRI-2016) model and select only those profiles with a reliability score of 0.6 or higher (on a scale up to 1) for further analysis. Preliminary Es layer inversion results are obtained and validated against electron density data derived from ionosonde fbEs measurements, demonstrating a linear correlation with a coefficient of 0.72 and a mean absolute percentage error of 36.08%. Further verification using RO S4max data shows that this research method achieved an accuracy of 85.3% in identifying Es events. We perform a detailed analysis of Es layer relative occurrence rates, intensity, and thickness. The Es intensity is expressed by NmμEs (the layer’s maximum electron density (Nm) corresponding to the metal (μ) ion), which is estimated from the measured layer peak electron density NmEs by subtracting the ambient E region electron density NeE(hEs) at the height of the layer’s peak hEs, computed from the IRI-2016 model. Our findings reveal that Es layers predominantly occur in mid-latitude regions during summer, with average intensities between 5×104and8×104el/cm3\\documentclass[12pt]{minimal} \\usepackage{amsmath} \\usepackage{wasysym} \\usepackage{amsfonts} \\usepackage{amssymb} \\usepackage{amsbsy} \\usepackage{mathrsfs} \\usepackage{upgreek} \\setlength{\\oddsidemargin}{-69pt} \\begin{document}$$5\ imes {10}^{4 }\ ext{ and }8\ imes {10}^{4 }\ ext{el}/{\ ext{cm}}^{3}$$\\end{document}. The most likely thickness of Es layers is approximately 1.4 km. Additionally, the present study shows that because NeE(hEs) increases during daytime, which leads to increases in NmEs, confirming that NmμEs is the proper parameter for assessing the Es layer intensity, in line with what is suggested by Haldoupis et al. (Haldoupis et al., J Atmos Sol Terr Phys 206:105327, 2020).Graphical

Observations and Numerical Simulations of the Effects of the Gamma Ray Burst 221009A on the Lower Ionosphere

AbstractThis paper investigates the impact of a powerful gamma ray burst (GRB) that occurred on 9 October 2022, on the Earth's environment using a very low frequency receiver (VLF) to probe the lower ionospheric region (the D region). In addition to the VLF data analysis, we employ numerical simulation through the Long Wavelength Propagation Capability code (LWPC) to derive the increase in the D− region electron density. Our results revealed discernible perturbations in amplitude and phase across all transmitter paths (NAA, DHO, ICV, and NSC) to the Algiers receiver persisting for 40 min. At the maximum of the signal perturbation, the LWPC simulation results showed a decrease in the mean new reference height h′ from 74 to 65.71 km, along with an increase in the sharpness factor β from 0.3 to 0.4875 km−1. Under these new conditions, the electron density increased from its ambient value (216.10 cm−3) to 33.7 103 cm−3.

Discharge mode and particle transport in radio frequency capacitively coupled Ar/O2 plasma discharges

Abstract Simulations are conducted on capacitively coupled Ar/O2 mixed gas discharges employing a one-dimensional fluid coupled with an electron Monte Carlo (MC) model. The research explores the impact of different O2 ratio and pressures on the discharge characteristics of Ar/O2 plasma. At a fixed Ar/O2 gas ratio, with the increasing pressure, higher ion densities, as well as a slight increase in electron density in the bulk region can be observed. The discharge remains dominated by the drift–ambipolar (DA) mode, and the flux of O(3P) at the electrode increases with the increasing pressure due to higher background gas density, while the fluxes of O(1D) and Ar* decrease due to the pronounced loss rate. With the increasing proportion of O2, a change in the dominant discharge mode from α mode to DA mode can be detected, and the O2-associated charged particle densities are significantly increased. However, Ar+ density shows a trend of increasing and then decreasing, while for neutral fluxes at the electrode, Ar* flux decreases, and O(3P) flux increases with the reduced Ar gas proportion, while trends in O(1D) flux show slight differences. The evolution of the densities of the charged particle and the neutral fluxes under different discharge parameters are discussed in detail using the ionization characteristics as well as the transport properties. Hopefully, more comprehensive understanding of Ar/O2 discharge characteristics in this work will provide a valuable reference for the industry.

Unveiling the Intermolecular Interactions between Drug 5-Fluorouracil and Watson-Crick/Hoogsteen Base Pairs: A Computational Analysis.

The adsorption of 5-fluorouracil (5FU) on Watson-Crick (WC) base pairs and Hoogsteen (HT) base pairs has been studied using the dispersion-corrected density functional theory (DFT). The adsorption, binding energy, and thermochemistry for the drug 5FU on the WC and HT base pairs were determined. The most stable geometries were near planar geometry, and 5FU has a higher preference for WC than HT base pairs. The adsorption energies of 5FU on nucleobase pairs are consistently higher than pristine nucleobase pairs, indicating that nucleobase pair cleavage is less likely during the adsorption of the 5FU drug. The enthalpy change for the formation of 5FU-DNA base pairs is higher than that for the formation of 5FU-nucleobases and is enthalpy-driven. The E gap of AT base pairs is higher, suggesting that their chemical reactivity toward further reaction would be less than that of GC base pairs. The electron density difference (EDD) analysis shows a significant decrease in electron density in aromatic regions on the purine bases (adenine/guanine) compared to the pyrimidine bases. The MESP diagram of the stable 5FU-nucleobase pair complexes shows a directional interaction, with the positive regions in a molecule interacting with the negative region of other molecules. The atoms in molecule analysis show that the ρ(r) values of C=O···H-N are higher than those of N···H/N-H···O. The N···H intermolecular bonds between the base pair/drug and nucleobases are weak, closed shell interactions and are electrostatic in nature. The noncovalent interaction analysis shows that several new spikes are engendered along with an increase in their strength, which indicates that the H-bonding interactions are stronger and play a dominant role in stabilizing the complexes. Energy decomposition analysis shows that the drug-nucleobase pair complex has a marginal increase in the electrostatic contributions compared to nucleobase pair complexes.

Visualizing the Internal Nanocrystallinity of Calcite Due to Nonclassical Crystallization by 3D Coherent X-Ray Diffraction Imaging.

The internal crystallinity of calcite is investigated for samples synthesized using two approaches: precipitation from solution and the ammonium carbonate diffusion method. Scanning electron microscopy (SEM) analyses reveal that the calcite products precipitated using both approaches have a well-defined rhombohedron shape, consistent with the euhedral crystal habit of the mineral. The internal structure of these calcite crystals is characterized using Bragg coherent diffraction imaging (BCDI) to determine the 3D electron density and the atomic displacement field. BCDI reconstructions for crystals synthesized using the ammonium carbonate diffusion approach have the expected euhedral shape, with internal strain fields and few internal defects. In contrast, the crystals synthesized by precipitation from solution have very complex external shapes and defective internal structures, presenting null electron density regions and pronounced displacement field distributions. These heterogeneities are interpreted as multiple crystalline domains, created by a nonclassical crystallization mechanism, where smaller nanoparticles coalescence into the final euhedral particles. The combined use of SEM, X-ray diffraction (XRD), and BCDI allows for structurally differentiating calcite crystals grown with different approaches, opening new opportunities to understand how grain boundaries and internal defects alter calcite reactivity.

Implicit particle-in-cell development for ion source plasmas

Particle-in-Cell (PIC) codes used to study plasma dynamics within ion sources typically use an explicit scheme. These methods can be slow when simulating regions of high electron density in ion sources, which require resolving the Debye length in space and the plasma frequency in time. Recent developments on fully-implicit PIC models in curvilinear geometries have shown that these spatial/time scales can be significantly decreased/increased respectively, allowing for notable speed-ups in simulation time, and thus making it a potential tool for studying the physics of ion sources. For this purpose, a charge and energy conserving implicit PIC code has been developed in 1D to determine its potential for simulating bounded plasmas. In this paper, we use this model to simulate a 1D benchmark of a bounded plasma with fixed plasma density and electron/ion temperatures. The results are shown to compare well to the benchmark and to the results using an explicit PIC code. It is shown that the total amount of macro-particles used in the simulation is a better figure of merit for accurate results than the standard particles per cell used in literature. Significant speed-ups in computation time can be achieved for high plasma densities if the accuracy requirements are relaxed. In this case, we demonstrate the ability of the implicit PIC code to speed-up simulation time by nearly a factor of 12 compared to explicit PIC.

A Simplified Method of True Height Analysis to Estimate the Real Height of Sporadic E Layers

AbstractThe sporadic E (Es) layer virtual height and the ordinary wave critical frequency are routinely measured ionogram parameters, used to characterize the Es altitude occurrence and intensity. It has become common practice to take the real height to be about equal to by assuming that signal propagation delays in the E region plasma below the layer are small and can be neglected. Although this applies for nighttime, during daytime it may overestimate significantly. The present paper relies on true height analysis theory to devise a simplified method and propose an algorithm that can estimate Es real heights reasonably well. The method relies on and ionosonde measurements and E region electron density profiles obtained from the International Reference Ionosphere model. The algorithm is applied to a typical set of Digisonde observations to compute and examine real height variations and functional dependencies. Whereas ≃ at nighttime, during daytime there are notable − differences taking values less than 10 km for most of the observed layers. During the early morning and early afternoon hours, however, when weak layers appear at upper heights, the virtual to real height differences become larger reaching 20–25 km. The method proposed here for the estimation of can be easily applied to improve the accuracy of the results of sporadic E layer studies.

Hybrid simulation of instabilities in capacitively coupled RF CF4/Ar plasmas driven by a dual frequency source

Instabilities in capacitively coupled Ar/CF4 plasma discharges driven by dual frequency sources are investigated using a one-dimensional fluid/electron Monte Carlo hybrid model. Periodic oscillations of the electron density and temperature on the timescale of multiple low frequency (LF) periods are observed. As the electron density increases, an intense oscillation of the electron temperature within each high frequency (HF) period is initiated. This causes a fluctuation of the electron density and results in a discharge instability. This phenomenon is consistent with the discharge behavior observed in scenarios with single-frequency (SF) sources, as reported by Dong et al (2022 Plasma Sources Sci. Technol. 31 025006). However, unlike the SF case, plasma parameters such as the electron density, electric field, electron power absorption and ionization rate exhibit not only periodic fluctuations but also a spatial asymmetry under the influence of the dual-frequency source. This spatial asymmetry leads to a non-uniform distribution of the electron density between the electrodes, which is related to a spatially asymmetric electric field, electron heating, and ionization around a region of minimum electron density (inside the bulk). This region of minimum electron density is shifted back and forth through the entire plasma bulk from one electrode to the other within multiple LF period. The above phenomena are related to superposition effect between the instabilities and the dual-frequency source. Moreover, the time averaged electric field influences the spatio-temporal evolution of ion fluxes. The ion fluxes at the electrodes, which play an important role in etching processes, are affected by both the high and LF components of the driving voltage waveform as well as the observed instabilities. As the HF increases, the electronegativity and electron temperature are reduced and the electron density increases, resulting in a gradual disappearance of the instabilities.

The influence of molecular shape and electronic properties on the formation of the ferroelectric nematic phase

ABSTRACT The synthesis and characterisation of two series of ferroelectric nematogens based on RM734 having an additional methoxy group on the central phenyl ring are reported, the 3-methoxy-4-((4-nitrophenoxy)carbonyl)phenyl 2-alkoxy-4-alkoxybenzoates (7-m-n) and the 3-methoxy-4-((3-fluoro-4-nitrophenoxy)carbonyl)phenyl 2-alkoxy-4-alkoxybenzoates (8-m-n). In order to compare the behaviour of these series to those of the corresponding materials that do not contain the methoxy group on the central phenyl ring, we also report the synthesis and characterisation of 4-[(4-nitrophenoxy)carbonyl]phenyl 4-methoxybenzoate (11-0-1), 4-[(3-fluoro-4-nitrophenoxy)carbonyl]phenyl 4-methoxybenzoate (12-0-1) and 4-[(3-fluoro-4-nitrophenoxy)carbonyl]phenyl 2,4-diethoxybenzoate (12-2-2). Two compounds in which a lateral ethoxy chain is attached to the central ring, 3-ethoxy-4-[(4-nitrophenoxy)carbonyl]phenyl 2,4-dimethoxybenzoate (18-2-1) and 3-ethoxy-4-[(3-fluoro-4-nitrophenoxy)carbonyl]phenyl 2,4-dimethoxybenzoate (19-2-1), are also described. The behaviour of these materials shows that the relative stabilities of the ferroelectric nematic, NF, and conventional nematic, N, phases are governed by a subtle interplay of steric and electronic factors. Furthermore, the electronic factors are better understood in terms of isolated regions of electron density rather than by a single large longitudinal dipole moment. In terms of molecular shape, to observe the NF phase it appears that the molecular structure must include one or more lateral substituents that enhance molecular biaxiality and destabilise the N phase.

Anion⋯anion self-assembly under the control of σ- and π-hole bonds.

The electrostatic attraction between charges of opposite signs and the repulsion between charges of the same sign are ubiquitous and influential phenomena in recognition and self-assembly processes. However, it has been recently revealed that specific attractive forces between ions with the same sign are relatively common. These forces can be strong enough to overcome the Coulomb repulsion between ions with the same sign, leading to the formation of stable anion⋯anion and cation⋯cation adducts. Hydroden bonds (HBs) are probably the best-known interaction that can effectively direct these counterintuitive assembly processes. In this review we discuss how σ-hole and π-hole bonds can break the paradigm of electrostatic repulsion between like-charges and effectively drive the self-assembly of anions into discrete as well as one-, two-, or three-dimensional adducts. σ-Hole and π-hole bonds are the attractive forces between regions of excess electron density in molecular entities (e.g., lone pairs or π bond orbitals) and regions of depleted electron density that are localized at the outer surface of bonded atoms opposite to the σ covalent bonds formed by atoms (σ-holes) and above and below the planar portions of molecular entities (π-holes). σ- and π-holes can be present on many different elements of the p and d block of the periodic table and the self-assembly processes driven by their presence can thus involve a wide diversity of mono- and di-anions. The formed homomeric and heteromeric adducts are typically stable in the solid phase and in polar solvents but metastable or unstable in the gas phase. The pivotal role of σ- and π-hole bonds in controlling anion⋯anion self-assembly is described in key biopharmacological systems and in molecular materials endowed with useful functional properties.

Are There Higher Electron Densities in Narrow Emission Line Regions of Type-1 AGNs than in Type-2 AGNs?

In the manuscript, we check properties of electron densities n e traced by flux ratio R sii of [S ii]λ6716 Å to [S ii]λ6731 Å in narrow emission line regions (NLRs) between Type-1 active galactic nucleus (AGN) and Type-2 AGN in SDSS Data Release 12 (DR12). Under the framework of unified model considering kiloparsec-scale structures, similar n e in NLRs should be expected between Type-1 AGN and Type-2 AGN. Based on reliable measurements of the [S ii] doublet with measured parameters at least 5 times larger than corresponding uncertainties, there are 6039 Type-1 AGN and 8725 Type-2 AGN (excluding the Type-2 LINERs and the composite galaxies) collected from SDSS DR12. Then, lower R sii (higher n e ) in NLRs can be well confirmed in Type-1 AGN than in Type-2 AGN, with the confidence level higher than 5σ, even after considering the necessary effects including effects of electron temperatures traced by [O iii]λ4364,4959,5007 Å on estimating n e in NLRs. Two probable methods are proposed to explain the higher n e in NLRs in Type-1 AGN. First, the higher n e in NLRs of Type-1 AGN could indicate longer time durations of AGN activities in Type-1 AGN than in Type-2 AGN, if AGN activities triggering galactic-scale outflows leading to more electrons injecting into NLRs were accepted to explain the higher n e in NLRs of Type-2 AGN than H ii galaxies. Second, the lower n e in NLRs of Type-2 AGN could be explained by stronger star-forming contributions in Type-2 AGN, considering lower n e in H ii regions. The results provide interesting challenges to the commonly and widely accepted unified model of AGN.

Local Time Variations of Ionospheric F Layer Radial Current in Response to Enhanced Solar Wind Input

AbstractUsing Challenging Minisatellite Payload and the Republic of China Satellite‐1 observations, the response of ionospheric radial current (IRC) in the F region to the enhancement of merging electric field (Em) at different magnetic local times (MLT) is investigated. Possible physical mechanisms are discussed in terms of neutral wind, conductivity, and prompt penetration electric field (PPEF). The disturbance IRC (ΔIRC) increases in the upward (downward) direction in the daytime (nighttime) within 3 hr after Em enhancement. However, disturbance zonal winds increase westward (eastward) at 12–18 MLT (00–06 MLT). The reduced F region electron density may help weaken IRC at 06–12 MLT and 18–24 MLT. This work indicates that the daytime eastward (nighttime westward) PPEF drives equatorward (poleward) Hall current (JH) at low latitudes, resulting in both upward (downward) ΔIRC and eastward (westward) plasma drift at the F region magnetic equator.