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Three novel polypyridyl‐Co(III)‐vitamin B6 complexes viz., [Co(CF3‐phtpy)(SBVB6)]Cl (Co1), [Co(anthracene‐tpy)(SBVB6)]Cl (Co2), [Co(NMe2‐phtpy)(SBVB6)]Cl (Co3), where 4’‐(4‐(trifluoromethyl)phenyl)‐2,2’:6’,2’’‐terpyridine=CF3‐phtpy, 4’‐(anthracen‐9‐yl)‐2,2’:6’,2’’‐terpyridine=anthracene‐tpy;, 4‐([2,2’:6’,2’’‐terpyridin]‐4’‐yl)‐N,N‐dimethylaniline=NMe2‐phtpy, (E)‐5‐(hydroxymethyl)‐4‐(((2‐hydroxyphenyl)imino)methyl)‐2‐methylpyridin‐3‐ol=H2SBVB6 were successfully developed for aPDT (antibacterial photodynamic therapy) applications. Co1–Co3 exhibited an intense absorption band at ca. 435–485 nm, which is attributed to ligand‐to‐metal charge transfer and was beneficial for antibacterial photodynamic therapy. The distorted octahedral geometry of the complexes with CoIIIN4O2 core was evident from the DFT study. The visible light absorption ability and good photo‐stability of Co1–Co3 made them good photosensitizers for aPDT. Co1–Co3 displayed significant antibacterial responses against gram‐positive (S. aureus) and gram‐negative (E. coli) bacteria upon light exposure (10 J cm−2, 400–700 nm) and showed MIC values between 0.01–0.005 μg mL−1. The aPDT activities of these complexes were due to their ability to damage bacterial cell membranes via ROS generation. Overall, this study shows the photo‐triggered ROS‐mediated bacteria‐killing potential of Co(III) complexes. [ABSTRACT FROM AUTHOR]

Co3Mo3N has been reported to have activity for the synthesis of ammonia surpassing that of industrial Fe catalysts under certain conditions. However, so far the research has largely focused on unsupported Co3Mo3N. We report a comprehensive study on the catalytic activity of Co3Mo3N when supported on two distinct MgO substrates. Our findings reveal that the method of MgO preparation plays a crucial role in influencing surface basicity. Remarkably, Co3Mo3N supported on single‐crystalline MgO demonstrates significantly enhanced catalytic activity, achieving a 162.0 mmol g−1metal h−1 rate. This surpasses the performance on commercial MgO support (41.2 mmol g−1metal h−1) and unsupported Co3Mo3N (15.0 mmol g−1metal h−1). While kinetic analyses show no substantial differences between the two supported catalysts, spectroscopic studies employing CO2 and N2 temperature‐programmed desorption (TPD) reveal a richer array of basic sites and adsorption/desorption phenomena on the single‐crystalline MgO support. These catalysts exhibit exceptional stability. The drastically reduced Co/Mo loading amounts in comparison to the bulk form, make the commercialization of Co3Mo3N catalysts more practical. [ABSTRACT FROM AUTHOR]

In this study, sugarcane bagasse (SB) was strategically subjected to a delignification process followed by the in situ growth of multi-layered molybdenum disulfide (MoS2) nanosheets with hexagonal phase (2H-phase) crystal structure via hydrothermal treatment. The MoS2 nanosheets underwent self-assembly to form nanoflower-like structures in the aligned cellulose inter-channels of delignified sugarcane bagasse (DSB), the mechanism of which was understood through FTIR and XPS spectroscopic studies. DSB, due to its porous morphology and abundant hydroxyl groups, shows remediation capabilities of methylene blue (MB) dye through physio-sorption but shows a low adsorption capacity of 80.21 mg/g. To improve the removal capacity, DSB after in situ growth of MoS2 (DSB-MoS2) shows enhanced dye degradation to 114.3 mg/g (in the dark) which further improved to 158.74 mg/g during photodegradation, due to catalytically active MoS2. Interestingly, DSB-MoS2 was capable of continuous dye degradation with recyclability for three cycles, reaching an efficiency of > 83%, along with a strong antibacterial response against Gram-positive Staphylococcus aureus (S.aureus) and Gram-negative Escherichia coli (E. coli). The present study introduces a unique strategy for the up-conversion of agricultural biomass into value-added bio-adsorbents, which can effectively and economically address the remediation of dyes with simultaneous microbial decontamination from polluted wastewater streams. [ABSTRACT FROM AUTHOR]

The events of hurricane seasons and the threat of terrorist attacks have made evacuation during disruptions a leading management issue. Transportation networks, which form the backbone of any emergency management plan, should be able to respond to disruptions by ensuring safe, organized and quick movement of people at the time of crisis. This work proposes two models to capture the highly uncertain and time-dependent nature of transportation systems in the face of an emergency. The first model addresses the location of safety shelters. It uses risk management tools, the classical facility location model and traffic assignment techniques with Wardrop’s principle to determine the optimal location of shelters. The second model deals with real time decision-making during evacuations. It incorporates a simulation algorithm with the successive shortest path algorithm to model evacuation. Detailed traffic information in the network can be obtained from this algorithm to facilitate the evacuation.

Herein, five novel polypyridyl-based Co(III) complexes of Schiff bases, viz., [Co(dpa)(L1)]Cl (1), [Co(dpa)(L2)]Cl (2), [Co(L3)(L2)]Cl (3), [Co(L3)(L1)]Cl (4), and [Co(L4)(L1)]Cl (5), where dpa (dipicolylamine) = bis(2-pyridylmethyl)amine; H2L1 = (E)-2-((2-hydroxybenzylidene)amino)phenol; H2L2 = (E)-5-(hydroxymethyl)-4-(((2-hydroxyphenyl)imino)methyl)-2-methylpyridin-3-ol; L3 = 4′-phenyl-2,2′:6′,2′′-terpyridine (ph-tpy); and L4 = 4′-ferrocenyl-2,2′:6′,2′′-terpyridine (Fc-tpy), were synthesized and characterized. Complexes 1, 3, and 4 were structurally characterized by single-crystal XRD, indicating an octahedral CoIIIN4O2 coordination core. The absorption bands of these complexes were observed in the visible range with a λmax at ∼430–485 nm. Complex 5 displayed an extra absorption band near 545 nm because of a ferrocene moiety. These absorptions in the visible region reflect the potential of the complexes to act as visible-light antimicrobial photodynamic therapy (aPDT) agents. All of these complexes showed reactive oxygen species (ROS)-mediated antibacterial effects against S. aureus (Gram-positive) and E. coli (Gram-negative bacteria) upon low-energy visible light (0.5 J cm−2, 400–700 nm) exposure. Additionally, 1–5 did not show any toxicity toward A549 (Human Lung adenocarcinoma) cells, reflecting their selective bacteria-killing abilities. [ABSTRACT FROM AUTHOR]