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Improvement of d–d interactions in density functional tight binding for transition metal ions with a ligand field model: assessment of a DFTB3+ U model on nickel coordination compounds
(Royal Society of Chemistry (RSC), 2020)
To improve the description of interactions among the localized d, f electrons in transition metals, we have introduced a ligand-field motivated contribution into the Density Functional Tight Binding (DFTB) model. Referred ...
Diversity and seasonal dynamics of culturable airborne fungi in a cultural heritage conservation facility
(Elsevier, 2021)
An extensive aeromycological survey was performed in the premises of a cultural heritage conservation facility to estimate fungal propagule concentrations in both indoor and outdoor air and seasonal dynamics with regard ...
Microbial bioremediation of the oil polluted environment and the sustainable development goals of pillar Planet of the Agenda 2030
(Srpinger Nature, 2024)
Sustainable development is a concept that is based on the development of the human society without compromising the natural resources, which should improve human lives and protect the environment for future generations. ...
An interlaboratory comparison of aerosol inorganic ion measurements by ion chromatography: implications for aerosol pH estimate
(Copernicus GmbH, 2020)
Water-soluble inorganic ions such as ammonium, nitrate and sulfate are major components of fine aerosols in the atmosphere and are widely used in the estimation of aerosol acidity. However, different experimental practices ...
Insight into the Origin of Pyrocatechol Inhibition on Oscillating Bray-Liebhafsky Reaction: Combined Experimental and Theoretical Study
(Chemical Society of Japan, 2020)
The pyrocatechol inhibitory effect on the oscillatory Bray-Liebhafsky (BL) reaction is reported. Obtained results are compared with those available in the literature (R. Cervellati et al, Helvetica Chimica Acta 2001) for ...
Real-Time AFM and Impedance Corrosion Monitoring of Environmentally Friendly Ceria Films on AA7075
(The Electrochemical Society, 2020)
Cerium-based conversion coatings have emerged as promising green alternatives to the harmful chromium-based ones, but the mechanism of corrosive protection still remains a subject of academic and industrial research. This ...
Study of the synergetic effect of co-pyrolysis of lignite and high-density polyethylene aiming to improve utilization of low-rank coal
(MDPI, 2021)
The mutual impact of low-quality lignite and high-density polyethylene (HDPE) during open system pyrolysis was investigated, aiming to improve utilization of lignite with simultaneous treatment of HDPE waste. Pyrolysis of ...
Aerogel Re/Pd-TiO2/SiO2 and Co/Mo-Al2O3/SiO2 catalysts for hydrodesulphurisation of dibenzothiophene and 4,6-dimethyldibenzothiophene
(Elsevier, 2021)
Re/Pd-TiO2/SiO2 and Co/Mo-Al2O3/SiO2 aerogel catalysts were synthesized using sol-gel method and supercritical drying in excess solvent, and investigated in the hydrodesulphurisation (HDS) of dibenzothiophene (DBT) and ...
Visible light promoted photoredox C(sp3)-H bond functionalization of tetrahydroisoquinolines in flow
(Royal Society of Chemistry, 2021)
A merger of organocatalysis and visible light photoredox catalysis performed in flow allowed access to a wide range of functionalizedN-aryl-substituted tetrahydroisoquinolines (THIQs) in a formal C-H oxidation/Mannich ...
Fatigue fracture analysis of helicopter landing gear cross tube
(Elsevier, 2021)
This paper presents the failure analysis results of the helicopter skid landing gear. The helicopter skid landing gear fractured while the helicopter was on the ground at the airport. The aft cross tube of the landing gear ...