Physicochemical and biological analysis of river Yamuna at Palla station from 2009 to 2019.

Yamuna is one of the main tributaries of the river Ganga and passes through Delhi, the national capital of India. In the last few years, it is considered one of the most polluted rivers of India. We carried out the analysis for the physiochemical and biological conditions of the river Yamuna based on measurements acquired at Palla station, Delhi during 2009-19. For our analysis, we considered various physicochemical and biological parameters (Dissolved Oxygen (DO) Saturation, Biological Oxygen Demand (BOD), Chemical Oxygen Demand (COD), Total Alkalinity, Total Dissolved Solids (TDS), and Total Coliform. The water stats of river Yamuna at Palla station were matched with Water Standards of India, United Nations Economic Commission for Europe (UNECE), and World Health Organization (WHO). Maximum changes are observed in DO saturation and total coliform, while BOD and COD values are also seen higher than the upper limits. Total alkalinity rarely meets the minimum standards. TDS is found to be satisfactory as per the standard limit. The river quality falls under Class D or E (IS2296), Class III or IV (UNECE), and fails to fulfill WHO standards for water. After spending more than 130 million USD for the establishment of a large number of effluent treatment plants, sewage treatment plants, and common effluent treatment plants, increasing discharges of untreated sewage, partially treated industrial effluents and reduced discharge of freshwater from Hathnikund are causing deterioration in water quality and no major improvements are seen in water quality of river Yamuna.

Superparamagnetic and Perfect-Paramagnetic Zinc Ferrite Quantum Dots from Microwave-Assisted Tunable Synthesis.

The properties of quantum dot (QD)-size material depend directly upon its unit cell structure. Spinel zinc ferrite QD powder is produced via a one-pot microwave-assisted hydrothermal synthesis for just 5 min. Varying initial pH values of the preparation sol from 6 to 12 enlarges the Zn/Fe atomic ratio (by ca. 10%), unit cell volume (by ca. 0.5%), particle size (3.5-4.5 nm), and degree of inversion. This leads to a change in the magnetic behavior of the QD-size zinc ferrite from a superparamagnetic to a perfect-paramagnetic type. This novel finding points that the significant changes in the inherent structural parameters of spinel ZnFe2O4 QDs (Zn/Fe ratio and degree of inversion) induced by the systematic pH change of the preparation sol are exclusively responsible for the observed unique magnetic behavior instead of mere QD (single domain) nanosizes.

New 2D Structural Materials: Carbon-Gallium Nitride (CC-GaN) and Boron-Gallium Nitride (BN-GaN) Heterostructures-Materials Design Through Density Functional Theory.

New class of ternary nanohetrostructures have been proposed by mixing 2D gallium nitride (GaN) with graphene and 2D hexagonal boron nitride (BN) with an aim towards desgining innovative 2D materials for applications in electronics and other industries. The structural stability and electronic properties of these nanoheterostructures have been analyzed using first-principles based calculations done in the framework of density functional theory. Different structure patterns have been analyzed to identify the most stable structures. It is found to be more energetically favorable that the carbon atoms occupy the positions of the nitrogen atoms in a clustered pattern in CC-GaN heterostructures, whereas boron doping is preferred in the reverse order, where isolated BN and GaN layered configurations are preferred in BN-GaN heterostructures. These 2D nanoheterostructures are energetically favored materials with direct band gap and have potential application in nanoscale semiconducting and nanoscale optoelectronic devices.

Photocatalytic and photoelectrochemical water oxidation over metal-doped monoclinic BiVO(4) photoanodes.

The visible-light-induced water oxidation ability of metal-ion-doped BiVO(4) was investigated and of 12 metal ion dopants tested, only W and Mo dramatically enhanced the water photo-oxidation activity of bare BiVO(4); Mo had the highest improvement by a factor of about six. Thus, BiVO(4) and W- or Mo-doped (2 atom %) BiVO(4) photoanodes about 1 µm thick were fabricated onto transparent conducting substrate by a metal-organic decomposition/spin-coating method. Under simulated one sun (air mass 1.5G, 100 mW cm(-2)) and at 1.23 V versus a reversible hydrogen electrode, the highest photocurrent density (J(PH)) of about 2.38 mA cm(-2) was achieved for Mo doping followed by W doping (J(PH) ≈ 1.98 mA cm(-2)), whereas undoped BiVO(4) gave a J(PH) value of about 0.42 mA cm(-2). The photoelectrochemical water oxidation activity of W- and Mo-doped BiVO(4) photoanodes corresponded to the incident photon to current conversion efficiency of about 35 and 40 % respectively. Electrochemical impedance spectroscopy and Mott-Schottky analysis indicated a positive flat band shift of about 30 mV, a carrier concentration 1.6-2 times higher, and a charge-transfer resistance reduced by 3-4-fold for W- or Mo-doped BiVO(4) relative to undoped BiVO(4). Electronic structure calculations revealed that both W and Mo were shallow donors and Mo doping generated superior conductivity to W doping. The photo-oxidation activity of water on BiVO(4) photoanodes (undoped

Density functional study of 1D nanowire for biomedical applications.

The special properties of magnetic nanowires make them attractive for biological applications. We have considered a 1D monatomic infinite chain of transition elements as 1D nano-wire. We have calculated the electronic and magnetic properties of 1D monatomic chain of transition metal atoms like Ni and Co by using full-potential linear augmented plane-wave method.