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1.
  • Stanaway, Jeffrey D., et al. (författare)
  • Global, regional, and national comparative risk assessment of 84 behavioural, environmental and occupational, and metabolic risks or clusters of risks for 195 countries and territories, 1990-2017: A systematic analysis for the Global Burden of Disease Study 2017
  • 2018
  • Ingår i: The Lancet. - 1474-547X .- 0140-6736. ; 392:10159, s. 1923-1994
  • Tidskriftsartikel (refereegranskat)abstract
    • Background The Global Burden of Diseases, Injuries, and Risk Factors Study (GBD) 2017 comparative risk assessment (CRA) is a comprehensive approach to risk factor quantification that offers a useful tool for synthesising evidence on risks and risk-outcome associations. With each annual GBD study, we update the GBD CRA to incorporate improved methods, new risks and risk-outcome pairs, and new data on risk exposure levels and risk- outcome associations. Methods We used the CRA framework developed for previous iterations of GBD to estimate levels and trends in exposure, attributable deaths, and attributable disability-adjusted life-years (DALYs), by age group, sex, year, and location for 84 behavioural, environmental and occupational, and metabolic risks or groups of risks from 1990 to 2017. This study included 476 risk-outcome pairs that met the GBD study criteria for convincing or probable evidence of causation. We extracted relative risk and exposure estimates from 46 749 randomised controlled trials, cohort studies, household surveys, census data, satellite data, and other sources. We used statistical models to pool data, adjust for bias, and incorporate covariates. Using the counterfactual scenario of theoretical minimum risk exposure level (TMREL), we estimated the portion of deaths and DALYs that could be attributed to a given risk. We explored the relationship between development and risk exposure by modelling the relationship between the Socio-demographic Index (SDI) and risk-weighted exposure prevalence and estimated expected levels of exposure and risk-attributable burden by SDI. Finally, we explored temporal changes in risk-attributable DALYs by decomposing those changes into six main component drivers of change as follows: (1) population growth; (2) changes in population age structures; (3) changes in exposure to environmental and occupational risks; (4) changes in exposure to behavioural risks; (5) changes in exposure to metabolic risks; and (6) changes due to all other factors, approximated as the risk-deleted death and DALY rates, where the risk-deleted rate is the rate that would be observed had we reduced the exposure levels to the TMREL for all risk factors included in GBD 2017.
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2.
  • Lozano, Rafael, et al. (författare)
  • Measuring progress from 1990 to 2017 and projecting attainment to 2030 of the health-related Sustainable Development Goals for 195 countries and territories: a systematic analysis for the Global Burden of Disease Study 2017
  • 2018
  • Ingår i: The Lancet. - : Elsevier. - 1474-547X .- 0140-6736. ; 392:10159, s. 2091-2138
  • Tidskriftsartikel (refereegranskat)abstract
    • Background: Efforts to establish the 2015 baseline and monitor early implementation of the UN Sustainable Development Goals (SDGs) highlight both great potential for and threats to improving health by 2030. To fully deliver on the SDG aim of “leaving no one behind”, it is increasingly important to examine the health-related SDGs beyond national-level estimates. As part of the Global Burden of Diseases, Injuries, and Risk Factors Study 2017 (GBD 2017), we measured progress on 41 of 52 health-related SDG indicators and estimated the health-related SDG index for 195 countries and territories for the period 1990–2017, projected indicators to 2030, and analysed global attainment. Methods: We measured progress on 41 health-related SDG indicators from 1990 to 2017, an increase of four indicators since GBD 2016 (new indicators were health worker density, sexual violence by non-intimate partners, population census status, and prevalence of physical and sexual violence [reported separately]). We also improved the measurement of several previously reported indicators. We constructed national-level estimates and, for a subset of health-related SDGs, examined indicator-level differences by sex and Socio-demographic Index (SDI) quintile. We also did subnational assessments of performance for selected countries. To construct the health-related SDG index, we transformed the value for each indicator on a scale of 0–100, with 0 as the 2·5th percentile and 100 as the 97·5th percentile of 1000 draws calculated from 1990 to 2030, and took the geometric mean of the scaled indicators by target. To generate projections through 2030, we used a forecasting framework that drew estimates from the broader GBD study and used weighted averages of indicator-specific and country-specific annualised rates of change from 1990 to 2017 to inform future estimates. We assessed attainment of indicators with defined targets in two ways: first, using mean values projected for 2030, and then using the probability of attainment in 2030 calculated from 1000 draws. We also did a global attainment analysis of the feasibility of attaining SDG targets on the basis of past trends. Using 2015 global averages of indicators with defined SDG targets, we calculated the global annualised rates of change required from 2015 to 2030 to meet these targets, and then identified in what percentiles the required global annualised rates of change fell in the distribution of country-level rates of change from 1990 to 2015. We took the mean of these global percentile values across indicators and applied the past rate of change at this mean global percentile to all health-related SDG indicators, irrespective of target definition, to estimate the equivalent 2030 global average value and percentage change from 2015 to 2030 for each indicator. Findings: The global median health-related SDG index in 2017 was 59·4 (IQR 35·4–67·3), ranging from a low of 11·6 (95% uncertainty interval 9·6–14·0) to a high of 84·9 (83·1–86·7). SDG index values in countries assessed at the subnational level varied substantially, particularly in China and India, although scores in Japan and the UK were more homogeneous. Indicators also varied by SDI quintile and sex, with males having worse outcomes than females for non-communicable disease (NCD) mortality, alcohol use, and smoking, among others. Most countries were projected to have a higher health-related SDG index in 2030 than in 2017, while country-level probabilities of attainment by 2030 varied widely by indicator. Under-5 mortality, neonatal mortality, maternal mortality ratio, and malaria indicators had the most countries with at least 95% probability of target attainment. Other indicators, including NCD mortality and suicide mortality, had no countries projected to meet corresponding SDG targets on the basis of projected mean values for 2030 but showed some probability of attainment by 2030. For some indicators, including child malnutrition, several infectious diseases, and most violence measures, the annualised rates of change required to meet SDG targets far exceeded the pace of progress achieved by any country in the recent past. We found that applying the mean global annualised rate of change to indicators without defined targets would equate to about 19% and 22% reductions in global smoking and alcohol consumption, respectively; a 47% decline in adolescent birth rates; and a more than 85% increase in health worker density per 1000 population by 2030. Interpretation: The GBD study offers a unique, robust platform for monitoring the health-related SDGs across demographic and geographic dimensions. Our findings underscore the importance of increased collection and analysis of disaggregated data and highlight where more deliberate design or targeting of interventions could accelerate progress in attaining the SDGs. Current projections show that many health-related SDG indicators, NCDs, NCD-related risks, and violence-related indicators will require a concerted shift away from what might have driven past gains—curative interventions in the case of NCDs—towards multisectoral, prevention-oriented policy action and investments to achieve SDG aims. Notably, several targets, if they are to be met by 2030, demand a pace of progress that no country has achieved in the recent past. The future is fundamentally uncertain, and no model can fully predict what breakthroughs or events might alter the course of the SDGs. What is clear is that our actions—or inaction—today will ultimately dictate how close the world, collectively, can get to leaving no one behind by 2030.
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3.
  • Murray, Christopher J. L., et al. (författare)
  • Population and fertility by age and sex for 195 countries and territories, 1950–2017: a systematic analysis for the Global Burden of Disease Study 2017
  • 2018
  • Ingår i: The Lancet. - 1474-547X .- 0140-6736. ; 392:10159, s. 1995-2051
  • Tidskriftsartikel (refereegranskat)abstract
    • Background: Population estimates underpin demographic and epidemiological research and are used to track progress on numerous international indicators of health and development. To date, internationally available estimates of population and fertility, although useful, have not been produced with transparent and replicable methods and do not use standardised estimates of mortality. We present single-calendar year and single-year of age estimates of fertility and population by sex with standardised and replicable methods. Methods: We estimated population in 195 locations by single year of age and single calendar year from 1950 to 2017 with standardised and replicable methods. We based the estimates on the demographic balancing equation, with inputs of fertility, mortality, population, and migration data. Fertility data came from 7817 location-years of vital registration data, 429 surveys reporting complete birth histories, and 977 surveys and censuses reporting summary birth histories. We estimated age-specific fertility rates (ASFRs; the annual number of livebirths to women of a specified age group per 1000 women in that age group) by use of spatiotemporal Gaussian process regression and used the ASFRs to estimate total fertility rates (TFRs; the average number of children a woman would bear if she survived through the end of the reproductive age span [age 10–54 years] and experienced at each age a particular set of ASFRs observed in the year of interest). Because of sparse data, fertility at ages 10–14 years and 50–54 years was estimated from data on fertility in women aged 15–19 years and 45–49 years, through use of linear regression. Age-specific mortality data came from the Global Burden of Diseases, Injuries, and Risk Factors Study (GBD) 2017 estimates. Data on population came from 1257 censuses and 761 population registry location-years and were adjusted for underenumeration and age misreporting with standard demographic methods. Migration was estimated with the GBD Bayesian demographic balancing model, after incorporating information about refugee migration into the model prior. Final population estimates used the cohort-component method of population projection, with inputs of fertility, mortality, and migration data. Population uncertainty was estimated by use of out-of-sample predictive validity testing. With these data, we estimated the trends in population by age and sex and in fertility by age between 1950 and 2017 in 195 countries and territories. Findings: From 1950 to 2017, TFRs decreased by 49·4% (95% uncertainty interval [UI] 46·4–52·0). The TFR decreased from 4·7 livebirths (4·5–4·9) to 2·4 livebirths (2·2–2·5), and the ASFR of mothers aged 10–19 years decreased from 37 livebirths (34–40) to 22 livebirths (19–24) per 1000 women. Despite reductions in the TFR, the global population has been increasing by an average of 83·8 million people per year since 1985. The global population increased by 197·2% (193·3–200·8) since 1950, from 2·6 billion (2·5–2·6) to 7·6 billion (7·4–7·9) people in 2017; much of this increase was in the proportion of the global population in south Asia and sub-Saharan Africa. The global annual rate of population growth increased between 1950 and 1964, when it peaked at 2·0%; this rate then remained nearly constant until 1970 and then decreased to 1·1% in 2017. Population growth rates in the southeast Asia, east Asia, and Oceania GBD super-region decreased from 2·5% in 1963 to 0·7% in 2017, whereas in sub-Saharan Africa, population growth rates were almost at the highest reported levels ever in 2017, when they were at 2·7%. The global average age increased from 26·6 years in 1950 to 32·1 years in 2017, and the proportion of the population that is of working age (age 15–64 years) increased from 59·9% to 65·3%. At the national level, the TFR decreased in all countries and territories between 1950 and 2017; in 2017, TFRs ranged from a low of 1·0 livebirths (95% UI 0·9–1·2) in Cyprus to a high of 7·1 livebirths (6·8–7·4) in Niger. The TFR under age 25 years (TFU25; number of livebirths expected by age 25 years for a hypothetical woman who survived the age group and was exposed to current ASFRs) in 2017 ranged from 0·08 livebirths (0·07–0·09) in South Korea to 2·4 livebirths (2·2–2·6) in Niger, and the TFR over age 30 years (TFO30; number of livebirths expected for a hypothetical woman ageing from 30 to 54 years who survived the age group and was exposed to current ASFRs) ranged from a low of 0·3 livebirths (0·3–0·4) in Puerto Rico to a high of 3·1 livebirths (3·0–3·2) in Niger. TFO30 was higher than TFU25 in 145 countries and territories in 2017. 33 countries had a negative population growth rate from 2010 to 2017, most of which were located in central, eastern, and western Europe, whereas population growth rates of more than 2·0% were seen in 33 of 46 countries in sub-Saharan Africa. In 2017, less than 65% of the national population was of working age in 12 of 34 high-income countries, and less than 50% of the national population was of working age in Mali, Chad, and Niger. Interpretation: Population trends create demographic dividends and headwinds (ie, economic benefits and detriments) that affect national economies and determine national planning needs. Although TFRs are decreasing, the global population continues to grow as mortality declines, with diverse patterns at the national level and across age groups. To our knowledge, this is the first study to provide transparent and replicable estimates of population and fertility, which can be used to inform decision making and to monitor progress. Funding: Bill & Melinda Gates Foundation.
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4.
  • Abdal, Noman, et al. (författare)
  • Salinity mitigates cadmium-induced phytotoxicity in quinoa (Chenopodium quinoa Willd.) by limiting the Cd uptake and improved responses to oxidative stress : implications for phytoremediation
  • 2023
  • Ingår i: Environmental Geochemistry and Health. - : Springer Science and Business Media LLC. - 0269-4042 .- 1573-2983. ; 45:1, s. 171-185
  • Tidskriftsartikel (refereegranskat)abstract
    • Cadmium (Cd) contamination and soil salinity are the main environmental issues reducing crop productivity. This study aimed to examine the combined effects of salinity (NaCl) and Cd on the physiological and biochemical attributes of quinoa (Chenopodium quinoa Willd.). For this purpose, 30-day-old plants of quinoa genotype “Puno” were transplanted in Hoagland's nutrient solution containing diverse concentrations of Cd: 0, 50, 100, 200 µM Cd, and salinity: 0, 150, and 300 mM NaCl. Results demonstrated that plant growth, stomatal conductance, and pigment contents were significantly lower at all Cd concentrations than the control plants. Quinoa plants exhibited improved growth and tolerance against Cd when grown at a lower level of salinity (150 mM NaCl) combined with Cd. In contrast, the elevated concentration of salinity (300 mM NaCl) combined with Cd reduced shoot and root growth of experimental plants more than 50%. Combined application of salinity and Cd increased Na (25-fold), while lessened the Cd (twofold) and K (1.5-fold) uptake. A blend of high concentrations of Na and Cd caused overproduction of H2O2 (eightfold higher than control) contents and triggered lipid peroxidation. The activities of antioxidant enzymes: ascorbate peroxidase (APX), catalase (CAT), peroxidase (POD), and superoxide dismutase (SOD) were 13, 12, 7 and ninefold higher than control to mitigate the oxidative stress. Due to restricted root to shoot translocation, and greater tolerance potential against Cd, the quinoa genotype, Puno, is suitable for phytostabilization of Cd in saline soils.
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6.
  • Afroz, Laila, et al. (författare)
  • Nanocomposite Catalyst (1 – x)NiO-xCuO/yGDC for Biogas Fueled Solid Oxide Fuel Cells
  • 2023
  • Ingår i: ACS Applied Energy Materials. - : American Chemical Society (ACS). - 2574-0962. ; 6:21, s. 10918-10928
  • Tidskriftsartikel (refereegranskat)abstract
    • The composites of Ni–Cu oxides with gadolinium doped ceria (GDC) are emerging as highly proficient anode catalysts, owing to their remarkable performance for solid oxide fuel cells operated with biogas. In this context, the nanocomposite catalysts (1 – x)NiO-xCuO/yGDC (x = 0.2–0.8; y = 1,1.3) are synthesized using a solid-state reaction route. The cubic and monoclinic structures are observed for NiO and CuO phases, respectively, while CeO2 showed cubic fluorite structure. The scanning electron microscopic images revealed a rise in the particle size with an increase in the copper and GDC concentration. The optical band gap values are calculated in the range 2.82–2.33 eV from UV–visible analysis. The Raman spectra confirmed the presence of vibration modes of CeO2 and NiO. The electrical conductivity of the nanocomposite anodes is increased as the concentration of copper and GDC increased and reached at 9.48 S cm–1 for 0.2NiO-0.8CuO/1.3GDC composition at 650 °C. The electrochemical performance of (1 – x)NiO-xCuO/yGDC (x = 0.2–0.8; y = 1,1.3)-based fuel cells is investigated with biogas fuel at 650 °C. Among all of the as-synthesized anodes, the fuel cell with composition 0.2NiO-0.8CuO/1.3GDC showed the best performance, such as an open circuit voltage of 0.84 V and peak power density of 72 mW cm–2. However, from these findings, it can be inferred that among all other compositions, the 0.2NiO-0.8CuO/1.3GDC anode is a superior combination for the high electrochemical performance of solid oxide fuel cells fueled with biogas.
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7.
  • Aslam, Marryam, et al. (författare)
  • Physical characteristics of CdZrO3 perovskite at different pressure for optoelectronic application
  • 2020
  • Ingår i: Journal of Materials Research and Technology. - : Elsevier. - 2238-7854. ; 9:5, s. 9965-9971
  • Tidskriftsartikel (refereegranskat)abstract
    • A comprehensive investigation of the physical characteristics of any material provides beneficial information regarding its application viewpoint in different industries. Herein, we report the tunable mechanical and optoelectronic properties of cubic CdZrO3 under variable pressure up to 80 GPa using density functional theory (DFT). The pressure-induced band gap engineering reveals a fantastic fact of transformation of the indirect to direct band gap with increasing pressure. The dielectric response disclosed that optical parameters dragged towards higher energy with an increase of pressure, which unveiled the potential of CdZrO3 for optoelectronic applications. Effective change in optoelectronic is attributed to indirect to direct band gap transition. This study provides a gateway to how the optoelectronic properties of cubic CdZrO3 could be tuned by employing external pressure.
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8.
  • Feigin, Valery L., et al. (författare)
  • Global, regional, and national burden of neurological disorders, 1990–2016 : a systematic analysis for the Global Burden of Disease Study 2016
  • 2019
  • Ingår i: Lancet Neurology. - : Elsevier. - 1474-4422 .- 1474-4465. ; 18:5, s. 459-480
  • Tidskriftsartikel (refereegranskat)abstract
    • Background: Neurological disorders are increasingly recognised as major causes of death and disability worldwide. The aim of this analysis from the Global Burden of Diseases, Injuries, and Risk Factors Study (GBD) 2016 is to provide the most comprehensive and up-to-date estimates of the global, regional, and national burden from neurological disorders.Methods: We estimated prevalence, incidence, deaths, and disability-adjusted life-years (DALYs; the sum of years of life lost [YLLs] and years lived with disability [YLDs]) by age and sex for 15 neurological disorder categories (tetanus, meningitis, encephalitis, stroke, brain and other CNS cancers, traumatic brain injury, spinal cord injury, Alzheimer's disease and other dementias, Parkinson's disease, multiple sclerosis, motor neuron diseases, idiopathic epilepsy, migraine, tension-type headache, and a residual category for other less common neurological disorders) in 195 countries from 1990 to 2016. DisMod-MR 2.1, a Bayesian meta-regression tool, was the main method of estimation of prevalence and incidence, and the Cause of Death Ensemble model (CODEm) was used for mortality estimation. We quantified the contribution of 84 risks and combinations of risk to the disease estimates for the 15 neurological disorder categories using the GBD comparative risk assessment approach.Findings: Globally, in 2016, neurological disorders were the leading cause of DALYs (276 million [95% UI 247–308]) and second leading cause of deaths (9·0 million [8·8–9·4]). The absolute number of deaths and DALYs from all neurological disorders combined increased (deaths by 39% [34–44] and DALYs by 15% [9–21]) whereas their age-standardised rates decreased (deaths by 28% [26–30] and DALYs by 27% [24–31]) between 1990 and 2016. The only neurological disorders that had a decrease in rates and absolute numbers of deaths and DALYs were tetanus, meningitis, and encephalitis. The four largest contributors of neurological DALYs were stroke (42·2% [38·6–46·1]), migraine (16·3% [11·7–20·8]), Alzheimer's and other dementias (10·4% [9·0–12·1]), and meningitis (7·9% [6·6–10·4]). For the combined neurological disorders, age-standardised DALY rates were significantly higher in males than in females (male-to-female ratio 1·12 [1·05–1·20]), but migraine, multiple sclerosis, and tension-type headache were more common and caused more burden in females, with male-to-female ratios of less than 0·7. The 84 risks quantified in GBD explain less than 10% of neurological disorder DALY burdens, except stroke, for which 88·8% (86·5–90·9) of DALYs are attributable to risk factors, and to a lesser extent Alzheimer's disease and other dementias (22·3% [11·8–35·1] of DALYs are risk attributable) and idiopathic epilepsy (14·1% [10·8–17·5] of DALYs are risk attributable).Interpretation: Globally, the burden of neurological disorders, as measured by the absolute number of DALYs, continues to increase. As populations are growing and ageing, and the prevalence of major disabling neurological disorders steeply increases with age, governments will face increasing demand for treatment, rehabilitation, and support services for neurological disorders. The scarcity of established modifiable risks for most of the neurological burden demonstrates that new knowledge is required to develop effective prevention and treatment strategies.Funding: Bill & Melinda Gates Foundation.
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9.
  • Karlsson, Mikael, et al. (författare)
  • Prediction of the onset of sound amplification at shear layers using linear stability analysis
  • 2019
  • Ingår i: 25th AIAA/CEAS Aeroacoustics Conference, 2019. - Reston, Virginia : American Institute of Aeronautics and Astronautics Inc, AIAA.
  • Konferensbidrag (refereegranskat)abstract
    • A simple numerical technique for predicting the potentiality of sound amplification by shear layers is presented. The technique applies Howe’s energy corollary to describe the energy exchange between the vortical mode in the shear layer and the acoustic wave incident on the layer. Potential sound amplification by the vortical mode is identified when the net energy gain of the incident acoustic wave is positive. The technique only requires steady flow simulation and linear stability analysis so the computational cost is modest. Numerical results are compared with a measurement on a particle agglomeration pipe and it shows that the sound amplification can be satisfactorily predicted by the simple technique.
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10.
  • Majal, Ghulam Mustafa (författare)
  • Flow dynamics in corrugated pipes: Effect on particle agglomeration
  • 2020
  • Doktorsavhandling (övrigt vetenskapligt/konstnärligt)abstract
    • In recent times, the deleterious impact of particulate emissions from road vehicles on the well-being of humans has garnered a significant amount ofattention. Regulatory bodies have enacted legislation in order to counter act particulate emissions. In order to meet the proposed legislative requirementsthe engineers have to come up with a suitable after treatment treatment technology. It has been understood that typically the emitted particles are distributed such that the particles largest in terms of number are the smallest in size. Recent legislations have increasingly emphasized controlling boththe particle mass and number of the emissions. The present thesis employs a numerical approach in order to study the transport of particles in an exhaust flow. A particle agglomeration concept is considered as a means to shift the particle size distribution. In order to increase the likelihood of interactionbetween the particles the host gas is manipulated in such a way that it successively accelerates and decelerates.As a starting point a 1D model is considered. Extensive parameter studies are performed in order to determine the appropriate flow characteristics,which promote particle grouping. The term grouping refers to particles moving together in a group or a cluster, thereby increasing the likelihood foragglomerating with one another. It is revealed that higher pulse frequency and geometric wavelength promotes particle grouping. A comparison between different pulse shapes highlighted that smoother pulse shapes are marginally better for particle grouping. Finally, it is observed that an idealized sinusoidalpulse form underestimated the extent of particle grouping when compared to an actual engine pulse.In the next step, a 3D computational fluid dynamics (CFD) study is performed on an idealized axi-symmetric sinusoidal pipe-like geometry. The geometrical parameters of the geometry are based on the earlier completed 1D study. Firstly, for a continuous inlet flow scenario the observed flow structures are highlighted. Proper orthogonal decomposition (POD) revealed that for a geometry with a sufficiently large maximum cross sectional diameteran asymmetric oscillatory mode is present. This mode is caused by the dynamics of the recirculation bubble and the shear layer. In a geometry witha much smaller maximum cross sectional diameter only axial modes driven by the shear layer are observed. In the case of pulsatile inflow conditions an additional axial mode, driven by the pulsation frequency, is observed on top of the earlier observed asymmetric oscillatory mode. Particles are later added into this geometry and it is observed that most of the particles have a small residence time within the geometry under both continuous and pulsatile inflow conditions. This is attributed to the narrow recirculation regions within the idealized pipe-like geometry. A second geometry that is utilized in this study is the experimental corrugated pipe-like geometry. Particles are injected again under continuous andpulsatile inflow conditions for this geometry. Earlier experimental work on this experimental pipe prototype revealed that there is no significant difference in the particle distribution obtained using a straight pipe and an experimental pipe prototype. The numerical study conducted revealed that despite the presence of large recirculation zones, within the cavities of the pipe, most of the particles tended to pass through contracted regions of the pipe without entering the recirculation zones.
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11.
  • Majal, Ghulam Mustafa, et al. (författare)
  • Particle behavior in a turbulent flow within an axially corrugated geometry
  • 2021
  • Ingår i: Advances in Mechanical Engineering. - : SAGE Publications. - 1687-8132 .- 1687-8140. ; 13:8
  • Tidskriftsartikel (refereegranskat)abstract
    • In this numerical study particle behavior inside a sinusoidal pipe geometry is analyzed. The 3D geometry consists of three identical modules, with a periodic boundary condition applied to the flow in the stream wise direction. The incompressible, turbulent gas flow is modeled using a Large Eddy Simulation (LES) approach. Furthermore, the particle dynamics are simulated using a Lagrangian point force approach incorporating the Stokes drag and slip correction factor. Four different sizes of particles, corresponding to a Stokes number less than unity, are considered along with two different inflow conditions: continuous and pulsatile. The pulsatile inflow has an associated flow frequency of 80 Hz. The fluid flow through the sinusoidal pipe is characterized by weak flow separation in the expansion zones of the sinusoidal pipe geometry, where induced shear layers and weak recirculation zones are identified. Particle behavior under the two inflow conditions is quantified using particle dispersion, particle residence time, and average radial position of the particle. No discernible difference in the particle behavior is observed between the two inflow conditions. As the observed recirculation zones are weak, the particles are not retained within the cavities for a long duration of time, thereby reducing their likelihood of agglomerating.
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12.
  • Majal, Ghulam Mustafa, et al. (författare)
  • Study of pulsating flows inside an axially corrugated geometry
  • Ingår i: Journal of Fluids Engineering. - 0098-2202 .- 1528-901X.
  • Tidskriftsartikel (refereegranskat)abstract
    • In this study the influence of flow pulsations on the intrinsic flow structures found within corrugated-pipe like geometries is explored numerically. An axisymmetric geometry with wavy-walls is taken under consideration. Two different pulsatile inlet conditions are considered which consist of sinusoidal pulse form and a distinct pulsation frequency: 80Hzand 160Hz. The 3D, incompressible and turbulent gas flow is simulated using a Large Eddy Simulation (LES) methodology with a wall adapting local eddy viscosity (WALE) subgrid scale (SGS) model. A solver validation study is firstly presented based on the Direct Numerical Simulation (DNS) data of the wavy-wall benchmark case (data set available at http://cfd.mace.manchester.ac.uk/ercoftac/database/cases/case77/Case_data/). A subsequent grid resolution study is completed in in order to determinean appropriate mesh size. This is followed by a comparison between the flow profiles and coherent structures for the pulsatile flow under consideration. The coherent flow structures are exposed using a Proper Orthogonal Decomposition (POD) approach and spectral analysis. The appearance of an axial mode is highlighted. Spectral analysis indicates that this particular flow mode is driven by the flow pulsations. Furthermore, an asymmetric oscillatory mode is highlighted using the POD approach. Spectral analysis revealed that up to 500Hz the most dominant spectral content appeared in the expansion regions, enveloping the shear-layer/recirculation bubble, of the geometry. Increasing beyond 500Hz the strongest spectral content appeared inside a narrow, confined region within the shear-layer.
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13.
  • Majal, Ghulam Mustafa, et al. (författare)
  • Turbulent flow mechanisms in axially corrugated geometries
  • Tidskriftsartikel (refereegranskat)abstract
    • In this study the impact of geometrical expansion on the intrinsic flow structures of corrugated-pipe like geometries is numerically investigated. Two axisymmetric geometrieswith wavy-walls are taken under consideration. The geometries have the same geometric wavelength but differ in their respective corrugation amplitude and mean hydraulic diameter. A Large Eddy Simulation (LES) approach is used to numerically simulate a 3D,incompressible, non pulsatile and turbulent gas flow. Firstly, a solver validation study is performed using experimental data for the periodic hill benchmark case (data set available at http://qnet-ercoftac.cfms.org.uk/w/index.php/Abstr:2D\_Periodic_Hill_Flow). This is followed by a grid resolution study in order to determine an appropriate mesh size. A comparison between the flow profiles and coherent structures as calculated for the two geometries is made. The coherent flow structures are exposedusing a Proper Orthogonal Decomposition (POD) approach and spectral analysis. The POD analysis revealed an asymmetric oscillatory mode for the geometry with the larger mean hydraulic diameter. A similar analysis highlighted axial modes for the geometry withthe smaller mean hydraulic diameter. Subsequent spectral analysis revealed that up to a certain frequency the strongest spectral content appeared in the expansion regions, en-compassing the shear-layer/recirculation bubble, of the geometry. Beyond that frequency the strongest spectral content appeared in a confined region within the shear-layer. For the geometry with larger mean hydraulic diameter the distinguishing frequency was determined to be 500Hz. In the case of the geometry with the smaller mean hydraulic diameter this frequency increased to 1500Hz. Frequency content lower than 100Hz is governed by the dynamics of recirculation bubble whereas higher frequency content is governed by the dynamics of the induced shear-layer.
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14.
  • Mustafa, Ghulam M., et al. (författare)
  • Study of optoelectronic and transport properties of MgLu2Z4 (Z=S, Se) spinels for optoelectronic and energy harvesting applications
  • 2021
  • Ingår i: Materials Science in Semiconductor Processing. - : Elsevier. - 1369-8001 .- 1873-4081. ; 121
  • Tidskriftsartikel (refereegranskat)abstract
    • Intense research has been done to build materials that are potential candidates for energy storage applications. Spinels are of great interest in this respect because they have vast potential to be used in Mg-based batteries. To explore their energy storage as well as transport response, we calculate Mg-based spinels, namely MgLu2Z4 (ZS, Se). The full potential linearized augmented plane wave method has been used to examine their optoelectronic and transport response. An increase in the lattice constant has been observed by replacing S with Se, and our calculated values are in good agreement with those obtained experimentally. The Tran-Blaha modified Becke-Johnson exchange potential (TB-mBJ), has been used to study the optoelectronic and thermoelectric characteristics of the respective spinels. The dependence of these properties on the bandgap has also been observed. Replacing S with Se resulted in the transformation of the electronic bandgap from near-infrared to the visible region (MgLu2S4: 2.60 eV and MgLu2Se4: 2.00 eV). These results showed that these materials have the potential to be used in optoelectronic devices. The optical properties are discussed as a function of energy. Besides, the thermal transports are discussed with the help of Seebeck coefficient and figure of merit as a function of chemical potential and temperature.
  •  
15.
  • Salo-Ahen, Outi M. H., et al. (författare)
  • Molecular Dynamics Simulations in Drug Discovery and Pharmaceutical Development
  • 2021
  • Ingår i: Processes. - : MDPI. - 2227-9717. ; 9:1
  • Forskningsöversikt (refereegranskat)abstract
    • Molecular dynamics (MD) simulations have become increasingly useful in the modern drug development process. In this review, we give a broad overview of the current application possibilities of MD in drug discovery and pharmaceutical development. Starting from the target validation step of the drug development process, we give several examples of how MD studies can give important insights into the dynamics and function of identified drug targets such as sirtuins, RAS proteins, or intrinsically disordered proteins. The role of MD in antibody design is also reviewed. In the lead discovery and lead optimization phases, MD facilitates the evaluation of the binding energetics and kinetics of the ligand-receptor interactions, therefore guiding the choice of the best candidate molecules for further development. The importance of considering the biological lipid bilayer environment in the MD simulations of membrane proteins is also discussed, using G-protein coupled receptors and ion channels as well as the drug-metabolizing cytochrome P450 enzymes as relevant examples. Lastly, we discuss the emerging role of MD simulations in facilitating the pharmaceutical formulation development of drugs and candidate drugs. Specifically, we look at how MD can be used in studying the crystalline and amorphous solids, the stability of amorphous drug or drug-polymer formulations, and drug solubility. Moreover, since nanoparticle drug formulations are of great interest in the field of drug delivery research, different applications of nano-particle simulations are also briefly summarized using multiple recent studies as examples. In the future, the role of MD simulations in facilitating the drug development process is likely to grow substantially with the increasing computer power and advancements in the development of force fields and enhanced MD methodologies.
  •  
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