600 research outputs found
Factors influencing burglary and home security measures in England and Wales
Objectives: This exploratory study aims to investigate the relationship between characteristics of the survey respondents, reported fear of burglary and installed home security measures.
Methods: This is a secondary analysis research on data from the Crime Survey for England and Wales 2017/18. The data was analysed using suitable statistical methods: regression modelling and factor analysis.
Results: The main findings showed that the socioeconomic status of respondents and the status of the area they live in are the strongest predictors of installation of deterrence home security measures. The findings further revealed that those of lower socioeconomic status are more afraid of burglary and more likely to have deterrence but not entry prevention home security installed. However, the direct impact of fear of burglary on deterrence home security measures indicated a decrease on the likelihood of this type of home security measure being installed. This suggests that affordability of home security measures plays an important role.
Conclusion: Participants from lower socioeconomic status are more afraid of becoming victims of burglary and invest in cheaper home security measures to protect their homes, while wealthier participants do not feel the need to protect their homes since they are more likely to live in low crime areas
The shape of the halogen atom—anisotropy of electron distribution and its dependence on basis set and method used
Zastosowanie teorii QTAIM i SAPT w analizie wiązań wodorowych wspomaganych ładunkiem
Zdigitalizowano i udostępniono w ramach projektu pn. Rozbudowa otwartych zasobów naukowych Repozytorium Uniwersytetu w Białymstoku, dofinansowanego z programu „Społeczna odpowiedzialność nauki" Ministra Edukacji i Nauki na podstawie umowy SONB/SP/512497/2021.The hydrogen bond (H-bond) has been probably most thoroughly investigated among different so-calIed "weak interactions". This is due to the fact that H-bond plays an essential role in many physical, chemical and biological processes. The strongest and, therefore, the most effectively affecting physical and chemical properties of interacting molecules, are those assisted by some additional effects, e.g. the resonance-assisted H-bonds (RAHBs) or the charge-assisted H-bonds (CAHBs). The latter occurs when the distribution of formal charges additionalIy favors H -bonding. A good example of such interaction may be the NH₄⁽⁺⁾ ... Cl⁽⁻⁾ CAHB(+/-) which can be found in crystal structure of ammonium chloride.The charge-assisted hydrogen bond (CAHB) was investigated for a set of H-bridges of D-H ... X (D=N, P, X=CI, Br) type by the use of computational methods: QTAIM and SAPT. The properties of these bonds, i.e. the interaction energy and its components and the electron density measured in a characteristic point of the chemical bond (band critical points), were represented as functions of H ... CI distance. This gives an opportunity to estimate and discuss the influence of formal charge on the energetic and topological characteristics of H-bonds. It was found that the energy of interaction is strongly affected by formaI charges, which is caused by the presence of effective interaction between formal ions. However, the electron density measured in the H-bond critical point seems to be totalIy independent of the formal charges. The decomposition of interaction energy performed for alI studied CAHBs systems shows that the electrostatic interaction is obviously the main attractive force in CAHB(+/-) and CAHB(-) H-bridges. The contribution of induction effect plays a crucial role in the stabilities of CAHB(+) H-bridge and the dispersion contribution is the main factor stabilizing non-charge-assisted H₃N∙∙∙HCI complex. AdditionalIy, the results of interaction energy decomposition were confronted against QTAIM characteristics of H-BCPs. This manuscript is a smalI review on the theoretical characteristic for a set of charge-assisted hydrogen bond (CAHB) of D-H ... X (D=N, P, X=Cl, Br) type.Wiązania wodorowe odgrywają zasadniczą rolę w wielu fizycznych, chemicznych oraz biologicznych procesach. Z tego względu należą do najczęściej badanych słabych oddziaływań. Najsilniejsze i za razem najefektywniej wpływające na fizykochemiczne właściwości oddziałujących cząsteczek są wiązania wodorowe, którym towarzyszą efekty wspomagające. Wśród nich możemy wyróżnić wiązania wspomagane rezonansem (RAHB) lub ładunkiem formalnym (CAHB). Te ostatnie pojawiają się, gdy obecność ładunku formalnego dodatkowo sprzyja tworzeniu się wiązania wodorowego. Dobrym przykładem wiązań wodorowych wspomaganych ładunkiem są oddziaływania między jonem amonowym i chlorkowym (NH₄⁽⁺⁾∙∙∙Cl⁽⁻⁾ CAHB(+/-)) występujące w strukturze krystalicznej chlorku amonu. Poniższy artykuł ma charakter przeglądowy i przedstawia wyniki teoretycznych badań dotyczących wiązań wodorowych wspomaganych ładunkiem typu D¬ -H•••X, gdzie D=N, P oraz X=CI, Br. Analizę oparto na Kwantowej Teorii Atomów w Cząsteczkach (QTAIM) oraz Teorii Zaburzeń Adaptowanej Symetrii (SAPT) zaliczanych do najbardziej zaawansowanych metod w chemii obliczeniowej stosowanych do opisu oddziaływań międzymolekularnych. Właściwości wiązań takie jak energia oddziaływania i jej składowe oraz gęstość elektronowa mierzona w punktach krytycznych wiązań wyrażono jako funkcję długości mostków wodorowych H•• •X. W ten sposób określono jaki wpływ ma obecność ładunku formalnego na energetyczne i topologiczne parametry międzycząsteczkowych wiązań wodorowych. Szczegółowo omówiono udział poszczególnych energetycznych składowych oddziaływań (elektrostatycznej, indukcyjnej i dyspersyjnej) w stabilizacji wiązania wodorowego. Przedstawiono korelację gęstości elektronowej z wymienionymi składowymi oddziaływań w badanych układach. W oparciu o wyniki badań wskazano liniowe zależności między gęstością elektronową w obrębie wiązania wodorowego a indukcyjnym i dyspersyjnym wkładem do energii oddziaływania. Brak jest natomiast zależności pomiędzy gęstości elektronową a energią oddziaływania elektrostatycznego. 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Corrosion behaviour of boiler tube materials during combustion of fuels containing Zn and Pb
Många förbränningsanläggningar som bränner utmanande bränslen såsom restfraktioner och avfall råkar ut för problem med ökad korrosion på överhettare och/eller vattenväggar pga. komponenter i bränslena som är korrosiva. För att minimera problemen i avfallseldade pannor hålls ångparametrarna på en relativt låg nivå, vilket drastiskt minskar energiproduktionen.
Beläggningarna i avfallseldade pannor består till största delen av element som är förknippade med högtemperaturkorrosion: Cl, S, alkalimetaller, främst K och Na, och tungmetaller som Pb och Zn, och det finns också indikationer av Br-förekomst. Det låga ångtrycket i avfallseldade pannor påverkar också stålrörens temperatur i pannväggarna i eldstaden. I dagens läge hålls temperaturen normalt vid 300-400 °C. Alkalikloridorsakad (KCl, NaCl) högtemperaturkorrosion har inte rapporterats vara relevant vid såpass låga temperaturer, men närvaro av Zn- och Pb-komponenter i beläggningarna har påvisats förorsaka ökad korrosion redan vid 300-400 °C. Vid förbränning kan Zn och Pb reagera med S och Cl och bilda klorider och sulfater i rökgaserna. Dessa tungmetallföreningar är speciellt problematiska pga. de bildar lågsmältande saltblandningar. Dessa lågsmältande gasformiga eller fasta föreningar följer rökgasen och kan sedan fastna eller kondensera på kallare ytor på pannväggar eller överhettare för att sedan bilda aggressiva beläggningar. Tungmetallrika (Pb, Zn) klorider och sulfater ökar risken för korrosion, och effekten förstärks ytterligare vid närvaro av smälta.
Motivet med den här studien var att få en bättre insikt i högtemperaturkorrosion förorsakad av Zn och Pb, samt att undersöka och prediktera beteendet och motståndskraften hos några stålkvaliteter som används i överhettare och pannväggar i tungmetallrika förhållanden och höga materialtemperaturer. Omfattande laboratorie-, småskale- och fullskaletest utfördes. Resultaten kan direkt utnyttjas i praktiska applikationer, t.ex. vid materialval, eller vid utveckling av korrosionsmotverkande verktyg för att hitta initierande faktorer och förstå deras effekt på högtemperaturkorrosion.Polttoon perustuvassa sähköntuotannossa polttoaineen energia pyritään muuntamaan sähköenergiaksi. Poltossa vapautuvalla lämpöenergialla tuotetaan tulistettua höyryä. Höyry johdetaan turbiiniin, johon kytketty generaattori muuntaa mekaanista energiaa sähköksi.
Niin kutsutut haastavat polttoaineet, kuten esimerkiksi jäte ja jäteperäiset polttoaineet, voivat aiheuttaa höyrykattilan tulistinputkien hajoamista ja/tai seinäputkien korroosiota Korroosio-ongelmien välttämiseksi tulistetun höyryn lämpötila pidetään suhteellisen alhaisena, mikä alentaa merkittävästi sähköntuotannon hyötysuhdetta.
Jätettä ja jäteperäisiä polttoaineita käyttävien kattiloiden tuhkakerrostumien sisältämät kloori (Cl), rikki (S) ja bromi (Br), alkalimetallit kalium (K) ja natrium (Na), sekä raskasmetallit sinkki (Zn) ja lyijy (Pb) on liitetty korkean lämpötilan korroosioon. Jätettä polttavien kattiloiden seinäputkien lämpötila on yleensä 300-400 °C. Alkaliklorideista (KCl, NaCl) johtuvaa korkean lämpötilan korroosiota ei yleensä esiinny näissä lämpötiloissa. Sen sijaan sinkkiä ja lyijyä sisältävien kerrostumien on havaittu aiheuttaneen korroosiota. Sinkki ja lyijy voivat poltossa reagoida rikin ja kloorin kanssa, muodostaen savukaasuun klorideja ja sulfaatteja. Nämä raskasmetalliyhdisteet ovat korroosion kannalta erityisen merkityksellisiä, koska ne muodostavat alhaisissa lämpötiloissa sulavia suolaseoksia. Kerrostuman osittainenkin sulaminen lisää korroosioriskiä.
Tämän työn tavoitteena oli sinkin ja lyijyn aiheuttaman korkean lämpötilan korroosion mekanismien parempi ymmärrys, sekä joidenkin höyrykattiloissa käytettyjen seinäputki- ja tulistinmateriaalien käyttäytymisen ja korroosionkeston arviointi kyseessä olevien raskasmetallien vaikutuksen alaisena, myös korkeissa lämpötiloissa. Tavoitteeseen pääsemiseksi suoritettiin laboratorio-, penkki-, ja teollisuuskokoluokan kokeita. Kokeiden tuloksia voidaan hyödyntää suoraan käytännössä, esimerkiksi tehtäessä materiaalivalintoja sekä kehitettäessä korroosionkeston parantamiseen tähtääviä työkaluja tunnistamalla korroosiota käynnistäviä tekijöitä ja ymmärtämällä niiden vaikutuksia.Many power plants burning challenging fuels such as waste-derived fuels experience failures
of the superheaters and/or increased waterwall corrosion due to aggressive fuel components
already at low temperatures. To minimize corrosion problems in waste-fired boilers, the steam
temperature is currently kept at a relatively low level which drastically limits power
production efficiency.
The elements found in deposits of waste and waste-derived fuels burning boilers that are most
frequently associated with high-temperature corrosion are: Cl, S, and there are also
indications of Br; alkali metals, mainly K and Na, and heavy metals such as Pb and Zn. The
low steam pressure and temperature in waste-fired boilers also influence the temperature of
the waterwall steel which is nowadays kept in the range of 300 °C - 400 °C. Alkali chloride
(KCl, NaCl) induced high-temperature corrosion has not been reported to be particularly
relevant at such low material temperatures, but the presence of Zn and Pb compounds in the
deposits have been found to induce corrosion already in the 300 °C - 400 °C temperature
range. Upon combustion, Zn and Pb may react with Cl and S to form chlorides and sulphates
in the flue gases. These specific heavy metal compounds are of special concern due to the
formation of low melting salt mixtures. These low melting, gaseous or solid compounds are
entrained in the flue gases and may stick or condense on colder surfaces of furnace walls and
superheaters when passing the convective parts of the boiler, thereby forming an aggressive
deposit. A deposit rich in heavy metal (Zn, Pb) chlorides and sulphates increases the risk for
corrosion which can be additionally enhanced by the presence of a molten phase.
The objective of this study was to obtain better insight into high-temperature corrosion
induced by Zn and Pb and to estimate the behaviour and resistance of some boiler superheater
and waterwall materials in environments rich in those heavy metals, including at increased
temperatures of materials. Therefore, extensive laboratory, bench-scale and full-scale tests
were carried out. The results from these tests may be directly made use of in practical
applications, for example for screening steels from the materials selection, as well as in the
development of corrosion preventing tools by finding corrosion initiating triggers and
understanding their effect on high-temperature corrosion.
The laboratory study covered steel exposure tests with pure ZnCl2, ZnO, PbCl2 and PbO as
well as with a number of salt mixtures: ZnCl2-K2SO4, PbCl2-K2SO4, PbCl2-KCl and PbCl2-
ZnCl2-KCl. It was shown that pure PbCl2 starts to be aggressive to the low-alloy steel
(10CrMo9-10) and also to the stainless steels (AISI 347) already at temperatures around
350 °C, below the melting temperature of PbCl2 which is 501 °C. The protective Cr2O3 on the
AISI 347 was destroyed due to PbCrO4 formation. The exposures to ZnCl2 showed an
increased oxide layer growth on the 10CrMo9-10 already at 350 °C, but negligible oxide layer
growth on the AISI 347 up to 450 °C. Above 350 °C, the fast evaporation of ZnCl2
suppressed the growth of the oxide layer.
The tests with ZnCl2- and PbCl2-containing mixtures (ZnCl2-K2SO4, PbCl2-K2SO4, PbCl2-KCl
and PbCl2-ZnCl2-KCl) showed that the ZnCl2-containing mixture (PbCl2-ZnCl2-KCl) was
more aggressive and active at lower temperatures than the PbCl2-KCl mixture. It suggests,
therefore, that ZnCl2 is more likely to cause problems at lower material temperatures, while
PbCl2 is more stable and is expected to be problematic at both waterwall and superheater
temperatures. At 400 °C, the highest corrosion rates on both test materials were observed
when both PbCl2 and ZnCl2 were present in the salt. The PbCl2-ZnCl2-KCl mixture contained
the highest fraction of melt out of all tested salt mixtures but the corrosiveness of this mixture
was not the highest at all test temperatures. Thus, the amount of melt does not necessary
decide the extent of corrosion. At 500 °C and above the corrosion caused by all three mixtures
containing PbCl2 was significant and both steels were damaged to a similar degree. The results
from the tests with the mixtures containing 5 wt-% PbCl2 were similar to the results from the
tests with pure PbCl2 showing its extremely corrosive character.
ZnO was shown not to be corrosive to the low-alloy steel (10CrMo9-10) and nor to the
stainless steel (AISI 347) at 550 °C. The oxide layer thickness was comparable to the test with
no salt present. However, tests with PbO at 550 °C caused a noticeable oxide layer growth on
10CrMo9-10 and fairly low on AISI 347.
To better understand the fate of Zn and its effect on high-temperature corrosion specifically in
waste-wood fired fluidized bed boilers, high-temperature corrosion/deposit probe tests were
performed in a 30 kWth bubbling fluidized-bed reactor by firing wood pellets doped with
ZnCl2 to simulate waste wood. Specific issues of interest in this study included the general
impact of firing waste wood containing higher amounts of Zn and Cl and the evaluation of the
role of ZnCl2 in high-temperature corrosion. The tests showed that the presence of ZnCl2 had
a clear impact on high-temperature corrosion of low-alloy steel. When compared to the
combustion of pure wood pellet, corrosion increased at temperatures above 450 °C (probe
cooling temperature). The K2ZnCl4 which was found in the deposit was concluded to be the
main corrosive agent.
During the planning stage of further experiments there were strong indications of bromide
induced high-temperature corrosion of the waterwalls. In consequence, a measurement
campaign in a BFB co-combusting SRF was performed to determine the occurrence of
corrosive Cl-, Br-, Zn- and Pb-compounds in the fuel, in the furnace vapours and in the
waterwall deposits. The relative corrosiveness of chlorides and bromides was further
established by means of laboratory experiments. A ZnBr2-K2SO4 salt mixture was tested and
compared with a corresponding ZnCl2-K2SO4 salt mixture. The mixture with ZnBr2 was found
to be more aggressive at 400 °C in oxidising conditions than the corresponding mixture with
ZnCl2. A measurement campaign showed that vapours in the furnace were enriched with Cl
and small amounts of Br, Zn and Pb. The chemical thermodynamic calculations indicated that
possible forms of those compounds at the waterwall deposit temperatures (400 °C) were Na-,
K-bromides and chlorides and Zn- and Pb-sulphides or sulphates in reducing and oxidizing
conditions, respectively. The thermodynamic calculations correlated with the deposit analysis
Analysis of Structural Features of Hard-Facing Overlays Performed Using Prototype Selfshielded Flux Cored Wires(Materials, Metallurgy & Weldability)
Carbamohydrazonothioate derivative—experimental and theoretical explorations of the crystal and molecular structure
Advancing gene therapies, methods, and technologies for Parkinson’s Disease and other neurological disorders
Introduction. Vector-based intracerebral gene therapies are being used to treat specific neurodegenerative conditions such as Parkinson’s Disease (PD). This review presents a basis for central nervous system (CNS) gene therapy treatments of neurodegenerative diseases such as PD, as well as the need for novel skill sets and health delivery strategies within the clinical neurosciences (neurology and neurosurgery) to meet future demand for such therapies.State of the art. Preclinical vector-based gene therapy approaches have been translated into clinical trials for PD and other neurodegenerative conditions. Unfortunately, such trials, and parallel efforts using other therapeutics, have yet to provide a breakthrough. Image-guided convection enhanced delivery (CED) optimises the parenchymal distribution of gene therapies applied within the CNS, and may ultimately provide such a breakthrough.Clinical implications. Currently, image-guided CED and gene therapy are not part of training programmes for most neurosurgeons and neurologists. As a result, few medical centres and hospitals have sufficiently experienced teams to participate in gene transfer clinical trials for PD or other neurological conditions. If CNS gene therapies prove to be efficacious for PD and/or other conditions, the demand for such treatments will overwhelm the available number of experienced clinical neuroscience teams and treatment centres.Future directions. Expanded indications and demand for CNS gene therapies will require a worldwide educational effort to supplement the training of clinical neuroscience practitioners. Initially, a limited number of Centres of Excellence will need to establish relevant educational training requirements and best practice for such therapeutic approaches. Advanced technologies, including robotics and artificial intelligence, are especially germane in this regard, and will expand the treatment team’s capabilities while assisting in the safe and timely care of those afflicted
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Magnetic resonance imaging-guided phase 1 trial of putaminal AADC gene therapy for Parkinson's disease.
ObjectiveTo understand the safety, putaminal coverage, and enzyme expression of adeno-associated viral vector serotype-2 encoding the complementary DNA for the enzyme, aromatic L-amino acid decarboxylase (VY-AADC01), delivered using novel intraoperative monitoring to optimize delivery.MethodsFifteen subjects (three cohorts of 5) with moderately advanced Parkinson's disease and medically refractory motor fluctuations received VY-AADC01 bilaterally coadministered with gadoteridol to the putamen using intraoperative magnetic resonance imaging (MRI) guidance to visualize the anatomic spread of the infusate and calculate coverage. Cohort 1 received 8.3 × 1011 vg/ml and ≤450 μl per putamen (total dose, ≤7.5 × 1011 vg); cohort 2 received the same concentration (8.3 × 1011 vg/ml) and ≤900 μl per putamen (total dose, ≤1.5 × 1012 vg); and cohort 3 received 2.6 × 1012 vg/ml and ≤900 μl per putamen (total dose, ≤4.7 × 1012 vg). (18)F-fluoro-L-dihydroxyphenylalanine positron emission tomography (PET) at baseline and 6 months postprocedure assessed enzyme activity; standard assessments measured clinical outcomes.ResultsMRI-guided administration of ascending VY-AADC01 doses resulted in putaminal coverage of 21% (cohort 1), 34% (cohort 2), and 42% (cohort 3). Cohorts 1, 2, and 3 showed corresponding increases in enzyme activity assessed by PET of 13%, 56%, and 79%, and reductions in antiparkinsonian medication of -15%, -33%, and -42%, respectively, at 6 months. At 12 months, there were dose-related improvements in clinical outcomes, including increases in patient-reported ON-time without troublesome dyskinesia (1.6, 3.3, and 1.5 hours, respectively) and quality of life.InterpretationNovel intraoperative monitoring of administration facilitated targeted delivery of VY-AADC01 in this phase 1 study, which was well tolerated. Increases in enzyme expression and clinical improvements were dose dependent. ClinicalTrials.gov Identifier: NCT01973543 Ann Neurol 2019;85:704-714
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