2,276 research outputs found
Automatic generation control of multigeneration power system
Load frequency Control (LFC) is used for many years as part of Automatic Generation Control (AGC) in power system around the world. In a mixed power system, it is usual to find an area regulated by hydro generation interconnected to another area regulated by thermal generation or in combination of both. In the following study, performance of AGC for Thermal, Hydro and Thermal turbine based power system is examined, including how frequency bias setting influences AGC responseand inadvertent interchange. Control performance analysis of three area interconnected systems is simulated and studied through Matlab Simulink software. Integral square error and Integral time absolute error has been used as performance criterion. It is shown that integral timeabsolute error (ITAE) as performance index leads to faster optimization of controller gain
Deep Brain Stimulation (DBS) Applications
The issue is dedicated to applications of Deep Brain Stimulation and, in this issue, we would like to highlight the new developments that are taking place in the field. These include the application of new technology to existing indications, as well as ânewâ indications. We would also like to highlight the most recent clinical evidence from international multicentre trials. The issue will include articles relating to movement disorders, pain, psychiatric indications, as well as emerging indications that are not yet accompanied by clinical evidence. We look forward to your expert contribution to this exciting issue
Electronic structure of porphyrin-based metalâ organic frameworks and their suitability for solar fuel production photocatalysis
Metalâorganic frameworks (MOFs) can be exceptionally good catalytic materials thanks to the presence of
active metal centres and a porous structure that is advantageous for molecular adsorption and
confinement. We present here a first-principles investigation of the electronic structure of a family of
MOFs based on porphyrins connected through phenyl-carboxyl ligands and AlOH species, in order to
assess their suitability for the photocatalysis of fuel production reactions using sunlight. We consider
structures with protonated porphyrins and those with the protons exchanged with late 3d metal cations
(Fe2+, Co2+, Ni2+, Cu2+, Zn2+), a process that we find to be thermodynamically favorable from aqueous
solution for all these metals. Our band structure calculations, based on an accurate screened hybrid
functional, reveal that the bandgaps are in a favorable range (2.0 to 2.6 eV) for efficient adsorption of
solar light. Furthermore, by approximating the vacuum level to the pore centre potential, we provide the
alignment of the MOFs' band edges with the redox potentials for water splitting and carbon dioxide
reduction, and show that the structures studied here have band edges positions suitable for these
reactions at neutral pH.Royal Society for an International Exchange Scheme grantVia our membership of the UK's HPC Materials Chemistry Consortium, which is funded by EPSRC (EP/L000202), this work made use of the facilities of ARCHER, the UK's national high-performance computing services, which are funded by the Office of Science and Technology through EPSRC's High End Computing ProgrammeEuropean Research Council through an ERC Starting Grant (ERC2011-StG-279520-RASPA)MINECO (CTQ2013-48396-P)AndalucĂa Region (FQM-1851)University of Granad
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Electronic structure simulations of energy materials: chalcogenides for thermoelectrics and metal-organic frameworks for photocatalysis
A theoretical investigation of the electronic structure of chalcogenides for
thermoelectric applications and metal organic frameworks (MOFs) for photocatalytic
applications is presented in this thesis. The development of chalcogenide materials for
thermoelectric applications presents an opportunity to move away from tellurium based
materials, which are not cost-effective. Their mainstream realization is dependent on an
increase in their efficiency. A combination of density functional theory and Boltzmann
transport theory are used to investigate the electronic and phonon transport properties of
chalcogenide materials. In the shandite family, the transport properties of Ni3Sn2S2
provide a useful rationalization of their behaviour. In Co3Sn2S2 indium substitutes tin
preferentially at the interlayer sites, and leads to a compositionally induced metal-tosemiconductor-to-metal
transition which is critical to its thermoelectric properties.
Cu2ZnSnSe4 is the most promising of the quaternary chalcogenides and is investigated
for thermoelectric applications. It is a p-type semiconductor and a combined theoretical
and experimental analysis shows how its ZT can be optimized through doping.
In the second part of this thesis, two classes of MOFs are investigated for their
photocatalytic properties, porphyrin based MOFs (PMOFs) and zeolitic imidazolate
frameworks (ZIFs). In both materials, DFT calculations are used to obtain the electronic
band structure, which is then aligned with a vacuum reference. In these MOFs, as in
chalcogenides, chemical substitution can be used to engineer the band structure for their
optimal properties. In PMOFs metal substitution at the octahedral metal centre is able
tune the band edge positions. Optimal properties were found by partial substitution of Al
by Fe at the octahedral sites, while keeping Zn at the porphyrin centres. In ZIFs the band
edge positions are mainly determined by the molecular linker and intrinsic photocatalytic
activity can be achieved by mixing different linkers
Issues and mitigations of wind energy penetrated network: Australian network case study
Longest geographically connected Australian power system is undergoing an unprecedented transition, under the effect of increased integration of renewable energy systems. This change in generation mix has implications for the whole interconnected system designs, its operational strategies and the regulatory framework. Frequency control policies about real-time balancing of demand and supply is one of the prominent and priority operational challenge requiring urgent attention. This paper reviews the Australian electricity market structure in presence of wind energy and its governance. Various issues related to increased wind generation systems integration are discussed in detail. Currently applied mitigations along with prospective mitigation methods requiring new or improved policies are also discussed. It is concluded that developing prospective frequency regulation ancillary services market desires further encouraging policies from governing authority to keep pace with current grid transition and maintain its security
Comportement hydromécanique des remblais miniers en pùte cimentés et des chantiers miniers remblayés
Avec la forte demande en mĂ©taux dans les pays Ă©mergents Ă travers le monde, la production miniĂšre a atteint un rĂ©gime soutenu. De ce fait, lâindustrie miniĂšre contribue Ă©normĂ©ment au PIB de nombreux pays miniers. Mais en mĂȘme temps, lâexploitation de plus en plus intense des gisements gĂ©nĂšre Ă©galement des rejets solides (rĂ©sidus et roches stĂ©riles) qui sont entreposĂ©s en surface dans des aires dâaccumulation. Cependant, les aires dâaccumulation des rĂ©sidus, aussi appelĂ©s parcs Ă rĂ©sidus, nĂ©cessitent un suivi et une gestion particuliĂšre pendant de trĂšs longues pĂ©riodes afin dâĂ©viter tout drainage minier acide (DMA), rĂ©sultat de lâoxydation des sulfures de fer et les minĂ©raux mĂ©talliques contenus dans les rĂ©sidus. Dans le cas dâune exploitation souterraine, une partie des rĂ©sidus est parfois renvoyĂ©e sous terre sous forme de remblai en pĂąte cimentĂ© (RPC). Le
RPC est constituĂ© de rĂ©sidus, dâeau de mĂ©lange et dâun agent liant.
Le RPC est ainsi destinĂ© Ă augmenter la stabilitĂ© des Ă©pontes des excavations miniĂšres permettant dâoptimiser lâexploitation des gisements sous terre (taux dâextraction Ă©levĂ©) et aussi dâamĂ©liorer la sĂ©curitĂ© des travailleurs et de rĂ©duire lâempreinte Ă©cologique de la mine. Cependant, le coĂ»t de lâagent liant reprĂ©sente en moyenne entre 12% et 16% des coĂ»ts dâopĂ©ration dâune mine utilisant le RPC (Belem et Benzaazoua, 2008). DâoĂč une quĂȘte incessante dâoptimiser les coĂ»ts des opĂ©rations de remblayage tout en atteignant les cibles de rĂ©sistance visĂ©e.
Un des aspects importants est le comportement du RPC une fois sous terre. La distribution des contraintes dans le chantier remblayĂ© est un phĂ©nomĂšne qui requiert encore une investigation dans le but dâĂ©claircir certains principes. Dâautant plus, les pressions exercĂ©es par le remblai sur les barricades construites pour retenir ce dernier dans les chantiers, ont un comportement diffĂ©rent qui influence sa construction. Lâanalyse de lâimpact de la cure sur les chantiers est un Ă©lĂ©ment essentiel dans la sĂ©quence de minage. Il sera aussi question de dĂ©terminer les diffĂ©rences au niveau des diffĂ©rents paramĂštres entre un chantier remblayĂ© et un modĂšle physique au laboratoire. Câest dans ce but que nous avons portĂ© notre esprit critique.
Il sâagira aussi de comparer les contraintes dans les chantiers remblayĂ©s avec diffĂ©rents types de liants, diffĂ©rentes sĂ©quences de remblayage. Pour ce faire, des essais de cisaillement ont Ă©tĂ© rĂ©alisĂ©s afin de dĂ©terminer les caractĂ©ristiques du remblai et ensuite une estimation des contraintes selon les diffĂ©rentes situations
Comportement hydromécanique des remblais miniers en pùte cimentés et des chantiers miniers remblayés
Résumé
Avec la forte demande en mĂ©taux dans les pays Ă©mergents Ă travers le monde, la production miniĂšre a atteint un rĂ©gime soutenu. De ce fait, lâindustrie miniĂšre contribue Ă©normĂ©ment au PIB de nombreux pays miniers. Mais dans le mĂȘme temps, lâexploitation de plus en plus intense des gisements gĂ©nĂšre Ă©galement des rejets solides (rĂ©sidus et roches stĂ©riles) qui sont entreposĂ©s en surface dans des aires dâaccumulation. Cependant, les aires dâaccumulation des rĂ©sidus, aussi appelĂ©s parcs Ă rĂ©sidus, nĂ©cessitent un suivi et une gestion particuliĂšre pendant de trĂšs longues pĂ©riodes afin dâĂ©viter tout drainage minier acide (DMA), rĂ©sultat de lâoxydation des sulfures de fer et les minĂ©raux mĂ©talliques contenus dans les rĂ©sidus. Dans le cas dâune exploitation souterraine, une partie des rĂ©sidus est renvoyĂ©e sous terre sous forme de remblai en pĂąte cimentĂ© (RPC). Le RPC est constituĂ© de rĂ©sidus, dâeau de mĂ©lange et dâun agent liant.
Le RPC est ainsi destinĂ© Ă augmenter la stabilitĂ© des Ă©pontes des excavations miniĂšres permettant dâoptimiser lâexploitation des gisements sous terre (taux dâextraction Ă©levĂ©) et aussi dâamĂ©liorer la sĂ©curitĂ© des travailleurs et de rĂ©duire lâempreinte Ă©cologique de la mine. Cependant, le coĂ»t de lâagent liant reprĂ©sente en moyenne entre 12% et 16% des coĂ»ts dâopĂ©ration dâune mine utilisant le RPC. DâoĂč une quĂȘte incessante dâoptimiser les coĂ»ts des opĂ©rations de remblayage tout en atteignant les cibles de rĂ©sistance visĂ©e.
Un des aspects importants est le comportement du RPC une fois sous terre. La distribution des contraintes dans le chantier remblayĂ© est un phĂ©nomĂšne qui requiert encore une investigation dans le but dâĂ©claircir certains principes. Dâautant plus, les pressions exercĂ©es par le remblai sur les barricades construites pour retenir ce dernier dans les chantiers, ont un comportement diffĂ©rent qui influence sa construction. Lâanalyse de lâimpact de la cure sur les chantiers est un Ă©lĂ©ment essentiel dans la sĂ©quence de minage. Il sera aussi question de dĂ©terminer les diffĂ©rences au niveau des diffĂ©rents paramĂštres entre un chantier remblayĂ© et un modĂšle physique au laboratoire. Câest dans ce but que nous avons portĂ© notre esprit critique. Il sâagira aussi de comparer les contraintes dans les chantiers remblayĂ©s avec diffĂ©rents types de liants, diffĂ©rentes sĂ©quences de remblayage. Pour ce faire, des essais de cisaillement ont Ă©tĂ© rĂ©alisĂ©s afin de dĂ©terminer les caractĂ©ristiques du remblai et ensuite une estimation des contraintes selon les diffĂ©rentes situations.
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ABSTRACT
The growth of the mining economy generates significant revenue for many companies. The exploitation also generates an increase amount of tailings that are stored at the surface. Tailings accumulation areas, also known as tailings ponds, require special monitoring and management for very long periods of time to avoid acid mine drainage (AMD), the result of the association between iron sulphides and metallic minerals. In order to reduce the amount of these tailings, they are returned underground in the form of cemented paste backfill (CPB).
The cemented paste backfill, while reducing the amount of tailings, increases the stability of the structures and walls to optimize the operation of underground construction sites by increasing the reserves and also improving the safety of the workers. However, the CPB consisting of tailings, water and cement has a high financial cost of operation to the point of reaching Œ of the overall financial costs of the mine. A regular quest of optimization, while meeting the targets for underground mining, has been the main focus of many researches with encouraging results at the end.
One of the important points is the behavior of this CPB once underground. The distribution of stresses inside the stopes is a phenomenon that requires more investigation to clarify some of the principles already defined in the literature. Especially, the pressure the CPB exerts on the fences built to keep him in the stope have different behaviour toward it and it factors in the building of the fence. Even less the impact of the cure time is an important detail in the mining plan of the secondary stopes. The differences in the parameters of a real stope and one that has been filled in the laboratory with reduce size will be a main topic. These are where we will carry out critical spirit.
It will also be a matter of comparing the stress in the backfilled stopes with different types of binders, different backfilling sequences in order to perform shear tests to determine the characteristics of the CPB and then an estimation of the stress according to different situations
Electron and phonon transport in shandite-structured Ni3Sn2S2
The shandite family of solids, with hexagonal structure and composition A3M 2X 2 (A = Ni, Co,
Rh, Pd, M = Pb, In, Sn, Tl, X = S, Se), has attracted recent research attention due to promising
applications as thermoelectric materials. Herein we discuss the electron and phonon transport
properties of shandite-structured Ni3Sn2S2, based on a combination of density functional theory
(DFT), Boltzmann transport theory, and experimental measurements. Ni3Sn2S2 exhibits a metallic
and non-magnetic groundstate with Ni0
oxidation state and very low charge on Sn and S atoms.
Seebeck coefficients obtained from theoretical calculations are in excellent agreement with those
measured experimentally between 100 and 600 K. From the calculation of the ratio Ï/Ï between
the electronic conductivity and relaxation time, and the experimental determination of electron
conductivity, we extract the variation of the scattering rate (1/Ï ) with temperature between 300
and 600 K, which turns out to be almost linear, thus implying that the dominant electron scattering
mechanism in this temperature range is via phonons. The electronic thermal conductivity, which
deviates only slightly from the Wiedemann-Franz law, provides the main contribution to thermal
transport. The small lattice contribution to the thermal conductivity is calculated from the phonon
structure and third-order force constants, and is only âŒ2 Wmâ1K
â1
at 300 K (less than 10% of the
total thermal conductivity), which is confirmed by experimental measurements. Overall, Ni3Sn2S2
is a poor thermoelectric material (ZT ⌠0.01 at 300 K), principally due to the low absolute value
of the Seebeck coefficient. However, the understanding of its transport properties will be useful for
the rationalization of the thermoelectric behavior of other, more promising members of the shandite
family
Electron and phonon interactions and transport in the ultrahigh-temperature ceramic ZrC
We have simulated the ultrahigh-temperature ceramic zirconium carbide (ZrC) in order to predict electron and
phonon scattering properties, including lifetimes and transport. Our predictions of heat and charge conductivity, which extend to 3000 K, are relevant to extreme-temperature applications of ZrC. Mechanisms are identified on a first-principles basis that considerably enhance or suppress heat transport at high temperature, including strain, anharmonic phonon renormalization, and four-phonon scattering. The extent to which boundary confinement and isotope scattering effects lower thermal conductivity is predicted
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