Дисертації з теми "Thermal computations"
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Gowreesunker, Baboo Lesh Singh. "Phase change thermal enery storage for the thermal control of large thermally lightweight indoor spaces." Thesis, Brunel University, 2013. http://bura.brunel.ac.uk/handle/2438/7649.
Повний текст джерелаMahrukh, Mahrukh. "Computational modelling of thermal spraying processes." Thesis, Cranfield University, 2016. http://dspace.lib.cranfield.ac.uk/handle/1826/10039.
Повний текст джерелаJang, Tai Seung. "Thermophysiologic issues in computational human thermal models /." free to MU campus, to others for purchase, 2003. http://wwwlib.umi.com/cr/mo/fullcit?p1418034.
Повний текст джерелаBhatnagar, Himanshu. "Computational Modeling of Failure in Thermal Barrier Coatings under Cyclic Thermal Loads." The Ohio State University, 2009. http://rave.ohiolink.edu/etdc/view?acc_num=osu1230741103.
Повний текст джерелаSeijas, Bellido Juan Antonio. "Computational studies of thermal transport in functional oxides." Doctoral thesis, Universitat Autònoma de Barcelona, 2019. http://hdl.handle.net/10803/669787.
Повний текст джерелаThis Thesis collects the computational works we have done in the field of condensed matter physics, focused on the thermal transport properties of the Lead Titanate (PbTiO3) and the Zinc Oxide (ZnO), both representative materials of many other insulating functional oxides. The first has been modeled using a second-principles potential, that is, a potential parameterized from first-principles calculations, which captures some quantum effects that can be relevant in the material. We have modeled the second one using the Buckingham's potential, a simple analytical expression that seems to describe the behavior of ZnO in a fairly approximate agreement with experiments.
Barakat, Magdi H. "Computation of indoor airflow for thermal comfort in residential buildings." Diss., Georgia Institute of Technology, 1989. http://hdl.handle.net/1853/23308.
Повний текст джерелаNegrão, Cezar O. R. "Conflation of computational fluid dynamics and building thermal simulation." Thesis, University of Strathclyde, 1995. http://oleg.lib.strath.ac.uk:80/R/?func=dbin-jump-full&object_id=21238.
Повний текст джерелаJohansson, Emma. "The thermal comfort of the cockpit: A pilot's experience." Thesis, KTH, Optimeringslära och systemteori, 2017. http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-203773.
Повний текст джерелаSaab gör stora satsningar för att säkerställa att cockpiten är en god arbetsplats för piloten. Den här rapporten syftar till att öka kunskapen om termisk komfort genom att kombinera Saabs atmosfärs-, kabin-, och pilotmodeller. För att kunna verifiera att den kombinerade modellen beskriver verkligheten genomfördes en kvalitativ studie med testpiloter. Intervjuerna reducerades till ett par flyg-scenarier, som sedan testades i den kombinerade modellen. Detta för att kunna verifiera att de upplevda obekvämligheterna kunde förutspås. Den kombinerade modellen utökades med en prediktion av bekvämligheten enligt Europeisk standard. Ur intervjuerna kunde situationer identifieras då piloterna känner termiskt obehag. Av dessa situationer är två flygfall och ett markfall, där piloten befinner sig utanför cockpit. Modellen simulerar hur piloten påverkas av den termiska miljön i kabin, på grund av detta kunde inte markfallet analyseras. Modellsimuleringen resulterade i figurer som visar temperaturen i kroppsdelar som piloterna har uttryck känns obehagliga. Predicted Mean Vote, PMV, förutspår komfort på en 6-gradig skala givet omgivningsparametrar så som tryck och temperatur. Predicted Percentage Dissatisfied, PPD, beskriver hur stor andel, i procent, som upplever obehag vid ett givet PMV. Dessa mått på komfort användes för att beräkna komforten i de olika kroppsdelarna. Modellsimuleringen av pilotkomforten stämmer överens med det piloterna nämnde till viss del. I vissa kroppsdelar stämmer det inte överens. Då modellen inte tar hänsyn till fuktighet vid beräkning av kroppstemperaturer kan detta vara en anledning till varför den inte stämmer helt. Fuktigheten påverkar PMV och PPD beräkningarna och i fall 2 visar det sig att PPD ökar med en ökad fuktighet. Slutligen, behöver modellens ses över, och detaljgraden ökas, för att den här rapportens metoder skall vara användbara vid tillverkningen av flygplan.
Eriksson, Christoffer. "Thermal design optimization by geometric parameterization of heat sources." Thesis, Uppsala universitet, Avdelningen för beräkningsvetenskap, 2017. http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-328011.
Повний текст джерелаXiang, Yetao. "Experimental and computational investigation of building integrated PV thermal air system combined with thermal storage." Thesis, University of Nottingham, 2017. http://eprints.nottingham.ac.uk/42743/.
Повний текст джерелаAbabneh, Mohammed. "Novel Charging Station and Computational Modeling for High Thermal Conductivity Heat Pipe Thermal Ground Planes." University of Cincinnati / OhioLINK, 2012. http://rave.ohiolink.edu/etdc/view?acc_num=ucin1353950640.
Повний текст джерелаLai, Ho-yin Albert. "Artificial intelligence based thermal comfort control with CFD modelling /." Hong Kong : University of Hong Kong, 1999. http://sunzi.lib.hku.hk/hkuto/record.jsp?B21929555.
Повний текст джерелаWang, Zhongxiao. "Parallel computation for reservoir thermal simulation An overlapping domain decomposition approach /." Ann Arbor, Mich. : Proquest, 2005. http://proquest.umi.com/pqdweb?index=0&did=954046251&SrchMode=1&sid=1&Fmt=2&VInst=PROD&VType=PQD&RQT=309&VName=PQD&TS=1187901937&clientId=57025.
Повний текст джерелаNguyen, Thanh Son. "Computational modelling of thermal-hydrological-mechanical processes in geological media." Thesis, McGill University, 1995. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=29096.
Повний текст джерелаThe development of the FRACON code followed an extensive procedure of code verification via analytical solutions and intercode comparison. A unique set of benchmark problems was proposed in order to perform code verification for coupled T-H-M.
The FRACON code was used to interpret certain laboratory and field experiments, including the following: (1) coupled T-H-M laboratory experiment on a block of cementitious material; (2) lab experiments on joint shear behaviour under constant normal stress and constant normal stiffness conditions; (3) coupled shear-flow laboratory experiment on a joint; (4) Field experiments of fluid injection in a horizontal fracture in a granitic rock mass.
Lastly, the FRACON code was used to simulate the coupled T-H-M response of a rock mass to radiogenic heat from nuclear fuel wastes buried in the rock formation. The coupled H-M response of this rock mass to a future glaciation scenario was also simulated. It was shown that the mechanical/hydraulic regimes of the rock mass could be significantly changed by the above two factors. The importance of the consideration of T-H-M processes in the overall scheme of safety assessment of sites targeted for nuclear fuel waste repositories is supported by the findings of this thesis.
Duplain, Eric. "Computational optimization of the thermal performance of internally finned ducts." Thesis, McGill University, 2006. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=99407.
Повний текст джерелаPaul, Steven Timothy. "A Computational Framework for Fluid-Thermal Coupling of Particle Deposits." Thesis, Virginia Tech, 2018. http://hdl.handle.net/10919/83544.
Повний текст джерелаMaster of Science
Mohekar, Ajit. "Computational modeling of triple layered microwave heat exchanger." Digital WPI, 2018. https://digitalcommons.wpi.edu/etd-theses/276.
Повний текст джерелаAbou-Ardate, Abdul Kader. "On-line computation of system operating limits with respect to thermal constraints." [Ames, Iowa : Iowa State University], 2006.
Знайти повний текст джерелаMajumdar, Shubhaditya. "Thermal Transport in Organic-Inorganic Heterojunctions: Experimental Measurements and Computational Predictions." Research Showcase @ CMU, 2016. http://repository.cmu.edu/dissertations/839.
Повний текст джерелаSrinivasan, Sriraj Soroush Masoud. "Computational and experimental study of spontaneous thermal polymerization of alkyl acrylates /." Philadelphia, Pa. : Drexel University, 2009. http://hdl.handle.net/1860/3131.
Повний текст джерелаRomagnoli, Alessandro. "Aerodynamic and thermal characterization of turbocharger turbines : experimental and computational evaluation." Thesis, Imperial College London, 2010. http://hdl.handle.net/10044/1/6134.
Повний текст джерелаYoo, Jee Soo. "Computational study on controlling the optical properties of solar thermal fuels." Thesis, Massachusetts Institute of Technology, 2019. https://hdl.handle.net/1721.1/123622.
Повний текст джерелаCataloged from PDF version of thesis.
Includes bibliographical references (pages 62-72).
Solar thermal fuels utilize molecules that undergo reversible photo-isomerization to convert solar energy into stored thermal energy.¹ Because solar thermal fuels produce no emissions and can store and convert energy within one material, they are an attractive option for a renewable energy source. However, it has remained a challenge to identify a suitable solar thermal fuel material that exhibits high energy density, high energy conversion efficiency, long energy storage lifetime, and can be produced at low cost. A recent proposal is a nanotemplate-photoisomer hybrid system, e.g. functionalized azobenzene, a well-known photoisomer molecule, attached to carbon nanostructure templates such as carbon nanotubes, graphene, pentacene or alkene chains. Such structures have been suggested and tested as candidate solar thermal fuel materials with high energy density and long storage time²⁻⁴ In this thesis work, we further investigated optical properties of functionalized azobenzene and geometry-modified azobenzene. We found the best structure that yields maximum optical isomerization rate for trans-azobenzene and minimum optical isomerization rate for cis-azobenzene, calculating the reaction rate based on overlap between the solar spectrum and optical spectra calculated using time-dependent density functional theory (TDDFT). We showed that energy-charged-state molecule (cis-isomer) content at the photostationary state can be improved from 73 percent for pure azobenzene to 83 percent and to 97 percent by functionalizing azobenzene and a designing different geometry for azobenzene, respectively. From this, a desired structure for nanotemplates-photoisomer hybrid system can be estimated and same calculation technique may be employed to calculate and optimize photostationary state of the nanotemplates-photoisomer hybrid system.
by Jee Soo Yoo.
S.M.
S.M. Massachusetts Institute of Technology, Department of Materials Science and Engineering
Kurzawa, Nils [Verfasser], and Mikhail [Akademischer Betreuer] Savitski. "Computational methods for thermal stability proteomics / Nils Kurzawa ; Betreuer: Mikhail Savitski." Heidelberg : Universitätsbibliothek Heidelberg, 2021. http://d-nb.info/1235674673/34.
Повний текст джерела黎浩然 and Ho-yin Albert Lai. "Artificial intelligence based thermal comfort control with CFD modelling." Thesis, The University of Hong Kong (Pokfulam, Hong Kong), 1999. http://hub.hku.hk/bib/B3122278X.
Повний текст джерелаAndersson, Per-Åke. "Computation of Thermal Development in Injection Mould Filling, based on the Distance Model." Licentiate thesis, Linköping University, Linköping University, Optimization, 2002. http://urn.kb.se/resolve?urn=urn:nbn:se:liu:diva-5733.
Повний текст джерелаThe heat transfer in the filling phase of injection moulding is studied, based on Gunnar Aronsson’s distance model for flow expansion ([Aronsson], 1996).
The choice of a thermoplastic materials model is motivated by general physical properties, admitting temperature and pressure dependence. Two-phase, per-phase-incompressible, power-law fluids are considered. The shear rate expression takes into account pseudo-radial flow from a point inlet.
Instead of using a finite element (FEM) solver for the momentum equations a general analytical viscosity expression is used, adjusted to current axial temperature profiles and yielding expressions for axial velocity profile, pressure distribution, frozen layer expansion and special front convection.
The nonlinear energy partial differential equation is transformed into its conservative form, expressed by the internal energy, and is solved differently in the regions of streaming and stagnant flow, respectively. A finite difference (FD) scheme is chosen using control volume discretization to keep truncation errors small in the presence of non-uniform axial node spacing. Time and pseudo-radial marching is used. A local system of nonlinear FD equations is solved. In an outer iterative procedure the position of the boundary between the “solid” and “liquid” fluid cavity parts is determined. The uniqueness of the solution is claimed. In an inner iterative procedure the axial node temperatures are found. For all physically realistic material properties the convergence is proved. In particular the assumptions needed for the Newton-Mysovskii theorem are secured. The metal mould PDE is locally solved by a series expansion. For particular material properties the same technique can be applied to the “solid” fluid.
In the circular plate application, comparisons with the commercial FEM-FD program Moldflow (Mfl) are made, on two Mfl-database materials, for which model parameters are estimated/adjusted. The resulting time evolutions of pressures and temperatures are analysed, as well as the radial and axial profiles of temperature and frozen layer. The greatest differences occur at the flow front, where Mfl neglects axial heat convection. The effects of using more and more complex material models are also investigated. Our method performance is reported.
In the polygonal star-shaped plate application a geometric cavity model is developed. Comparison runs with the commercial FEM-FD program Cadmould (Cmd) are performed, on two Cmd-database materials, in an equilateral triangular mould cavity, and materials model parameters are estimated/adjusted. The resulting average temperatures at the end of filling are compared, on rays of different angular deviation from the closest corner ray and on different concentric circles, using angular and axial (cavity-halves) symmetry. The greatest differences occur in narrow flow sectors, fatal for our 2D model for a material with non-realistic viscosity model. We present some colour plots, e.g. for the residence time.
The classical square-root increase by time of the frozen layer is used for extrapolation. It may also be part of the front model in the initial collision with the cold metal mould. An extension of the model is found which describes the radial profile of the frozen layer in the circular plate application accurately also close to the inlet.
The well-posedness of the corresponding linearized problem is studied, as well as the stability of the linearized FD-scheme.
Report code: LiU-TEK-LIC-2002:66.
AL-AZMI, BADER SHABEEB. "ANALYSIS OF TRANSPORT MODELS AND COMPUTATION ALGORITHMS FOR FLOW THROUGH POROUS MEDIA." The Ohio State University, 2003. http://rave.ohiolink.edu/etdc/view?acc_num=osu1051059625.
Повний текст джерелаAl-Khwaji, Abdusalam. "Computational and Experimental Modeling of the Bioheat Transfer Process of Perfusion in Tissue Applied to Burn Wounds." Diss., Virginia Tech, 2013. http://hdl.handle.net/10919/19368.
Повний текст джерелаThis work consists of three journal papers. The first paper introduces the mathematical model and its validation with finite-difference solutions. The second paper validates the physical aspects of the usage of the model with thermal measurement in detecting simulated burned layers and the associated perfusion. The third paper demonstrates the ability of the model to use thermal measurements to detect different burn severity of an animal model and to study the healing process.
Ph. D.
Sazhina, E. M. "Numerical analysis of autoignition and thermal radiation processes in diesel engines." Thesis, University of Brighton, 1999. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.299221.
Повний текст джерелаBadenhorst, Reginald Ivor. "Computational Fluid Dynamics analysis of flow patterns in a thermal tray dryer." Diss., University of Pretoria, 2010. http://hdl.handle.net/2263/27534.
Повний текст джерелаDissertation (MEng)--University of Pretoria, 2010.
Mechanical and Aeronautical Engineering
unrestricted
Sagerman, Denton Gregory. "Hypersonic Experimental Aero-thermal Capability Study Through Multilevel Fidelity Computational Fluid Dynamics." University of Dayton / OhioLINK, 2017. http://rave.ohiolink.edu/etdc/view?acc_num=dayton1499433256220438.
Повний текст джерелаBensassi, Khalil. "Contribution to the Numerical Modeling of the VKI Longshot Hypersonic Wind Tunnel." Doctoral thesis, Universite Libre de Bruxelles, 2014. http://hdl.handle.net/2013/ULB-DIPOT:oai:dipot.ulb.ac.be:2013/229727.
Повний текст джерелаDoctorat en Sciences de l'ingénieur
info:eu-repo/semantics/nonPublished
De, Abreu Negreiros Bianca. "Building design and environmental performance : thermal comfort through thermal mass and natural ventilation in social housing in Northeast Brazil." Thesis, University of Manchester, 2018. https://www.research.manchester.ac.uk/portal/en/theses/building-design-and-environmental-performance-thermal-comfort-through-thermal-mass-and-natural-ventilation-in-social-housing-in-northeast-brazil(71a83bde-8a7c-43d1-a181-2bb340dcb639).html.
Повний текст джерелаFarhoudi, Yalda. "Measurement and computation of thermal stresses in injection molding of amorphous and crystalline polymers." Thesis, National Library of Canada = Bibliothèque nationale du Canada, 1998. http://www.collectionscanada.ca/obj/s4/f2/dsk1/tape11/PQDD_0018/NQ44426.pdf.
Повний текст джерелаHernandez, Tascon Mauricio. "Experimental and computational evaluation of thermal performance and overheating in double skin facades." Thesis, University of Nottingham, 2008. http://eprints.nottingham.ac.uk/10628/.
Повний текст джерелаCharmeau, Anne. "A computational thermal-fluid modeling approach to pulsed and steady gas core reactors." [Gainesville, Fla.] : University of Florida, 2004. http://purl.fcla.edu/fcla/etd/UFE0003720.
Повний текст джерелаZhang, Hantao S. M. Massachusetts Institute of Technology. "Computational investigation of the thermal conductivities and phonon properties of strontium cobalt oxides." Thesis, Massachusetts Institute of Technology, 2019. https://hdl.handle.net/1721.1/123356.
Повний текст джерелаThesis: S.M., Massachusetts Institute of Technology, Department of Nuclear Science and Engineering, 2019
Cataloged from student-submitted PDF version of thesis.
Includes bibliographical references (pages 87-91).
The thermal conductivities of electrochemically tuned strontium cobalt oxides (SCO) are significantly different among the perovskite SrCoO3 (P-SCO), the brownmillerite SrCoO2.5 (BM-SCO) and the hydrogenated HSrCoO2.5 (H-SCO)1. The underlying mechanism causing this large difference is still unclear. And phonon properties in SCO have not been investigated thoroughly or have some contradictive predictions. In this work, we have calculated the thermal conductivities in P-SCO and BM-SCO by applying molecular and lattice dynamics, and successfully reconstructed the large difference of the thermal conductivities, consistent with measurements. Furthermore, several phonon properties including heat capacities, group velocities, lifetimes and mean free paths have been calculated, and the key roles of local atomic environment and crystal symmetry in determining the thermal conductivities have been identified. We have also analyzed the impact of interfaces, isotropic strains and defects on thermal conductivities, predicted the neutron scattering intensity in P-SCO, and tested the accuracy and performance of molecular dynamics based on deep learning. Additionally, even though the calculations about the phonon properties in H-SCO are not complete, it still offers some inspirations about its thermal conductivity. The thorough investigations about the phonon properties and the mechanisms determining the thermal conductivities in SCO may benefit future research about tunable thermal conductivities in complex oxides.
by Hantao Zhang.
S.M.
S.M. Massachusetts Institute of Technology, Department of Nuclear Science and Engineering
Osborn, Tim H. "COMPUTATIONAL DESIGN AND CHARACTERIZATION OF SILICENE NANOSTRUCTURES FOR ELECTRICAL AND THERMAL TRANSPORT APPLICATIONS." Wright State University / OhioLINK, 2014. http://rave.ohiolink.edu/etdc/view?acc_num=wright1401712678.
Повний текст джерелаBatkam, Hemo Serge. "Thermique multidomaines en simulation numérique du remplissage 3D." Paris, ENMP, 2002. http://www.theses.fr/2002ENMP0001.
Повний текст джерелаSolving the thermal problem is a key point for the numerical simulation of injection molding. The main causes of the numerical difficulties encountered by classical Galerkin techniques are the specific characters of molten polymers: high energy dissipation, low thermal conductivity, thermal shocks at the mold wall, thermal dependence of rheology. In this contribution, we have developed a space-time finite element method to solve the heat equation. A discontinuous Galerkin technique using P0/P0+ elements is proposed for the steady problem. The transient problem is treated with a discontinuous high order finite element in time method. The so-built scheme is local and easy to implement. It reveals good properties of stability, robustness and speed. Its appears to be efficient both for convection dominant and diffusion dominant equations, and is therefore suitable for injection molding process. Another difficulty when modelling the thermal exchanges in the polymer is to define accurate boundary conditions at the cavity frontier. We have investigated a numerical scheme which allows to couple the computations in the polymer with thermal computations in domains surrounding the cavity (multidomain approach). This scheme does not require coincident meshes between the domains. A specific processing at the interfaces guarantees natural thermal exchanges between two domains in contact, with no regard of any particular heat exchange coefficient specified at the interface. All the proposed methods have been validated through analytic examples, then integrated to the thermal solver of REM3D® software. Several examples of complex 3D mold filling, including thermomechanical coupling in the cavity, and possibly thermal coupling in the mold or in inserts (overmolding injection process) are given
Cunsolo, Salvatore. "Radiative properties computational modeling of porous cellular materials." Thesis, Lyon, 2018. http://www.theses.fr/2018LYSEI005/document.
Повний текст джерелаCellular media such as plastic, ceramic and metal foams present specific characteristics that make them interesting for a number of applications related to thermal engineering. Their ability to minimize natural convection makes them ideal candidates for insulation applications, while the high specific surface and permeability to fluid of open cell foams makes them interesting heat transfer enhancers. In addition, their permeability to light makes them an ideal candidate for thermal radiation based applications, such as porous burners or solar energy collectors. In many of these application, thermal radiation heat transfer can have a significant influence on the heat transfer process. Both accurate radiation models and accurate morphological models of the structure of the foam are required. This work provides an original contribution on both these accounts. A discussion of the literature on numerical methods for radiation heat transfer in cellular media is presented, with focus on Monte Carlo methods. Homogeneous Phase (HPA) and Multi Phase (MPA) methods are discussed. Further efforts are required to accurately model and digitally replicate of foam morphologies. Our goal is to digitally generate three commonly occurring types of foam structures, covering a large range of real materials: high-porosity open cell foams, high-porosity closed cell foams, low-porosity open-cell structures. For high-porosity open cell foams, the automated parametric digital generation technique was validated against a dataset consisting of raw morphological data obtained by tomographic analysis. The generation capabilities were then applied to parametrically investigate the influence of morphological parameters on the radiative properties (namely, the extinction coefficient) of an opaque open-cell foam. Highly accurate analytical relationships were subsequently deduced and validated by comparison with results obtained from tomography samples. Modeling radiation in foams with a semi-transparent solid phase is substantially more complex. A Direct Monte-Carlo Homogenization reference technique is proposed, that allows to simulate radiation within arbitrary cavities and calculate macroscopic radiative quantities based on a Representative Elementary Volume (REV) of cellular material. The technique is validated against full scale Monte Carlo simulations. Improvements of the existing Homogeneous Phase and Multi Phase approach are proposed, through extensive use of inverse methods and the addition of one equation to take into account specific phenomena taking place in the semi-transparent solid phase. The resulting Improved Homogenized Approaches are extensively tested by comparing them with Direct Monte Carlo Homogenization simulations and existing homogenized models, on a varied set of morphologies making full use of the previously developed digital generation techniques. The improved models consistently outperform existing homogenized models
Iyer, Kaushik A. "Quantitative characterization of thermophysical properties in computational heat transfer." Full text open access at:, 1993. http://content.ohsu.edu/u?/etd,273.
Повний текст джерелаDavies, Gareth Frank. "Development of a predictive model of the performance of domestic gas ovens using computational fluid dynamics." Thesis, London South Bank University, 1996. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.263995.
Повний текст джерелаAldeeb, Abdulrehman Ahmed. "Systematic approach for chemical reactivity evaluation." Diss., Texas A&M University, 2003. http://hdl.handle.net/1969.1/159.
Повний текст джерелаNie, Qihong. "Experimentally validated multiscale thermal modeling of electronic cabinets." Diss., Atlanta, Ga. : Georgia Institute of Technology, 2008. http://hdl.handle.net/1853/26492.
Повний текст джерелаCommittee Chair: Joshi, Yogendra; Committee Member: Gallivan, Martha; Committee Member: Graham, Samuel; Committee Member: Yeung, Pui-Kuen; Committee Member: Zhang, Zhuomin. Part of the SMARTech Electronic Thesis and Dissertation Collection.
Guo, Zuojun. "Structural Stability of Nucleic Acids and Peptides: a Theoretical and Computational Study." Thesis, Boston College, 2012. http://hdl.handle.net/2345/3782.
Повний текст джерелаIn chapter one, two simple models are used to estimate the electrostatic contributions to the stiffness of short DNA fragments. The first model views DNA as two strands that are appropriately parameterized and are wrapped helically around a straight cylinder radius equal to the radius of the DNA molecule. The potential energy of the DNA due to phosphate-phosphate electrostatic interactions is evaluated assuming that the charges interact through Debye-Hückle potentials. This potential energy is compared with the potential energy as computed using our second model in which DNA is viewed as two helical strands wrapping around a curved tube whose cross-section is a disk of radius equal to the radius of the DNA. The results are compared with counterion condensation models and experimental data (Guo et al. J. Phys. Chem. B, 2008, 112, 16163-16169). In chapter two, the fidelity of translation selection begins with the base pairing of codon-anticodon complex between the mRNA and tRNAs. Binding of cognate and near-cognate tRNAs induces 30S subunit of the ribosome to wrap around the ternary complex, EF-Tu(GTP)aa-tRNA. We have proposed that large thermal fluctuations play a crucial role in the selection process. The binding energies of over a dozen unique site-bound magnesium structural motifs are investigated and provide insights into the nature of interaction of divalent metal ions with the ribosome (Guo et al. Proc. Nat. Acad. Sci. 2011, 108, 3947-3951). In chapter three, we use extensive molecular dynamics simulations to study a series of stapled alpha helical peptides over a range of temperatures in solution. The peptides are found to exhibit substantial variations in predicted helicities that are in good agreement with the experimental value. In addition, we find significant variation in local structural flexibility of the peptides with the position of the linker, which appears to be more closely related to the observed differences in activity than the absolute alpha helical stability (Guo et al. Chem. Biol. Drug. Des. 2010, 75, 348-359.). In chapter four, the alpha helical conformation and structural stability of single and double stapled all-hydrocarbon cross-linked p53 peptides in solution and when bound to MDM2 is investigated. We determined the effects of the peptide sequence, the stereochemistry of the cross-linker, the conformation of the double bond in the alkene bridge, the length of the bridge, on the relative stability of the alpha helix structure. The conformation population distribution indicates a fully helical state and several partially folded states. The distribution of dihedral pairs of the stapled peptides in the bound state indicates a significant population around the alpha helical region. Sequences over which the linker spans tend to have the highest helical occupancy. Significant helical content is observed for a double stapled p53 peptide at 575 K. The probability to form native contacts is increased when the stapled peptides are bound to MDM2. The distribution of the end-to-end distance of the peptides is bimodal
Thesis (PhD) — Boston College, 2012
Submitted to: Boston College. Graduate School of Arts and Sciences
Discipline: Chemistry
Somani, Ankit. "Advanced thermal management strategies for energy-efficient data centers." Thesis, Atlanta, Ga. : Georgia Institute of Technology, 2009. http://hdl.handle.net/1853/26527.
Повний текст джерелаCommittee Chair: Joshi, Yogendra; Committee Member: ghiaasiaan, mostafa; Committee Member: Schwan, Karsten. Part of the SMARTech Electronic Thesis and Dissertation Collection.
Moghimi, Ardekani Mohammad. "Optical thermal and economic optimisation of a linear Fresnel collector." Thesis, University of Pretoria, 2017. http://hdl.handle.net/2263/61313.
Повний текст джерелаThesis (PhD)--University of Pretoria, 2017.
Mechanical and Aeronautical Engineering
PhD
Unrestricted
Wang, Liang. "Experimental and Computational Investigation of Thermal-Flow Characteristics of Gas Turbine Reverse-Flow Combustor." ScholarWorks@UNO, 2010. http://scholarworks.uno.edu/td/1212.
Повний текст джерелаKnutsen, Christopher. "Thermal analysis of the internal climate condition of a house using a computational model." Master's thesis, Faculty of Engineering and the Built Environment, 2021. http://hdl.handle.net/11427/32740.
Повний текст джерелаIwashita, Takuya. "Computational Studies on the Dynamics of Small-Particle Suspensions using Meso-Scale Modeling." 京都大学 (Kyoto University), 2009. http://hdl.handle.net/2433/77956.
Повний текст джерелаCruz, Ethan E. "Coupled inviscid-viscous solution methodology for bounded domains: Application to data center thermal management." Diss., Georgia Institute of Technology, 2015. http://hdl.handle.net/1853/54316.
Повний текст джерела