Дисертації з теми "3d Transition Metal Oxides"
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Kumagai, Yu. "Relationship between atomic arrangements and electronic structures of selected 3d transition-metal oxides by first principles calculations." 京都大学 (Kyoto University), 2010. http://hdl.handle.net/2433/120814.
Повний текст джерелаFürsich, Katrin [Verfasser], and Bernhard [Akademischer Betreuer] Keimer. "X-ray and Raman scattering studies of novel phases in 3d and 4d transition metal oxides / Katrin Fürsich ; Betreuer: Bernhard Keimer." Stuttgart : Universitätsbibliothek der Universität Stuttgart, 2020. http://d-nb.info/1223928926/34.
Повний текст джерелаRahman, Mohammad Mahbubur. "Solar selective characteristics and local electronic bonding states of 3d transition metal oxide and metal nitride based thin film coatings." Thesis, Rahman, Mohammad Mahbubur ORCID: 0000-0002-6778-7931 (2016) Solar selective characteristics and local electronic bonding states of 3d transition metal oxide and metal nitride based thin film coatings. PhD thesis, Murdoch University, 2016. https://researchrepository.murdoch.edu.au/id/eprint/30910/.
Повний текст джерелаQi, Tongfei. "MAGNETIC AND ORBITAL ORDERS COUPLED TO NEGATIVE THERMAL EXPANSION IN MOTT INSULATORS, CA2RU1-XMXO4 (M = 3D TRANSITION METAL ION)." UKnowledge, 2012. http://uknowledge.uky.edu/physastron_etds/6.
Повний текст джерелаSchrön, Andreas [Verfasser], Friedhelm [Akademischer Betreuer] Bechstedt, Peter [Akademischer Betreuer] Kratzer, and Diema [Akademischer Betreuer] Ködderitzsch. "Ab-initio studies of the magnetic properties of the 3d transition-metal oxides and their surfaces = Ab-initio-Untersuchungen der magnetischen Eigenschaften der 3d-Übergansmetalloxide und deren Oberflächen / Andreas Schrön. Gutachter: Friedhelm Bechstedt ; Peter Kratzer ; Diema Ködderitzsch." Jena : Thüringer Universitäts- und Landesbibliothek Jena, 2015. http://d-nb.info/1075492815/34.
Повний текст джерелаBergmann, Arno [Verfasser], Peter [Akademischer Betreuer] Strasser, and Christina [Gutachter] Roth. "On the catalytically active state and structure-activity correlations of 3d transition metal oxide catalysts for electrochemical water splitting / Arno Bergmann ; Gutachter: Christina Roth ; Betreuer: Peter Strasser." Berlin : Technische Universität Berlin, 2016. http://d-nb.info/1156012627/34.
Повний текст джерелаHossain, A. "Synthesis, crystal structure and properties of complex oxides with the perovskite structure based on neodymium, alkaline earth and 3d-transition metals : dissertation for the degree of candidate of chemical sciences : 02.00.04." Thesis, б. и, 2019. http://hdl.handle.net/10995/82032.
Повний текст джерелаMete, Ersen. "Electronic Properties Of Transition Metal Oxides." Phd thesis, METU, 2003. http://etd.lib.metu.edu.tr/upload/1069699/index.pdf.
Повний текст джерелаBogdanov, Nikolay. "Anisotropic interactions in transition metal oxides." Doctoral thesis, Saechsische Landesbibliothek- Staats- und Universitaetsbibliothek Dresden, 2018. http://nbn-resolving.de/urn:nbn:de:bsz:14-qucosa-234886.
Повний текст джерелаSadoc, Aymeric Gaël Jocelyn. "Charge disproportionation in transition metal oxides." [S.l. : [Groningen : s.n.] ; University Library Groningen] [Host], 2008. http://irs.ub.rug.nl/ppn/.
Повний текст джерелаLau, Bayo. "Modeling polarons in transition-metal oxides." Thesis, University of British Columbia, 2011. http://hdl.handle.net/2429/33463.
Повний текст джерелаField, Marianne Alice Louise. "Transition metal oxides and oxide-halides." Thesis, University of Southampton, 2004. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.401833.
Повний текст джерелаGuo, Yuzheng. "Electronic structures of transition metal oxides." Thesis, University of Cambridge, 2014. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.648465.
Повний текст джерелаGibbs, Alexandra S. "Emergent states in transition metal oxides." Thesis, University of St Andrews, 2013. http://hdl.handle.net/10023/3557.
Повний текст джерелаVale, J. G. "The nature of the metal-insulator transition in 5d transition metal oxides." Thesis, University College London (University of London), 2017. http://discovery.ucl.ac.uk/1538695/.
Повний текст джерелаAdam, Robert. "Phasenumwandlungen und Änderungen der Mikrostruktur in Konversionselektroden für Lithium-Ionen-Batterien basierend auf 3d-Übergangsmetalloxiden." TU Bergakademie Freiberg, 2020. https://tubaf.qucosa.de/id/qucosa%3A75540.
Повний текст джерелаMann, Peter David Alexander. "Electronic structure of layered transition metal oxides." Thesis, University of Cambridge, 2007. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.612888.
Повний текст джерелаMcAllister, Judith Ann. "Lattice effects in layered transition metal oxides." Thesis, University of Cambridge, 2000. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.621529.
Повний текст джерелаHickey, Peter James. "Structural studies of layered transition metal oxides." Thesis, University of Southampton, 2009. https://eprints.soton.ac.uk/173977/.
Повний текст джерелаGummow, Rosalind June. "Lithium intercalation reactions with transition metal oxides." Doctoral thesis, University of Cape Town, 1993. http://hdl.handle.net/11427/19039.
Повний текст джерелаDe, Silva Theja Nilantha. "Spin-Orbital Physics in Transition Metal Oxides." University of Cincinnati / OhioLINK, 2004. http://rave.ohiolink.edu/etdc/view?acc_num=ucin1092948911.
Повний текст джерелаAdem, Umut. "Magnetodielectric coupling in multiferroic transition metal oxides." [S.l. : [Groningen : s.n.] ; University of Groningen] [Host], 2008. http://irs.ub.rug.nl/ppn/.
Повний текст джерелаSimpson, Jeffrey Ray. "Optical properties of strongly correlated transition metal oxides." College Park, Md. : University of Maryland, 2004. http://hdl.handle.net/1903/2079.
Повний текст джерелаThesis research directed by: Physics. Title from t.p. of PDF. Includes bibliographical references. Published by UMI Dissertation Services, Ann Arbor, Mich. Also available in paper.
Payne, David J. "The Electronic Structure of Post Transition Metal Oxides." Thesis, University of Oxford, 2008. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.491678.
Повний текст джерелаAbdoullah, Mohamad. "Supported transition metal oxides as solid base catalysts." Thesis, University of Huddersfield, 2016. http://eprints.hud.ac.uk/id/eprint/28325/.
Повний текст джерелаMillburn, Julie Elizabeth. "Structural and electronic properties of transition metal oxides." Thesis, University of Oxford, 1997. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.364166.
Повний текст джерелаWilkins, Stuart Brian. "Charge and spin correlations in transition metal oxides." Thesis, Durham University, 2002. http://etheses.dur.ac.uk/4101/.
Повний текст джерелаLeonov, Ivan [Verfasser]. "Charge Order in Transition Metal Oxides / Ivan Leonov." Aachen : Shaker, 2007. http://d-nb.info/116434093X/34.
Повний текст джерелаNicoll, Steven. "Simulation studies of transition metal and actinide oxides." Thesis, University College London (University of London), 1995. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.308937.
Повний текст джерелаWright, Jonathan Paul. "Powder diffraction studies of frustrated transition metal oxides." Thesis, University of Cambridge, 2001. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.620972.
Повний текст джерелаPatino, Midori Amano. "Topochemical manipulation of some complex transition metal oxides." Thesis, University of Oxford, 2016. https://ora.ox.ac.uk/objects/uuid:e312bf34-98d5-4818-bb50-fd8772688a1d.
Повний текст джерелаŞahin, Aytaç Eanes Mehtap. "Hydrothermal Synthesis and Characterization of Transition Metal Oxides/." [s.l.]: [s.n.], 2004. http://library.iyte.edu.tr/tezler/master/malzemebilimivemuh/T000435.doc.
Повний текст джерелаHallam, Keith Richard. "Carbon deposition on transition metal- and uranium-oxides." Thesis, Open University, 1991. http://oro.open.ac.uk/57324/.
Повний текст джерелаSmith, Adam. "Transition Metal Oxides for Solar Water Splitting Devices." Thesis, University of Oregon, 2016. http://hdl.handle.net/1794/19670.
Повний текст джерелаTeran, Escobar Gerardo. "Solution-Processed Transition Metal Oxides for Organic Solar Cells." Doctoral thesis, Universitat Autònoma de Barcelona, 2013. http://hdl.handle.net/10803/131406.
Повний текст джерелаOrganic Solar Cells (OSCs) have emerged as a promise for low cost energy production, and its potential is reflected in the huge efforts to improve their efficiencies. In the last 30 years, this technology has grown enormously; nowadays the state of the art is showing efficiencies higher than 10%. The continuous development of semiconducting polymers, buffer materials, and the depth knowledge about the electronic exchange at the interfaces, have been the principal reasons of this growing. Nevertheless, upgrading this technology to low cost production states like roll to roll printing technologies is the goal, and the development of low temperature processing materials is the challenge to overcome. In this work, it has explored in depth the application of Transition Metal Oxides (TMOs) as electronic buffer layers like TiO2, ZnO as electron transport layers, and V2O5, NiO as hole transport layers. Also shows the development of a water base low temperature solution-processed V2O5 ink for R2R applications, as well as the application of NiO film sintered at low temperature (350oC) and the characterization by distinct techniques. As well, the long-term stability studies, like indoor and outdoor; carrying out degradation studies for the different architecture devices tested.
Popa, Andreia Ioana. "Electrochemistry and magnetism of lithium doped transition metal oxides." Doctoral thesis, Saechsische Landesbibliothek- Staats- und Universitaetsbibliothek Dresden, 2010. http://nbn-resolving.de/urn:nbn:de:bsz:14-qucosa-26029.
Повний текст джерелаKimber, Simon A. J. "Spin and orbital ordering in ternary transition metal oxides." Thesis, University of Edinburgh, 2008. http://hdl.handle.net/1842/3487.
Повний текст джерелаKrimmel, Alexander [Verfasser]. "Electronically highly correlated ternary transition metal oxides / Alexander Krimmel." Hamburg : Diplom.de, 2005. http://d-nb.info/1179775953/34.
Повний текст джерелаSenn, Mark Stephen. "Charge, orbital and magnetic ordering in transition metal oxides." Thesis, University of Edinburgh, 2013. http://hdl.handle.net/1842/7828.
Повний текст джерелаHunter, Ross. "Transition metal oxides and dust in extended stellar atmospheres." Thesis, University of Nottingham, 2004. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.416415.
Повний текст джерелаAdomkevicius, A. "Controlling transition metal oxides nanostructures for energy storage systems." Thesis, University of Liverpool, 2017. http://livrepository.liverpool.ac.uk/3007846/.
Повний текст джерелаCrawford, Kevin G. "Surface transfer doping of diamond using transition metal oxides." Thesis, University of Glasgow, 2017. http://theses.gla.ac.uk/8561/.
Повний текст джерелаBrammall, M. I. "Stoner criteria in transition metal oxides and heavy fermions." Thesis, University of Birmingham, 2011. http://etheses.bham.ac.uk//id/eprint/1648/.
Повний текст джерелаZhou, Fei Ph D. Massachusetts Institute of Technology. "Models for transition metal oxides and for protein design." Thesis, Massachusetts Institute of Technology, 2006. http://hdl.handle.net/1721.1/39558.
Повний текст джерелаIncludes bibliographical references (p. 133-156).
A large number of properties of solid state materials can now be predicted with standard first-principles methods such as the Local Density (LDA) or Generalized Gradient Approximation (GGA). However, known problems exist when using these methods for predicting the electronic structure and total energy of transition metal oxides. We demonstrate that the LDA+U method, in which localized d electrons are treated with a Hubbard-like model, gives considerably better predictions in band gap, magnetization, lattice constants, redox potential, mixing energy and other properties of lithium transition-metal oxides. The systematic improvement of both electronic structure and total energy properties suggests that the more accurate treatment of electron correlation on the transition metal sites will greatly enhance the predictive character of ab-initio methods for these materials. In a even more dramatic example, the more accurate electronic and total energy descriptions with LDA+U have enabled us to study the finite temperature phase diagram of LixFePO4. It is found that an unexpected solid solution phase are mainly stabilized by the entropy contribution of localized d electrons. This brings the less visited problem of the effects of electronic correlation on thermodynamics into our attention.
(cont.) The second part of this thesis is focused on application of methods used in solid state materials to proteins. Protein systems are well known for having extremely large conformation space, which makes their energy evaluation expensive even with empirical energy models. We are implementing a coarse graining scheme, called the cluster expansion, to help alleviate this problem. Traditionally, the cluster expansion is a powerful tool to model the energetics of solid-state materials with configurational disorder. We have developed a generalized cluster expansion framework suitable for protein studies, in which properties such as the energy can be unambiguously expanded in the amino acid sequence space. The cluster expansion coarse-grains over non-sequence degrees of freedom (e.g. sidechain configurations) and thereby simplifies the problem of designing proteins, or predicting the compatibility of a sequence with a given structure, by many orders of magnitude. With the help of this method, we have been able to perform a full-sequence design for a small peptide within a relatively short period of time.
by Fei Zhou.
Ph.D.
Forrest, T. R. C. "Ordering and dynamics of strongly correlated transition metal oxides." Thesis, University College London (University of London), 2010. http://discovery.ucl.ac.uk/20216/.
Повний текст джерелаDixon, Edward. "The anion chemistry of transition metal oxides and oxychlorides." Thesis, University of Oxford, 2011. http://ora.ox.ac.uk/objects/uuid:3ddb2e1e-18e9-427a-a4a3-b7f2eba2489f.
Повний текст джерелаPopa, Andreia Ioana. "Electrochemistry and magnetism of lithium doped transition metal oxides." Doctoral thesis, Leibniz-Institut für Festkörper- und Werkstoffforschung Dresden, 2009. https://tud.qucosa.de/id/qucosa%3A25180.
Повний текст джерелаRaikar, Ganesh Narayan. "Auger lineshape analysis of semiconductors and transition-metal oxides." Thesis, Raikar, Ganesh Narayan (1987) Auger lineshape analysis of semiconductors and transition-metal oxides. PhD thesis, Murdoch University, 1987. https://researchrepository.murdoch.edu.au/id/eprint/51560/.
Повний текст джерелаMcGrellis, Siobhan Ann. "Structure and chemistry of some low valent transition metal oxides containing metal-metal bonds." Thesis, University of Reading, 1994. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.384902.
Повний текст джерелаBiegler, Zachary J. "Growth, Optimization, and Characterization of Transition Metal Nitrides and Transition Metal Oxides for Electronic and Optical Applications." University of Dayton / OhioLINK, 2019. http://rave.ohiolink.edu/etdc/view?acc_num=dayton1574016211227215.
Повний текст джерела