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Статті в журналах з теми "Metal-Molecule-Metal structure"
Kučera, Jan, and Axel Groß. "Influence of water on the properties of an Au/Mpy/Pd metal/molecule/metal junction." Beilstein Journal of Nanotechnology 2 (July 12, 2011): 384–93. http://dx.doi.org/10.3762/bjnano.2.44.
Повний текст джерелаOrpen, A. Guy. "Metal Complex Geometries in Small-Molecule Crystals." Acta Crystallographica Section D Biological Crystallography 54, no. 6 (November 1, 1998): 1194–98. http://dx.doi.org/10.1107/s0907444998007744.
Повний текст джерелаMaio, U., K. Dolag, B. Ciardi, and L. Tornatore. "Metal and molecule cooling in simulations of structure formation." Monthly Notices of the Royal Astronomical Society 379, no. 3 (August 11, 2007): 963–73. http://dx.doi.org/10.1111/j.1365-2966.2007.12016.x.
Повний текст джерелаWillenbockel, M., D. Lüftner, B. Stadtmüller, G. Koller, C. Kumpf, S. Soubatch, P. Puschnig, M. G. Ramsey, and F. S. Tautz. "The interplay between interface structure, energy level alignment and chemical bonding strength at organic–metal interfaces." Physical Chemistry Chemical Physics 17, no. 3 (2015): 1530–48. http://dx.doi.org/10.1039/c4cp04595e.
Повний текст джерелаKim, Do-Hyun, Hyoyoung Lee та Taehyoung Zyoung. "Transport mechanism of self-assembled D-σ-A-thiol monolayers in metal-molecule-metal structure". Synthetic Metals 152, № 1-3 (вересень 2005): 293–96. http://dx.doi.org/10.1016/j.synthmet.2005.07.160.
Повний текст джерелаMondal, Monosij, Maicol A. Ochoa, Maxim Sukharev, and Abraham Nitzan. "Coupling, lifetimes, and “strong coupling” maps for single molecules at plasmonic interfaces." Journal of Chemical Physics 156, no. 15 (April 21, 2022): 154303. http://dx.doi.org/10.1063/5.0077739.
Повний текст джерелаRojanasuwan, Sunit, Pakorn Prajuabwan, Annop Chanhom, Anuchit Jaruvanawat, Adirek Rangkasikorn, and Jiti Nukeaw. "The Effect of the Central Metal Atom on the Structural Phase Transition of Indium Doped Metal Phthalocyanine." Advanced Materials Research 717 (July 2013): 146–52. http://dx.doi.org/10.4028/www.scientific.net/amr.717.146.
Повний текст джерелаSartain, Hope T., Richard J. Staples та Shannon M. Biros. "Crystal structure of pentakis(ethylenediamine-κ2N,N′)lanthanum(III) trichloride–ethylenediamine–dichloromethane (1/1/1)". Acta Crystallographica Section E Structure Reports Online 70, № 11 (29 жовтня 2014): 424–26. http://dx.doi.org/10.1107/s1600536814023289.
Повний текст джерелаChu, Yu-Ming, Muhammad Abid, Muhammad Imran Qureshi, Asfand Fahad, and Adnan Aslam. "Irregular topological indices of certain metal organic frameworks." Main Group Metal Chemistry 44, no. 1 (January 1, 2021): 73–81. http://dx.doi.org/10.1515/mgmc-2021-0009.
Повний текст джерелаPengmanayol, S., and Tanakorn Osotchan. "Optical Properties of Metal Free and Metal Phthalocyanine by Molecular Band Calculation." Advanced Materials Research 55-57 (August 2008): 677–80. http://dx.doi.org/10.4028/www.scientific.net/amr.55-57.677.
Повний текст джерелаДисертації з теми "Metal-Molecule-Metal structure"
Campos, Otero Alfredo. "Optics and structure of metal clusters at the atomic scale." Thesis, Université Paris-Saclay (ComUE), 2018. http://www.theses.fr/2018SACLS401/document.
Повний текст джерелаIt is well known that the optical properties of nanoparticles of noble metals, in particular gold and silver, deviate strongly from those of macroscopic metals. For sizes between ten and a few hundred nanometers, they are dominated by surface plasmons (SPs) described by purely classical models. On the other hand, clusters of a few tens of atoms behave like quantum systems inducing new optical behaviors. The structure of the nanoparticles and the dielectric environment can affect the optical properties. In this thesis I used a scanning transmission electron microscope (STEM) fitted with an electron energy loss spectrometer (EELS) to measure, in parallel, the optical and structural properties of individual nanoparticles. I present how complementary experiments (STEM-EELS and optical absorption) on sizeselected small silver nanoparticles embedded in silica yield at first inconsistent results: while optical absorption shows no size-effect in the range between only a few atoms and ~10 nm, a clear spectral shift is observed in STEM-EELS technique. Our quantitative interpretation, based on a mixed classical/quantum model which takes into account all the relevant quantum effects, resolves the apparent contradictions, not only within our experimental data, but also in the literature. Our comprehensive model describes how the local environment is the crucial parameter controlling the manifestation or absence of quantum size effects. Secondly, I was interested in the purely classical region through lithographed structures of a few hundred nanometers. Although triangular plasmonic cavities have been widely studied in the literature, a classification in terms of plasmonic modes of breathing and edge was missing. In this study, experimental STEM-EELS results, analytical models and classical simulations enabled us to describe the nature of the different modes
DIMONTE, ALICE. "Nanogap structures for molecular electronics and biosensing." Doctoral thesis, Politecnico di Torino, 2013. http://hdl.handle.net/11583/2506146.
Повний текст джерелаTemirov, Ruslan [Verfasser]. "Studying complex metal-molecule interface with low temperature scanning tunneling microscope : from electronic structure to charge transport / Ruslan Temirov." Bremen : IRC-Library, Information Resource Center der Jacobs University Bremen, 2008. http://d-nb.info/1034984187/34.
Повний текст джерелаMusetti, Caterina. "SELECTIVE TARGETING OF NUCLEIC ACIDS BY SMALL MOLECULES: A DNA STRUCTURE RECOGNITION APPROACH." Doctoral thesis, Università degli studi di Padova, 2011. http://hdl.handle.net/11577/3422045.
Повний текст джерелаLa scoperta di nuovi target anticancro è il fattore chiave per lo sviluppo di terapie sempre più efficaci. Lo studio del legame selettivo a sequenze di DNA a doppia elica nella classica forma B è stato largamente impiegato al fine di direzionare piccole molecole verso porzioni polinucleotidiche definite. Più recentemente, il riconoscimento (da parte di ligandi) di porzioni non canoniche di DNA si può tradurre in un metodo vantaggioso per indirizzare questi composti verso regioni distinte del genoma. A tale proposito, le strutture G-quadruplex rappresentano un sistema interessante poiché sono ritenute fisiologicamente significative. Queste strutture “non-canoniche” di DNA si trovano alle estremità del cromosoma (telomeri) così come in varie regioni promotrici di oncogeni in cui vi è un’abbondante presenza di residui guaninici e sembrano coinvolte nella regolazione di importanti eventi biologici. Pare infatti che l'induzione e la stabilizzazione di strutture G-quadruplex dalle parte di piccole molecole porti all'inibizione dell'attività della telomerasi interferendo con l'interazione tra l’enzima e il suo substrato a singola catena. Un simile meccanismo molecolare è probabilmente coinvolto anche nel controllo della regolazione dell'espressione genica e può portare alla soppressione della trascrizione di un oncogene. Di conseguenza, “l’approccio G-quadruplex” si rivela molto interessante per lo sviluppo di una strategia anticancro specifica caratterizzata anche da una riduzione drammatica degli effetti collaterali, tipici della chemioterapia. Lo scopo di questo lavoro è lo studio delle interazioni tra nuove famiglie di piccole molecole e diverse conformazioni di DNA G-quadruplex. Queste nuove molecole sono state opportunamente progettate apportando sostituzioni di atomi o gruppi funzionali basate sulla valutazione di composti precedentemente studiati al fine di aumentare la loro selettività per strutture G-quadruplex e di ridurre gli effetti tossici. Le proprietà biofisiche e biologiche di tutti i nuovi derivati sono state valutate al livello molecolare e cellulare. Il lavoro di tesi si divide in tre parti in base alle caratteristiche strutturali dei composti. La prima parte è dedicata alla studio di dicationi eterociclici: si è cercato correlare modifiche nella conformazione molecolare con l’affinita’ verso strutture G-quadruplex. In particolare è stato possibile razionalizzare cambiamenti della modalità di legame in base alla struttura dei composti esaminati. Tuttavia una correlazione fra i risultati biofisici (affinità G-quadruplex) e biologici (inibizione della telomerasi e citotossicità) non è risultata sempre definita. Ciò può suggerire il coinvolgimento di bersagli cellulari diversi dal telomero umano. Nel capitolo 3, sono state studiate le proprietà di legame al DNA di alcuni derivati fenantrolinici in presenza ed in assenza di Ni (II) e Cu (II). Abbiamo confermato che complessi caratterizzati da diverse geometrie che coinvolgono una, due o tre molecole per ione possono compromettere o meno il riconoscimento del DNA o determinare cambiamenti conformazionali dell'acido nucleico. Per concludere, il capitolo 4 è dedicato allo studio di derivati del transplatino. In particolare ci siamo focalizzati nel definire la capacità dei composti di formare addotti, la natura dei complessi e la cinetica di formazione del complesso non solo con DNA a doppio filamento ma utilizzando anche substrati a singola catena come il G-quadruplex. I risultati hanno dimostrato come diverse modifiche strutturali possano avere un ruolo importante nell’interazione dei composti con gli acidi nucleici. E’ risultata interessante la loro preferenzialità a reagire con porzioni di DNA a singolo filamento rispetto a sequenze a doppia elica. Ciò è probabilmente dovuto ad uno sfavorevole orientamento dei gruppi reattivi quando la molecola interagisce con il substrato di DNA. Di conseguenza, i composti sembrano formare un cross-link tra due filamenti non appaiati. A livello cellulare, questi risultati riflettono una distinta distribuzione del sito di platinazione all’interno del genoma rispetto al cisplatino e perfino rispetto al transplatino. I risultati ottenuti incrementano la conoscenza disponibile sull’interazione tra DNA e piccole molecole. In particolare è emerso che la conservazione della modalità di interazione si correla con effetti biologici definiti. Al contrario, una variazione della modalità di legame può portare a effetti citotossici differenti. Ciò può fornire una spiegazione razionale per una successiva ottimizzazione della struttura dei composti finalizzata allo sviluppo di nuovi agenti antitumorali efficaci e selettivi.
Rossi, François-Noël. "Etude théorique des collisions non réactives entre atomes alcalins et molécules d'hydrogène ou de deuterium : Calcul et analyse des surfaces de potentiel, application aux transitions de structure fine du rubidium." Paris 13, 1986. http://www.theses.fr/1986PA132015.
Повний текст джерелаDuan, Sai. "Geometrical and Electronic Structures at Molecule-Metal Interfaces from Theoretical Modeling." Doctoral thesis, KTH, Teoretisk kemi och biologi, 2012. http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-94120.
Повний текст джерелаQC 20120515
Houwaart, Torsten. "Cobalt porphyrins on coinage metal surfaces - adsorption and template properties." Thesis, Lyon, École normale supérieure, 2014. http://www.theses.fr/2014ENSL0927.
Повний текст джерелаThis thesis is a theoretical study on the cobalt porphyrin - coinage metal surface interface with the DFT code VASP. The necessary DFT framework has been introduced in chapter 1. The structure of the Java program jBardeen for STM simulation is explained in chapter 2 and the source code is attached as Appendix. A study of the adsorption of CoTPP on coinage metal surfaces has been undertaken in chapter 3. Different parameters of the calculation have been evaluated: the adsorption site and the geometry of both the molecule and surface have been investigated with respect to the xc-functional and dispersion correction used. A most stable adsorption site -bridge down- is identified. Consequently, this most stable site was investigated for its electronic structure. Calculated STM images with the jBardeen code were compared with an experiment of CoTPP on a Cu(111) surface with sub monolayer coverage. In chapter 4 an Fe adatom was introduced to the CoTPP on Ag(111) system. Three symmetrically different binding sites for the Fe atom were identified on the macrocycle, labelled the bi-, brd- and bru-positions for bisector, bridge down and bridge up respectively. A magnetic moment could be evidenced which was mainly located on the Fe atom. Possible pathways between the four symmetrically equivalent bisector sites were investigated with different methods. Single point calculations in vacuum and Nudged Elastic Band (NEB) of the whole system revealed a barrier height of slightly above 0.2 eV going from bi- to the brd-position. A vibrational analysis showed that switching of the Fe atom is likely, when perturbed out of equilibrium in the brd- and bru- positions
Hliwa, Mohamed. "Traitement simplifie des interactions moleculaires en chimie quantique." Toulouse 3, 1988. http://www.theses.fr/1988TOU30038.
Повний текст джерелаMartin, Claudia. "Density functional study of the electronic and magnetic properties of selected transition metal complexes." Doctoral thesis, Technische Universitaet Bergakademie Freiberg Universitaetsbibliothek "Georgius Agricola", 2014. http://nbn-resolving.de/urn:nbn:de:bsz:105-qucosa-134958.
Повний текст джерелаHaghjoo, Farhad. "The synthesis and structural characterisation of a series of iodides and dipyridyl ketone based metal complexes with relevance to the Grätzel photovoltaic cell and single molecule magnets." Thesis, University of Manchester, 2014. https://www.research.manchester.ac.uk/portal/en/theses/the-synthesis-and-structural-characterisation-of-a-series-of-iodides-and-dipyridyl-ketone-based-metal-complexes-with-relevance-to-the-gratzel-photovoltaic-cell-and-single-molecule-magnets(18f7cd83-fa41-46b9-a5c8-a28e95a9b184).html.
Повний текст джерелаКниги з теми "Metal-Molecule-Metal structure"
Unimolecular and supramolecular electronics: Chemistry and physics meet at metal-molecule interfaces. Heidelberg: Springer, 2012.
Знайти повний текст джерелаЧастини книг з теми "Metal-Molecule-Metal structure"
Ueno, Nobuo, Satoshi Kera, and Kaname Kanai. "Fundamental Electronic Structure of Organic Solids and Their Interfaces by Photoemission Spectroscopy and Related Methods." In The Molecule-Metal Interface, 173–217. Weinheim, Germany: Wiley-VCH Verlag GmbH & Co. KGaA, 2013. http://dx.doi.org/10.1002/9783527653171.ch7.
Повний текст джерелаPetek, H., M. Feng, and J. Zhao. "Electronic Structure of Metal–Molecule Interfaces." In Current-Driven Phenomena in Nanoelectronics. Pan Stanford Publishing, 2010. http://dx.doi.org/10.1201/b11114-2.
Повний текст джерелаEnoki, Toshiaki, Morinobu Endo, and Masatsugu Suzuki. "Surface Properties and Gas Adsorption." In Graphite Intercalation Compounds and Applications. Oxford University Press, 2003. http://dx.doi.org/10.1093/oso/9780195128277.003.0010.
Повний текст джерела"Bio-Mediated Synthesis of Metal Nanomaterials for SERS Application." In Materials Research Foundations, 118–54. Materials Research Forum LLC, 2021. http://dx.doi.org/10.21741/9781644901571-5.
Повний текст джерелаTorres-Santillan, Esther, Selene Capula-Colindres, Gerardo Teran, Carmen M. Reza-San German, Miriam Estrada Flores, and Oscar Guadalupe Rojas Valencia. "Synthesis of Pt-Mo/WMCNTs Nanostructures Reduced by the Green Chemical Route and Its Electrocatalytic Activity in the ORR." In Carbon Nanotubes - Recent Advances, New Perspectives and Potential Applications [Working Title]. IntechOpen, 2022. http://dx.doi.org/10.5772/intechopen.106396.
Повний текст джерелаShajkumar, Aruni, and Ananthakumar Ramadoss. "Recent Advancements in Photocatalytic Nanocomposites." In Research Anthology on Synthesis, Characterization, and Applications of Nanomaterials, 952–72. IGI Global, 2021. http://dx.doi.org/10.4018/978-1-7998-8591-7.ch039.
Повний текст джерелаShajkumar, Aruni, and Ananthakumar Ramadoss. "Recent Advancements in Photocatalytic Nanocomposites." In Diverse Applications of Organic-Inorganic Nanocomposites, 136–61. IGI Global, 2020. http://dx.doi.org/10.4018/978-1-7998-1530-3.ch006.
Повний текст джерелаLowenstam, Heinz A., and Stephen Weiner. "Some Nonskeletal Functions in Biomineralization." In On Biomineralization. Oxford University Press, 1989. http://dx.doi.org/10.1093/oso/9780195049770.003.0012.
Повний текст джерелаHarris, Nadine, Logan K. Ausman, Jeffrey M. McMahon, David J. Masiello, and George C. Schatz. "Computational Electrodynamics Methods." In Computational Nanoscience, 147–78. The Royal Society of Chemistry, 2011. http://dx.doi.org/10.1039/bk9781849731331-00147.
Повний текст джерелаHejczyk, Tomasz, Jarosław Wrotniak, and Wiesław Jakubik. "Numerical Analysis of the Steady State in SAW Sensor Structures with Selected Polymers for Detection of DMMP and CO." In Metal-Oxide Gas Sensors. IntechOpen, 2023. http://dx.doi.org/10.5772/intechopen.109367.
Повний текст джерелаТези доповідей конференцій з теми "Metal-Molecule-Metal structure"
Wong, Eric K. L., and Geraldine L. Richmond. "Laser excitation spectroscopy: a probe of metal ion binding in polymers." In International Laser Science Conference. Washington, D.C.: Optica Publishing Group, 1986. http://dx.doi.org/10.1364/ils.1986.fg6.
Повний текст джерелаTomar, Aishwarya, and AK Shankhwar. "Design and Performance Investigation of Symmetrical Dual Gate Doping-less TFET for Biomolecule Recognition." In International Conference on Women Researchers in Electronics and Computing. AIJR Publisher, 2021. http://dx.doi.org/10.21467/proceedings.114.72.
Повний текст джерелаSharma, Brajendra K., Girma Biresaw, and Sevim Z. Erhan. "Adsorption Behavior of Heat Modified Soybean Oil via Boundary Lubrication Coefficient of Friction Measurements." In STLE/ASME 2008 International Joint Tribology Conference. ASMEDC, 2008. http://dx.doi.org/10.1115/ijtc2008-71292.
Повний текст джерелаFei, Haosheng, Xicheng Ai, Li Han, Ruijuan Nie, and Zhenhua Hu. "Surface Effect On The Nonlinear Optical Properties Of Transition Metal-Oxode Microcrystallites." In Nonlinear Optics. Washington, D.C.: Optica Publishing Group, 1992. http://dx.doi.org/10.1364/nlo.1992.we15.
Повний текст джерелаXiaochuan, Zeng, Li Xuejun, He Cuizhu, and Hu Qiaodan. "First-Principles Study on Adsorption Reaction of Oxygen Molecules on Fe (110) Crystal Surface." In 2022 29th International Conference on Nuclear Engineering. American Society of Mechanical Engineers, 2022. http://dx.doi.org/10.1115/icone29-92890.
Повний текст джерелаErhan, Sevim Z., and Brajendra K. Sharma. "Development and Tribochemical Evaluation of Biobased Antiwear Additive." In ASME 2005 International Mechanical Engineering Congress and Exposition. ASMEDC, 2005. http://dx.doi.org/10.1115/imece2005-81444.
Повний текст джерелаSemenova, S. N. "Functionalization of nickel-carbon nanocomposite with sodium polymethyl naphthalene sulfonate (C-3)." In 2022 33th All-Russian Youth Exhibition of Innovations. Publishing House of Kalashnikov ISTU, 2022. http://dx.doi.org/10.22213/ie022142.
Повний текст джерелаMcCarthy, Michael C., and R. W. Field. "Application of a sideband oodr Zeeman spectroscopy to diatomic molecules." In OSA Annual Meeting. Washington, D.C.: Optica Publishing Group, 1990. http://dx.doi.org/10.1364/oam.1990.wn2.
Повний текст джерелаOshikiri, Mitsutake, and Mauro Boero. "Water Molecule Adsorption Properties and Electronic Structures of Metal Oxide Photo-catalysts Designed for Water Decomposition." In 2006 International Conference on Nanoscience and Nanotechnology. IEEE, 2006. http://dx.doi.org/10.1109/iconn.2006.340712.
Повний текст джерелаReda, M. "The Principle of Nanoengines as a Tool for Designing Alloys and Controlling Corrosion Phenomena." In ASME 2008 6th International Conference on Nanochannels, Microchannels, and Minichannels. ASMEDC, 2008. http://dx.doi.org/10.1115/icnmm2008-62043.
Повний текст джерелаЗвіти організацій з теми "Metal-Molecule-Metal structure"
Hamers, Robert John. Ultra-stable Molecule-Surface Architectures at Metal Oxides: Structure, Bonding, and Electron-transfer Processes. Office of Scientific and Technical Information (OSTI), December 2013. http://dx.doi.org/10.2172/1109183.
Повний текст джерела