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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - Enrique Abad
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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - neues Buch

1, ISBN: 9783642309069

[ED: Buch], [PU: Springer-Verlag GmbH], Neuware - In recent years, ever more electronic devices have started to exploit the advantages of organic semiconductors. The work reported in this thesis focuses on analyzing theoretically the energy level alignment of different metal/organic interfaces, necessary to tailor devices with good performance. Traditional methods based on density functional theory (DFT), are not appropriate for analyzing them because they underestimate the organic energy gap and fail to correctly describe the van der Waals forces.Since the size of these systems prohibits the use of more accurate methods, corrections to those DFT drawbacks are desirable. In this work a combination of a standard DFT calculation with the inclusion of the charging energy (U) of the molecule, calculated from first principles, is presented. Regarding the dispersion forces, incorrect long range interaction is substituted by a van der Waals potential. With these corrections, the C60, benzene, pentacene, TTF and TCNQ/Au(111) interfaces are analyzed, both for single molecules and for a monolayer. The results validate the induced density of interface states model., DE, [SC: 1.40], Neuware, gewerbliches Angebot, 244x164x18 mm, 198, [GW: 459g], offene Rechnung (Vorkasse vorbehalten), sofortueberweisung.de, Selbstabholung und Barzahlung, Skrill/Moneybookers, PayPal, Lastschrift, Banküberweisung, Internationaler Versand

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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts : From Interfaces to Molecular Electronics - Enrique Abad
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Enrique Abad:
Energy Level Alignment and Electron Transport Through Metal/Organic Contacts : From Interfaces to Molecular Electronics - neues Buch

2012, ISBN: 3642309062

ID: 9814581119

[EAN: 9783642309069], Neubuch, [SC: 0.0], [PU: Springer-Verlag Gmbh Sep 2012], OPTIK; SCIENCE / CHEMISTRY PHYSICAL & THEORETICAL; PHYSICS MATHEMATICAL COMPUTATIONAL; CONDENSED MATTER; TECHNOLOGY ENGINEERING MATERIALS, Neuware - In recent years, ever more electronic devices have started to exploit the advantages of organic semiconductors. The work reported in this thesis focuses on analyzing theoretically the energy level alignment of different metal/organic interfaces, necessary to tailor devices with good performance. Traditional methods based on density functional theory (DFT), are not appropriate for analyzing them because they underestimate the organic energy gap and fail to correctly describe the van der Waals forces.Since the size of these systems prohibits the use of more accurate methods, corrections to those DFT drawbacks are desirable. In this work a combination of a standard DFT calculation with the inclusion of the charging energy (U) of the molecule, calculated from first principles, is presented. Regarding the dispersion forces, incorrect long range interaction is substituted by a van der Waals potential. With these corrections, the C60, benzene, pentacene, TTF and TCNQ/Au(111) interfaces are analyzed, both for single molecules and for a monolayer. The results validate the induced density of interface states model. 198 pp. Englisch

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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - Enrique Abad
Vergriffenes Buch, derzeit bei uns nicht verfügbar.
(*)
Enrique Abad:
Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - neues Buch

1, ISBN: 9783642309069

[ED: Buch], [PU: Springer-Verlag GmbH], Neuware - In recent years, ever more electronic devices have started to exploit the advantages of organic semiconductors. The work reported in this thesis focuses on analyzing theoretically the energy level alignment of different metal/organic interfaces, necessary to tailor devices with good performance. Traditional methods based on density functional theory (DFT), are not appropriate for analyzing them because they underestimate the organic energy gap and fail to correctly describe the van der Waals forces. Since the size of these systems prohibits the use of more accurate methods, corrections to those DFT drawbacks are desirable. In this work a combination of a standard DFT calculation with the inclusion of the charging energy (U) of the molecule, calculated from first principles, is presented. Regarding the dispersion forces, incorrect long range interaction is substituted by a van der Waals potential. With these corrections, the C60, benzene, pentacene, TTF and TCNQ/Au(111) interfaces are analyzed, both for single molecules and for a monolayer. The results validate the induced density of interface states model., DE, [SC: 0.00], Neuware, gewerbliches Angebot, FixedPrice, 198, [GW: 459g], offene Rechnung (Vorkasse vorbehalten), PayPal, Banküberweisung

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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - Enrique Abad
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(*)
Enrique Abad:
Energy Level Alignment and Electron Transport Through Metal/Organic Contacts - neues Buch

ISBN: 9783642309069

ID: 9783642309069

Physics; Surface and Interface Science, Thin Films; Optical and Electronic Materials; Theoretical, Mathematical and Computational Physics; Theoretical and Computational Chemistry; Surfaces and Interfaces, Thin Films Benzene/Au(111) Interface, C60/Au(111) Interface, DFT-LDA Calculation, Energy Level Alignment, IDIS Model, Induced Density of Interface States, Metal-organic Interfaces, Molecular Electronics, Organic Electronics, Outstanding PhD Thesis, Pentacene/Au(111) Interface, TCNQ/Au(111) Interface Books, Springer Nature

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This book focuses on analyzing theoretically the energy level alignment of different metal/organic interfaces. It presents a combination of a standard DFT calculation with the inclusion of the charging energy (U) of the molecule. Versandkosten:zzgl. Versandkosten.
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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts From Interfaces to Molecular Electronics - Abad, Enrique
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Energy Level Alignment and Electron Transport Through Metal/Organic Contacts From Interfaces to Molecular Electronics - gebunden oder broschiert

2012, ISBN: 3642309062

ID: A19906842

Gebundene Ausgabe Optik, SCIENCE / Chemistry / Physical & Theoretical, SCIENCE / Physics / Mathematical & Computational, SCIENCE / Physics / Condensed Matter, TECHNOLOGY & ENGINEERING / Materials Science, Mathematische Physik, Quanten- und theoretische Chemie, Oberflächenchemie und Adsorption, Materialwissenschaft, Elektronische Geräte und Materialien, mit Schutzumschlag neu, [PU:Springer-Verlag GmbH; Springer Berlin]

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