Copied Energy Level Alignment and Electron Transport Through Metal/Organic Contacts
Energy Level Alignment and Electron Transport Through Metal/Organic Contacts
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.
Price Comparison
| Seller | Contact Seller | List Price | On Sale | Shipping | Best Promo | Final Price | Volume Discount | Financing | Availability | Seller's Page |
|---|---|---|---|---|---|---|---|---|---|---|
|
BEST PRICE 1 Product Purchase
|
|
$84.99 | $84.99 |
|
$84.99 | See Site | In stock | Visit Store |
Reviews
Questions & Answers
Managing Population Decline in Europe's Urban and Rural Areas
$54.99
Personality and Individual Differences
$119.99
My Recordable Storytime- Miracle on 34th Street by Valentine Davies Estate
$24.99
Contemporary Love Studies in the Arts and Humanities
$44.99
The Global Gym
$54.99
Fourier Transforms, Filtering, Probability and Random Processes
$54.99
Citizenship, Democracy and Higher Education in Europe, Canada and the USA
$54.99
Verwaltung im digitalen Zeitalter
$49.99
Agile Processes in Software Engineering and Extreme Programming
$39.99
Policy Decision Modeling with Fuzzy Logic
$169.99
3D-Spannungsanalyse von linear elastisch homogenen Krpern
$17.99
Medizinische Akutversorgung nach sexualisierter Gewalt
$59.99
The Zinc/Bromine Flow Battery
$69.99
Pump It Up
$39.99
Konkurrierende Verfahren in der Gefchirurgie
$59.99
Celluloseesterlacke
$49.99
Adult Education in Neoliberal Times
$119.99
Advances in Design for Inclusion
$219.99
Scheduling Computer and Manufacturing Processes
$169.99
Die betriebswirtschaftliche Erfassung der Transportkosten
$54.99
Rapid On-Site Evaluation (ROSE) in Diagnostic Interventional Pulmonology
$219.99
Die Vervielfltigung von Zeichnungen insbesondere von technischen Zeichnungen
$79.99
Insolvenzprognosen aus aktienrechtlichen Jahresabschlssen
$69.99
Natural Products and Cancer Drug Discovery
$129.00
Applications of Discrete-time Markov Chains and Poisson Processes to Air Pollution Modeling and Stud
$49.95
Frontiers in Cyber Security
$79.99
Frames in the Toxicity Controversy
$129.00
Competence Management and Competitive Product Development
$169.99
Atonement by Ian Mcewan
$17.00
Complex Networks & Their Applications IX
$329.99
Ethnic Diversity and Public Policy
$84.99
Complex Manifolds
$54.99
Data Mining and Big Data
$59.99
King James VI and I and the History of Homosexuality
$109.99
Dames de Lettres
$59.99
Wildflowers of the Midwest, A Field Guide to Over 600 Wildflowers in the Region by Don Kurz
$29.95
Genetics and Genomics of Cucurbitaceae
$199.99
Contingent Convertible Bonds, Corporate Hybrid Securities and Preferred Shares
$79.99
SmartShadow: Models and Methods for Pervasive Computing
$109.99
ffentliche Heizkraftwerke und Elektrizittswirtschaft in Stdten
$84.99
