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  Designing multifunctional chemical sensors using Ni and Cu doped carbon nanotubes

Mowbray, D., Garca-Last, J., Thygesen, K., Rubio, A., & Jacobsen, K. (2010). Designing multifunctional chemical sensors using Ni and Cu doped carbon nanotubes. Physica Status Solidi B-Basic Solid State Physics, 247(11-12), 2678-2682. doi:10.1002/pssb.201000171.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-0011-2A6D-0 Version Permalink: https://hdl.handle.net/11858/00-001M-0000-002B-232B-3
Genre: Conference Paper

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1004.5334v1.pdf (Preprint), 573KB
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https://hdl.handle.net/11858/00-001M-0000-002B-232C-1
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1004.5334v1.pdf
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arXiv:1004.5334v1 [cond-mat.mes-hall] 29 Apr 2010
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 Creators:
Mowbray, D.J. 1, 2, Author
Garca-Last, J.M.1, 2, Author
Thygesen, K.S.2, Author
Rubio, Angel1, 3, Author           
Jacobsen, K.W. 2, Author
Affiliations:
1Nano-Bio Spectroscopy Group and ETSF Scientific Development Centre, Dpto. Fı´sica de Materiales, Universidad del Paı´s Vasco, Centro de Fı´sica de Materiales CSIC-UPV/EHU-MPC and DIPC, Av. Tolosa 72, 20018 San Sebastia´n, Spain, ou_persistent22              
2Center for Atomic-scale Materials Design, Department of Physics, Technical University of Denmark, 2800 Kgs. Lyngby, Denmark , ou_persistent22              
3Theory, Fritz Haber Institute, Max Planck Society, D-14195 Berlin, Germany, ou_634547              

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 Abstract: We demonstrate a “bottom up” approach to the computational design of a multifunctional chemical sensor. General techniques are employed for describing the adsorption coverage and resistance properties of the sensor based on density functional theory and non-equilibrium Green's function methodologies, respectively. Specifically, we show how Ni and Cu doped metallic (6,6) single-walled carbon nanotubes may work as effective multifunctional sensors for both CO and NH3

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Language(s): eng - English
 Dates: 2010-10-042010
 Publication Status: Issued
 Pages: 5
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1002/pssb.201000171
 Degree: -

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Title: IWEPNM 2010 - 24th International Winterschool on Electronic Properties of Novel Materials - Molecular Nanostructures
Place of Event: Tirol, Austria
Start-/End Date: 2010-03-06 - 2010-03-13

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Title: Physica Status Solidi B-Basic Solid State Physics
Source Genre: Journal
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Publ. Info: Berlin : Akademie-Verlag
Pages: - Volume / Issue: 247 (11-12) Sequence Number: - Start / End Page: 2678 - 2682 Identifier: ISSN: 0370-1972
CoNE: https://pure.mpg.de/cone/journals/resource/958480240330_2