First-principles study on NO2-adsorbed tungsten oxide nanowires for sensing application

Journal of Alloys and Compounds

Volumn 587, Issue , 2014, Pages 227-233

  Qin, Yuxiang ^a   Hua, Deyan ^a   Liu, Mei ^a  

^a TIANJIN UNIVERSITY   (China)

Author keywords

Density functional calculations; Gas adsorption; Gas sensor; Nanowire; Tungsten oxide

Indexed keywords

ADSORPTION ENERGIES; ELECTRON POPULATION; FIRST-PRINCIPLES CALCULATION; FIRST-PRINCIPLES STUDY; MULLIKEN POPULATION ANALYSIS; SENSING APPLICATIONS; TUNGSTEN OXIDE; TUNGSTEN OXIDE NANOWIRES;

CALCULATIONS; CHEMICAL SENSORS; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; GAS ADSORPTION; GAS DETECTORS; NITROGEN OXIDES; OXIDES; POSITIVE IONS; TUNGSTEN; TUNGSTEN COMPOUNDS;

NANOWIRES;

EID: 84888110670     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2013.10.079     Document Type: Article

References (37)

1. G. Eranna, B.C. Joshi, D.P. Runthala, and R.P. Gupta Oxide materials for development of integrated gas sensors - a comprehensive review Crit. Rev. Solid State Mater. Sci. 29 2004 111 188 (Pubitemid 40184933)
2. 2 gas dependent on process condition Sens. Actuators B 60 1999 49 55
3. 3 nanorods as photoelectrodes for dye-sensitized solar cells J. Alloys Comp. 547 2013 113 117
4. 3 nanowires on carbon papers: electronic transport, improved ultraviolet-light photodetectors and excellent field emitters J. Mater. Chem. 21 2011 6525 6530
5. 49 nanowires J. Crystal Growth 310 2008 462 466 (Pubitemid 350297260)
6. 3 nanowires/nanorods using EDTA salts J. Alloys Comp. 475 2009 446 451
7. 3 nanowires Appl. Phys. A 85 2006 241 246 (Pubitemid 44599955)
8. R.A. Gerlitz, K.D. Benkstein, D.L. Lahr, J.L. Hertz, C.B. Montgomery, J.E. Bonevich, S. Semancik, and M.J. Tarlov Fabrication and gas sensing performance of parallel assemblies of metal oxide nanotubes supported by porous aluminum oxide membranes Sens. Actuators B 136 2009 257 264
9. 2-sensing properties of tungsten oxide nanostructures Sens. Actuators B 150 2010 339 345
10. 2 gas sensor applications J. Alloy Comp. 509 2011 8401 8406
11. 3) nanorods ethanol sensing Chin. Phys. B 20 2011 050701 050716
12. K.M. Neyman, and F. Illas Theoretical aspects of heterogeneous catalysis: applications of density functional methods Catal. Today 105 2005 2 16
13. 2 surface Sens. Actuators B 60 2007 62 67 (Pubitemid 47381418)
14. 3 surfaces: First principle study Sens. Actuators B 160 2011 505 510
15. M. Breedon, M.J.S. Spencer, and I. Yarovsky Adsorption of NO and NO2 on the ZnO(2110) surface. A DFT study Surf. Sci. 603 2009 3389 3399
16. 2, NO, O, and N with the ZnO (1010) surface J. Phys. Chem. C 114 2010 10881 10893
17. 3 (0 0 2) surfaces Chin. Phys. B 20 2011 102101 102108
18. R. Delamare, M. Gillet, E. Gillet, and P. Guaino Structure and electrical properties of tungsten oxide nanorods epitaxially organized on a mica substrate Surf. Sci. 601 2007 2675 2679 (Pubitemid 46964860)
19. C.H. Chen, S.J. Wang, R.M. Ko, Y.C. Kuo, K.M. Uang, T.M. Chen, B.W. Liou, and H.Y. Tsai The influence of oxygen content in the sputtering gas on the self-synthesis of tungsten oxide nanowires on sputter-deposited tungsten films Nanotechnology 17 2006 217 223
20. M. Gao, S. You, and Y. Wang First-principles study of silicon nanowires with different surfaces Jpn. J. Appl. Phys. 47 2008 3303 3309
21. W.B. Hu, Y.M. Zhao, Z.L. Liu, C.W. Dunnill, D.H. Gregory, and Y.Q. Zhu Nanostructural evolution: from one-dimensional tungsten oxide nanowires to three-dimensional ferberite flowers Chem. Mater. 20 2008 5657 5665
22. S.B. Sun, Y.M. Zhao, Y.D. Xia, Z.D. Zou, G.H. Min, and Y.Q. Zhou Bundled tungsten oxide nanowires under thermal processing Nanotechnology 19 2008 305709 305716
23. Y.F. Li, Z. Zhou, Y.S. Chen, and Z.F. Chen Do all wurtzite nanotubes prefer faceted ones? J. Chem. Phys. 130 2009 204706 204712
24. D.B. Migas, V.L. Shaposhnikov, and V.E. Borisenko Tungsten oxides. II. The metallic nature of Magnéli phases J. Appl. Phys. 108 2010 093714 093721
25. T. Vo, A.J. Williamson, and G. Galli First principles simulations of the structural and electronic properties of silicon nanowires Phys. Rev. B 74 2006 045116 045128
26. 3 thin films Thin Solid Films 467 2004 239 246
27. C.B.E. Santos, and T.M. Schmidt Direct band gap GaP nanowires predicted through first principles J. Appl. Phys. 108 2010 103715 103721
28. C. Filippi, D.J. Singh, and C.J. Umriga All-electron local-density and generalized-gradient calculations of the structural properties of semiconductors Phys. Rev. B 50 1994 14947 14952
29. Z. Zhou, J.J. Zhao, Y.S. Chen, P.V.R. Schleyer, and Z.F. Chen Energetics and electronic structures of AlN nanotubes/wires and their potential application as ammonia sensors Nanotechnology 18 2007 424023 424031
30. 2 surface-supported Pd Pt and Au. Appl. Surf. Sci. 258 2012 3298 3301
31. Y. Shi, M. Wang, C. Hong, Z. Yang, J. Deng, X. Song, L. Wang, J. Shao, H. Liu, and Y. Ding Multi-junction joints network self-assembled with converging ZnO nanowires as multi-barrier gas sensor Sens. Actuators B 177 2013 1027 1034
32. Y.S. Kim, S.C. Ha, K. Kim, H. Yang, and S.Y. Choi Room-temperature semiconductor gas sensor based on nonstoichiometric tungsten oxide nanorod film Appl. Phys. Lett. 86 2005 213105 213107
33. x catalysts, in: V.H. Grassian (Ed.), Environmental Catalysis, CRC Press, Taylor and Francis Group, 2005, pp. 211-232 (Chapter 9).
34. 2 sensor Sens. Actuators B 94 2003 343 351
35. 3 sensors Sens. Actuators B 77 2001 264 267 (Pubitemid 32544359)
36. F. Shao, M.W.G. Hoffmann, J.D. Prades, J.R. Morante, N. López, and F. Hernández-Ramírez Interaction mechanisms of ammonia and tin oxide: a combined analysis using single nanowire devices and DFT calculations J. Phys. Chem. C 117 2013 3520 3526
37. 2 detection Sens. Actuators B 126 2007 18 23 (Pubitemid 47374453)