Sensing mechanism of SnO2(1 1 0) surface to H2: Density functional theory calculations

Sensors and Actuators, B: Chemical

Volumn 220, Issue , 2015, Pages 279-287

  Chen, Yanping ^a   Wang, Xiaofeng ^a,b   Shi, Changmin ^a   Li, Ling ^a   Qin, Hongwei ^a   Hu, Jifan ^a  

^a SHANDONG UNIVERSITY   (China)

^b DALIAN UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

DFT; Gas sensor; H2; Sensing mechanism; SnO2

Indexed keywords

ATOMS; CHEMICAL SENSORS; OXYGEN;

AMBIENT ATMOSPHERE; ELECTRON RELEASE; ELECTRON TRANSFER; OXYGEN CONCENTRATIONS; REDUCTION DEGREE; SENSING MECHANISM; SNO2; STRUCTURAL RECONSTRUCTION;

DENSITY FUNCTIONAL THEORY;

EID: 84936743399     PISSN: 09254005     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.snb.2015.05.061     Document Type: Article

References (52)

1. W.T. Hsieh, Y.K. Fang, W.J. Lee, K.H. Wu, J.J. Ho, K.H. Chen, and S.Y. Huang An a-SiGe: H phototransistor integrated with a Pd film on glass substrate for hydrogen monitoring IEEE Trans. Electron Dev. 47 2000 939 943
2. M.S. Dresselhaus, and I.L. Thomas Alternative energy technologies Nature 414 2001 332 337
3. 2 film contacted with Pd electrode Sens. Actuators B 93 2003 519 525
4. 0.76 as (MOS) high electron mobility transistor (HEMT)-based hydrogen sensor IEEE Sens. J. 6 2006 287 292
5. 0.7 As Schottky diodes Sens. Actuators B 117 2006 151 158
6. S. Sumida, S. Okazaki, S. Asakura, H. Nakagawa, H. Murayama, and T. Hasegawa Distributed hydrogen determination with fiber-optic sensor Sens. Actuators B 108 2005 508 514
7. S. Okazaki, H. Nakagawa, S. Asakura, Y. Tomiuchi, N. Tsuji, H. Murayama, and M. Washiya Sensing characteristics of an optical fiber sensor for hydrogen leak Sens. Actuators B: Chem. 93 2003 142 147
8. 2 nano-thin films Sens. Actuators B: Chem. 178 2013 418 425
9. 2 film on anodic aluminum oxide Sens. Actuators B: Chem. 140 2009 109 115
10. 2 films Appl. Surf. Sci. 126 1998 57 64
11. 2 and ZnO thin-film resistive sensors to hydrocarbons, carbon monoxide and hydrogen Sens. Actuators B 10 1992 11 14
12. N.S. Baik, G. Sakai, N. Miura, and N. Yamazoe Hydrothermally treated sol solution of tin oxide for thin-film gas sensor Sens. Actuators B 63 2000 74 79
13. W. Shin, M. Matsumiya, F. Qiu, N. Izu, and N. Murayama Thermoelectric gas sensor for detection of high hydrogen concentration Sens. Actuators B 97 2004 344 347
14. N. Maffei, and A.K. Kuriakose A solid-state potentiometric sensor for hydrogen detection in air Sens. Actuators B 98 2004 73 76
15. Y.M. Wong, W.P. Kang, J.L. Davidson, A. Wisitsora-at, and K.L. Soh A novel microelectronic gas sensor utilizing carbon nanotubes for hydrogen gas detection Sens. Actuators B 93 2003 327 332
16. W.P. Jakubik, M.W. Urbanczyk, S. Kochowski, and J. Bodzenta Palladium and phthalocyanine bilayer films for hydrogen detection in a surface acoustic wave sensor system Sens. Actuators B 96 2003 321 328
17. D.R. Baselt, B. Fruhberger, E. Klaassen, S. Cemalovic, C.L. Britton Jr., S.V. Patel, T.E. Mlsna, D. McCorkle, and B. Warmack Design and performance of a microcantilever-based hydrogen sensor Sens. Actuators B 88 2003 120 131
18. J.B. William, B.P. Matthew, B. Robert, and R. Carl An overview of hydrogen safety sensors and requirements Int. J. Hydrogen Energy 36 2011 2462 2470
19. L. Boon-Brett, J. Bousek, G. Black, P. Moretto, P. Castello, T. Hübert, and U. Banach Identifying performance gaps in hydrogen safety sensor technology for automotive and stationary applications Int. J. Hydrogen Energy 35 2010 373 384
20. L. Boon-Brett, J. Bousek, and P. Moretto Reliability of commercially available hydrogen sensors for detection of hydrogen at critical concentrations: Part II - selected sensor test results Int. J. Hydrogen Energy 34 2009 562 571
21. 2 nanomaterials Proc. Chem. 1 2009 1423 1426
22. G. Tournier, and C. Pijolat Influence of oxygen concentration in the carrier gas on the response of tin dioxide sensor under hydrogen and methane Sens. Actuators B: Chem. 61 1999 43 50
23. 2 nanofibers Sens. Actuators B: Chem. 150 2010 806 810
24. 2 nanowires J. Alloys Compd. 488 2009 L21 L25
25. 2 nanoscale-particle films with platinum electrodes Sens. Actuators B: Chem. 146 2010 145 153
26. 2 gas detection Proc. Eng. 36 2012 476 481
27. 2 composite nanofibers Sens. Actuators B: Chem. 147 2010 111 115
28. 4 and LPG Microelectron. J. 29 1998 861 874
29. 2 nanomaterials Sens. Actuators B: Chem. 154 2011 264 269
30. 2 in different oxygen backgrounds Sens. Actuators B 157 2011 510 517
31. 2(1 1 0) studied by first-principles methods Surf. Sci. 513 2002 26 36
32. 2 surfaces studied by first-principles calculations Surf. Sci. 463 2000 93 101
33. 2(1 1 0) surface Surf. Sci. 339 1995 258 271
34. V. Lantto, T.T. Rantala, and T.S. Rantala Atomistic understanding of semiconductor gas sensors J. Eur. Ceram. Soc. 21 2001 1961 1965
35. 2(1 1 0) surface Sens. Actuators B 65 2000 375 378
36. 2(1 1 0) surface Phys. Rev. B 64 2001 075407
37. 2(1 1 0) surface Mater. Sci. Semicond. Process. 3 2000 103 107
38. 2(1 1 0) surfaces Phys. Rev. B 65 2002 245428
39. 2(1 1 0) surface Surf. Sci. 577 2005 127 138
40. 2 Surf. Sci. 511 2002 408 420
41. 2: a first-principles density functional approach with an empirical correction of van der Waals interactions Phys. Rev. B 77 2008 045332
42. 2(1 1 0) surface and the property of oxygen adsorption Chin. J. Sens. Actuators 20 2007 2364 2368
43. 2+) nanocomposite Sens. Actuators B: Chem. 160 2011 455 462
44. 2 from first-principles Phys. B: Condens. Matter 405 2010 3458 3462
45. 2-based sensor for hydrogen and carbon monoxide J. Nanomater. 2012 2012 1
46. 2(1 1 0) surface to CO: density functional theory calculations J. Phys. Chem. C 118 2014 28548 28561
47. B. Delley An all-electron numerical method for solving the local density functional for polyatomic molecules J. Chem. Phys. 92 1990 508 517
48. B. Delley From molecules to solids with the DMol approach J. Chem. Phys. 113 2000 7756 7764
49. 2(1 1 0) Surf. Sci. 524 2003 49 62
50. 3(0 1 0) surface: a first-principles study J. Phys. Chem. C 115 2011 5593 5598
51. 2O(1 1 1)/CO Surf. Sci. 373 1997 21 32
52. 2O(1 1 1) Surf. Sci. 430 1999 137 145