Preparation and characterizations of SnO2 nanopowder and spectroscopic (FT-IR, FT-Raman, UV-Visible and NMR) analysis using HF and DFT calculations

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 118, Issue , 2014, Pages 1135-1143

  Ayeshamariam, A ^a   Ramalingam, S ^b   Bououdina, M ^c   Jayachandran, M ^d  

^a KHADIR MOHIDEEN COLLEGE   (India)

^b A V C COLLEGE AUTONOMOUS   (India)

^c UNIVERSITY OF BAHRAIN   (Bahrain)

^d CENTRAL ELECTROCHEMICAL RESEARCH INSTITUTE   (India)

Author keywords

Bulk phase of SnO2; Kubo gap; NMR and UV Visible spectra; Photoluminescence; SnO2

Indexed keywords

BULK PHASE; FTIR AND FT-RAMAN SPECTRA; FUNDAMENTAL FREQUENCIES; HF AND DFT CALCULATIONS; KUBO GAP; PHOTOLUMINESCENCE SPECTRUM; SNO2; UV-VISIBLE SPECTRA;

PHOTOLUMINESCENCE; SOL-GELS;

SPECTROSCOPIC ANALYSIS;

TIN DERIVATIVE; TIN DIOXIDE;

ARTICLE; BULK PHASE OF SNO(2); CHEMICAL STRUCTURE; CHEMISTRY; INFRARED SPECTROSCOPY; KUBO GAP; LUMINESCENCE; NMR AND UV-VISIBLE SPECTRA; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PHOTOLUMINESCENCE; POWDER; QUANTUM THEORY; RAMAN SPECTROMETRY; SNO(2); ULTRAVIOLET SPECTROPHOTOMETRY;

BULK PHASE OF SNO(2); KUBO GAP; NMR AND UV-VISIBLE SPECTRA; PHOTOLUMINESCENCE; SNO(2);

LUMINESCENCE; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, MOLECULAR; POWDERS; QUANTUM THEORY; SPECTROPHOTOMETRY, ULTRAVIOLET; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN; TIN COMPOUNDS;

EID: 84886149380     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2013.09.030     Document Type: Article

References (40)

1. D. Duonghong, J. Ramsden, and M. Gratzell Charge carrier trapping and recombination dynamics in small semicondctor nanoparticles J. Am. Chem. Soc. 104 1982 2977
2. L.E. Brus Carrier confinement and special crystal dimensions in layered semiconductor nanostructures J. Chem. Phys. 80 1984 4403
3. H. Weller Crystallographically oriented mesoporous WO3 films: synthesis, characterization, and applications Adv. Mater. 5 1993 88
4. Y. Wang, and N. Herron Nanometer-sized semiconductor clusters: materials synthesis, quantum size effects and photophysical properties J. Phys. Chem. 95 1991 525
5. J. Watson Microstructural characterization of sensors based on electronic ceramic materials Sens. Actuators 5 1984 29
6. S. Ferrere, A. Zaban, and B.A. Gregg Molecular design of sensitizers for dye-sensitized solar cells J. Phys. Chem. B 101 1997 4490
7. 2 quantum dots embedded in a polyimide layer Phys. Rev. B 49 1994 282
8. J.R. Brown, P.W. Haycock, L.M. Smith, A.C. Jones, and E.W. Williams Response behaviour of tin oxide thin film gas sensors grown by MOCVD Sens. Actuators B 63 2000 109
9. 2 matrix J. Cryst. Growth 255 2003 357
10. L.M. Liz-Marzan, and P.V. Kamat Magnetic nanoparticles with functional silanes: evolution of well-defined shells from anhydride containing silane Nanoscale Mater. 35 2003 97 118
11. G. C Hadijipanyis, and R.W. Siegel Synthesis and characterization of nanocrystalline iron aluminide particles Nanophase Mater. 4 1994 121
12. ZL. Wang Materials Enhancing the electrical and optoelectronic performance of nanobelt devices by molecular surface functionalization Prop. Dev. Metal Semicond. Nanowires 1 2003 (Nature of the band gap of In(2)O(3) revealed by first-principles calculations and X-ray spectroscopy)
13. 2 nanowires fabricated by thermal evaporation and annealed in different ambient Phys. Rev. Lett. 41 1978 1750
14. 4-tpp) J. Phys. Chem. 92 1988 822
15. N.Y. Shishkin, I.M. Zharsky, V.G. Lugin, and V.G. Zarapin Air sensitive tin dioxide thin films by magnetron sputtering and thermal oxidation technique Actuators B 48 1998 403
16. T. Hanrath, and B.A. Korgel J. Am. Chem. Soc. B 124 2002 1424 1429
17. M.J. Frisch Gaussian 09, Revision A.1 2009 Gaussian, Inc. Wallingford, CT
18. Z. Zhengyu, and D. Dongmei J. Mol. Struct. (Theochem) 505 2000 247 252
19. Z. Zhengyu, F. Aiping, and D. Dongmei J. Quantum Chem. 78 2000 186 189
20. A.D. Becke Phys. Rev. A 38 1988 3098 3101
21. C. Lee, W. Yang, and R.G. Parr Phys. Rev. B 37 1988 785 790
22. A.D. Becke J. Chem. Phys. 98 1993 5648 5652
23. J.P. Perdew, K. Burke, and Y. Wang Phys. Rev. B 54 1996 16533 16537
24. D.C. Young Computational Chemistry: A Practical guide for applying Techniques to Real world Problems (Electronic) 2001 John Wiley and Sons Inc. New York
25. J. Baker, A.A. Jarzecki, and P. Pulay J. Phys. Chem. A 102 1998 1412 1424
26. SQM version 1.0, Scaled Quantum Mechanical Force Field, 2013 Green Acres Road, 18 Fayetteville, Arkansas 72703.
27. G. Socrates Infrared and Raman Characteristics Group Frequencies third ed. 2001 Wiley New York
28. V. Baranauskas, M. Fontana, Z.J. Guo, H.J. Ceragioli, and A.C. Peterlevitz Fieldemission properties of nanocrystalline tin oxide films Sens. Actuators B Chem. 107 2005 474 478
29. 2 J. Appl. Phys. 75 3 1994 1835 1836
30. P. Manjula, L. Satyanarayana, Y. Swarnalatha, and Sunkara V. Manora Sens. Actuators B 138 2009 28 34
31. S. Yang, and L. Gao Facile and surfactant-free route nanocrystalline mesoporous tin oxide J. Am. Ceram. Soc. 89 5 2006 1742 1744
32. 2 Catal. Today 70 2001 139 154
33. Emil. Roduner Chem. Soc. Rev. 35 2006 583 592
34. S.I. Gorelsky, SWizard Program Revision 4.5, University of Ottawa, Ottawa, Canada, 2010. < http://www.sg.chem.net/ >.
35. C.G. Granqvist, and A. Hultaker Transparent and conducting ITO films: new developments and applications Thin Solid Films 411 2002 1
36. C. Huang, Z. Tang, and Z. Zhang Electrodeposition of lanthanum hydroxide-polyethylenimine films J. Am. Cerm. Soc. 84 2001 1637
37. R.D. Purohit, B.P. Sharma, K.T. Pillai, and A.K. Tyagi Morphology control of Ce0.9Gd0.1O1.95 nanopowder synthesized by sol-gel method using PVP as a surfactant Mater. Res. Bull. 36 2001 2711
38. M. Girtan, G.I. Rusu, G.G. Rusu, and S. Gurlui Influence of oxidation conditions on the properties of indium oxide thin films Appl. Surf. Sci. 492 2000 162
39. 2 nanoparticles dispersed in conducting polymer Chem. Phys. Lett. 372 2003 451
40. 2 Solid State Commun. 127 2003 595