2008
DOI: 10.1007/s12034-008-0012-6
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MOCVD of ZrO2 films from bis(t-butyl-3-oxo-butanoato)zirconium(IV): some theoretical (thermodynamic) and experimental aspects

Abstract: The equilibrium concentrations of various condensed and gaseous phases were calculated from thermodynamic modeling of MOCVD of ZrO 2 films using a β-ketoesterate complex of zirconium as precursor. This leads to the construction of the 'CVD phase stability diagram' for the formation of solid phases. In the reactive ambient of oxygen, the calculations predict carbon-free ZrO 2 film over a wide range of process conditions. The thermodynamic yields are in reasonable agreement with experimental observations, though… Show more

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Cited by 13 publications
(6 citation statements)
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“…The bands at 519 cm -1 and 792 cm -1 correspond to various vibrations of the Zr-O bond. Dhar [14] investigated ZrO 2 thin films deposited by MOCVD technique using beta ketoesterate complex and obtained similar type of microstructure.…”
Section: Resultsmentioning
confidence: 86%
“…The bands at 519 cm -1 and 792 cm -1 correspond to various vibrations of the Zr-O bond. Dhar [14] investigated ZrO 2 thin films deposited by MOCVD technique using beta ketoesterate complex and obtained similar type of microstructure.…”
Section: Resultsmentioning
confidence: 86%
“…The approach requires the identification of all the possible reactants and reaction products. The procedure for enumerating the gaseous species to be considered in the calculations, by consulting the mass spectrum of the precursor and employing 'chemical reasoning', is described in our earlier publications (Mukhopadhyay et al 2002a, b;Dhar et al 2008). For the CVD process with Fe(tbob) 3 as precursor, every possible solid product was considered for the analytical study.…”
Section: Analyticalmentioning
confidence: 99%
“…These are listed in table 1, along with the possible gaseous products. Calculations were performed, as described earlier (Mukhopadhyay et al 2002a, b;Dhar et al 2008), to obtain the concentrations of the various possible solid and gaseous products of the MOCVD process, as functions of substrate temperature (T sub ), total reactor pressure (P), and the ratio of the molar flow rates of oxygen and the vapour of the metalorganic precursor (O 2 /Pre). The corresponding phase stability diagrams were also constructed.…”
Section: Analyticalmentioning
confidence: 99%
“…Sarin (1995) has demonstrated that partial or complete coupling of modeling, based on fundamental principles related to equilibrium thermodynamics and process kinetics, and the corresponding experimentations, can be effectively used systematically to develop customized CVD coatings. Thermodynamic modeling has also been employed to analyse the MOCVD process for thin films of RuO 2 (Kang et al 2000), Cu (Mukhopadhyay et al 2002a, b), ZrO 2 (Baum and Larson 1993;Fredriksson and Forsgren 1995;Dhar et al 2008a) and iron oxides (Dhar et al 2008b). Such analysis computes the compositions of the thin films and the gaseous products as functions of parameters such as temperature, pressure, and partial pressure of various gases.…”
Section: Introductionmentioning
confidence: 99%