1. Elastic modulus of amorphous boron suboxide thin films studied by theoretical and experimental methods.
- Author
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Music, Denis, Kreissig, Ulrich, Chirita, Valeriu, Schneider, Jochen M., and Helmersson, Ulf
- Subjects
BORON ,THIN films ,PHYSICS - Abstract
Boron suboxide BO[sub x] thin films have been deposited on Si (100) by reactive rf magnetron sputtering of B powders in an Ar/O[sub 2] atmosphere. Elastic recoil detection analysis and x-ray diffraction were used to study the influence of the O incorporation on the film composition and structure and relate them to mechanical properties, which were evaluated by nanoindentation. As x in BOx was increased from 0.08 to 0.18, the elastic modulus of the x-ray amorphous films decreased from 273 to 231 GPa, by 15%. This can be understood using classical molecular dynamics (MD) with a Buckingham-like interaction potential: The increase in the O concentration and corresponding formation of B-O bonds, shown to be longer than the B-B bonds, resulted in larger ionic contributions as well as a density reduction. This increased ionicity was responsible for the observed decrease in elastic modulus. As even more O was incorporated (x > 0.18), the H concentration increased, exceeding 0.3 at. %. This may cause the formation of boric acid (H[sub 3]BO[sub 3]) as a result of the chemical reaction with H[sub 2]O upon atmosphere exposure. The presence of van der Waals and hydrogen bonding, associated with H[sub 3]BO[sub 3] formation, provides a reasonable explanation for the extensive decrease in elastic modulus from 231 to 15 GPa, by 94%. The parameterization for the Buckingham-like interaction potential, introduced in this study, can be used for MD simulations of amorphous BOx systems without H[sub 3]BO[sub 3]. [ABSTRACT FROM AUTHOR]
- Published
- 2003
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