Thesis
Transferable reduced TB models for elemental Si and N and binary Si-N systems
- Abstract:
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Silicon nitride is a bulk and a coating material exhibiting excellent mechanical properties. The understanding of the complex processes at the nanometre scale gained through experimental research will be enhanced by the existence of a computationally efficient and accurate model that is able to describe the mechanical properties of silicon nitride. Such a model has yet to be proposed.
In this thesis we present a transferable reduced tight-binding (TB) model for the silicon nitride s...
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Authors
Contributors
+ Kolmogorov, A
Role:
Supervisor
+ Pettifor, D
Role:
Supervisor
+ Drautz, R
Role:
Supervisor
Funding
+ Engineering and Physical Sciences Research Council
More from this funder
Funding agency for:
Gehrmann, J
Bibliographic Details
- Publication date:
- 2013
- Type of award:
- DPhil
- Level of award:
- Doctoral
- Awarding institution:
- University of Oxford
Item Description
- Language:
- English
- Keywords:
- Subjects:
- UUID:
-
uuid:002b0c99-0e9d-4d8c-a0dc-ad07383f083f
- Local pid:
- ora:11890
- Deposit date:
- 2015-07-27
Terms of use
- Copyright holder:
- Gehrmann, J
- Copyright date:
- 2013
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