Improving the efficiency of computation of free energy differences
There has been a recent focus on investigating the properties of semi-conductors at the nanoscale as it is well known that the band-gap of semi-conducting materials is altered due to quantum confinement effects. The potential to fine-tune a material's properties based solely on particle size ha...
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| Format: | Thesis |
| Language: | English |
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Curtin University
2011
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| Online Access: | http://hdl.handle.net/20.500.11937/2424 |