Pseudopotentials for electronic structure calculations of small CdSe colloidal quantum dots
A method of generating and testing pseudopotentials will be presented. This required the development of PPTester, a custom software program to analyze and quantify various parameters. These methods were first used to study bulk Si and verify the installation and performance of SIESTA. Plots, which a...
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| Format: | Others |
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2011
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| Online Access: | http://cardinalscholar.bsu.edu/handle/handle/188210 http://liblink.bsu.edu/uhtbin/catkey/1339456 |