Rick Muller rpmuller
rpmuller
/ PyQuante Testing.ipynb
Last active
July 8, 2021 00:53
Notes, timings, and additional tests for the development of pyquante2 by comparing to to PyQuante (1.6.??).
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rpmuller
/ Tight Binding.ipynb
Created
May 30, 2013 01:31
Tight Binding program to compute the band structure of simple semiconductors. Expands on the basic Harrison parameters. Parameters taken from Vogl, Hjalmarson and Dow,
[A Semiempirical Tight-Binding Theory of the Electronic Structure
of Semiconductors](http://www.sciencedirect.com/science/article/pii/0022369783900641), J. Phys. Chem. Sol. 44 (5)…
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rpmuller
/ svg-display.ipynb
Last active
January 23, 2019 05:53
IPython's SVG display functionality, in conjunction with the ease of making SVG strings using ElementTrees, makes it really easy to have a nice drawing canvas inside of IPython.
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