Daily Archives: January 14, 2009

Converge, dammit!

Posted on January 14, 2009 by Invader Xan

One of the biggest irritations in time dependent DFT calculations is getting your functionals to converge. And a certain large molecule that I’m trying to work some calculations on is just being a little carbonaceous bitch. I’ve run the calculation … Continue reading →

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Posted on January 14, 2009 by Invader Xan

For your reading pleasure, Carnival of Space 86 is upon us, hosted by collectSPACE. And interestingly, I’m not the only person to have been writing about Betelgeuse lately. Pretty much the same title and everything — do great minds think … Continue reading →

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