Re: [Wien] An interesting article on DFT: Understanding density functional theory (DFT) and completing it in practice

2016-12-08 Thread Peter Blaha
I doubt that this is of interest. Am 08.12.2016 um 14:11 schrieb Osama Yassin: Dear Colleague I came across the article: *Understanding density functional theory (DFT) and completing it in practice. **It may be of interest for develpers and users of DFT.*

Re: [Wien] An interesting article on DFT: Understanding density functional theory (DFT) and completing it in practice

2016-12-08 Thread Sam Trickey
Be very careful with this article. The method it presents purports to give a correct set of DFT results - both total energy and band gap - with a prescription for constructing a finite-sized basis set. The explicit contradiction with the concept of the complete basis set limit should be cause

[Wien] An interesting article on DFT: Understanding density functional theory (DFT) and completing it in practice

2016-12-08 Thread Osama Yassin
Dear Colleague I came across the article: *Understanding density functional theory (DFT) and completing it in practice. **It may be of interest for develpers and users of DFT.* http://scitation.aip.org/content/aip/journal/adva/4/12/10.1063/1.4903408 The article is open for free. Best wishes