Hi Mohammad, Take a look at this article, it has what you are looking for in it: http://www.sciencedirect.com/science/article/pii/S0927025614007940#f0005
The name is : "Systematic pseudopotentials from reference eigenvalue sets for DFT calculations"
Cheers, Nicolas MB MB <[email protected]> wrote :
Dear SIESTA users, Does anyone of you know how do I get a tested Pseudopotential for Tungsten to use it for calculations on WS2, for example?? Thank you in advance for your help. Best regards Mohammad
