On Mon, December 10, 2007 20:20, zhs064 wrote: > hi, all > I'm a novice of PWscf. Does anybody know how to convert a > pseudopotential with semi-core states generated by OPIUM to PWscf > UPF format? Are there some programs for that or some suggestions. > Thank you very much!
Dear Victor, once I did it, so it is possible. You should use one of the ___2upf tools that you can find in the upftools subdirectory, I don't remeber wich one but it should be possible to guess it from the file extension. To build the upf tools you have to "make upf". I hope this helps, Lorenzo. P.s. please sign your posts with full name and surname, and affiliation if possible. -- Lorenzo Paulatto +39 040 3787 511 http://people.sissa.it/~paulatto/ ---------------------------------------------------------------- SISSA Webmail https://webmail.sissa.it/ Powered by SquirrelMail http://www.squirrelmail.org/
