[Wien] asking

hi  my name is Aftab Hussaini m very new user of /wiens2k i wana ask you that how can i find the elastic and structural properties of Li2Se though i brought up the electric and DOS graphs but how to fully understand them.regards.Aftab Hussain dep of computational physics peshawar university.

Re: [Wien] berryPI code

kindly tell how i would get master in wien 2kif you have any simple way to tell On Wednesday, September 9, 2015 3:17 AM, Oleg Rubel wrote: I afraid you need to dig into the source code of w2w and see what is going on in these lines. Oleg > On Sep 8, 2015, at 17:57, nilofar hadaeg

Re: [Wien] EFG dependence on magnetic field

kindly tell how i would get master in wien 2kif you have any simple way to tell On Monday, September 7, 2015 1:27 PM, Muhammad Sajjad wrote: Thank you veru much Dear Gavin On Mon, Sep 7, 2015 at 11:25 AM, Gavin Abo wrote: Yes On 9/7/2015 1:55 AM, Muhammad Sajjad wrote: De

Re: [Wien] Need your help

kindly tell how i would get master in wien 2kif you have any simple way to tell On Thursday, August 13, 2015 4:46 PM, sikander Azam wrote: Resp Sir Laurence MarksThank sir for the reply.Regardssikander On Thu, Aug 13, 2015 at 4:42 AM, Laurence Marks wrote: Ti is 4+ (valence), Ni

Re: [Wien] Segmentation fault in Supercell Calculation

kindly tell how i would get master in wien 2kif you have any simple way to tell On Wednesday, July 29, 2015 2:00 AM, Laurence Marks wrote: You have the wrong blacs for openmpi, please use the Intel link advisor I sent to work out what you need. It looks like you may need static lin

Re: [Wien] k-points of doped material

kindly tell how i would get master in wien 2kif you have any simple way to tell On Monday, July 27, 2015 6:49 AM, delamora wrote: #yiv7449270628 #yiv7449270628 -- P {margin-top:0;margin-bottom:0;}#yiv7449270628 As I said, the first structure is F (press f3 in xcrysden and you will