Re: [Wien] error in doing bandstructure cal

Ok Sir, thankyou. Will try doing again. On Tue, 8 Aug, 2023, 11:01 pm Peter Blaha, wrote: > Probably you only did: > > x lapw1 -up -band > > but not the -dn command. > > lapw2 needs both spins on the same k-mesh. > Am 08.08.2023 um 18:35 schrieb Neetu Malik: > > Hello everyone, trying to

Re: [Wien] error in doing bandstructure cal

Probably you only did: x lapw1 -up -band but not the  -dn command. lapw2 needs both spins on the same k-mesh. Am 08.08.2023 um 18:35 schrieb Neetu Malik: Hello everyone, trying to produce bandstructure but getting following error, please guide: Commandline: *x lapw2 -band -qtl -up * Program

[Wien] error in doing bandstructure cal

Hello everyone, trying to produce bandstructure but getting following error, please guide: Commandline: *x lapw2 -band -qtl -up * Program input is: *""* At line 72 of file fermi_tmp_.F (unit = 29, file = 'Sr2FeRuO6.energydn') Fortran runtime error: Sequential READ or WRITE not allowed after EOF