Hi Munima, I try help you out of this problem. Please konfirm to Axel first...
problem of CHDENS konfirm us that our input is wrong, my be we write pseudopotential is incorect. so try again and choose pseudopotential must be right. for example: atom Cu, the pseudopotential must Cu.UPF And write too ecutwfc and ecutrho Oke try again... Tahnks Rahmat Gunawan > Hi, > > I can now get the PWgui window. But this time I am having problem in > running a scf calculation (from the examples) from the menubar. An > application error window appears which says - can't read > "::pwscf::settings (CHDENS)":no such element in array. > > Please help me out. > > Thanks > Munima > > > ----------------------------------------------------------------------------------- > This email was sent from IIT Guwahati Webmail. If you are not the > intended recipient, please contact the sender by email and delete all > copies; your cooperation in this regard is appreciated. > http://www.iitg.ernet.in > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum >
