[CPMD-list] WANNIER_DOS

A.Alaka aoa101 at york.ac.uk
Thu Aug 26 11:13:09 CEST 2004


Does anyone know how to get the WANNIER_DOS file for a ceratin system? 
Im guessing via a PROPERTIES calculation but the manual offers no 
information on this. Another thing is the LDOS keyword (for calculating 
the layer projected DOS). Its in the manual but again no explanation. 
I've tried several input options with the keyword but none seem to work. 
Perhaps it isn't implemented yet?
Thanks in advance.




More information about the CPMD-list mailing list