Re: [SIESTA-L] Integrated PDOS and COHP questions...

2010-10-20 Por tôpico Barraza-lopez, Salvador
27;%f' ); PDOSC(1,i)=PDOSC(1,i)+vals(1); PDOSCz(counter_row,i)=PDOSCz(counter_row,i)+vals(1); end orbital_count=orbital_count+1; if (orbital_count==13) orbital_count; text; counter_row; end orbital_count=orbital_count+1; if (orbital_count==13) orbital_count; text; counter_row; if (orbit

Re: [SIESTA-L] Integrated PDOS and COHP questions...

2010-10-20 Por tôpico N H
I find extremely impolite when someone hurry the collaborators of this list to answer his questions. In special if this question can be solved by consulting the user's manual! On Wed, Oct 20, 2010 at 4:56 PM, Nguyen Doan Sau wrote: > Hi Siesta users, > I have two quick questions. > First, ho

[SIESTA-L] Integrated PDOS and COHP questions...

2010-10-20 Por tôpico Nguyen Doan Sau
Hi Siesta users, I have two quick questions. First, how do we get the integrated Pdos in Siesta Second, how do we get the integrated COHP in Siesta. Could anyone help me on those question quickly! Thanks, Sau Nguyen U of Houston