Atom Specific Denisty of States
Posted: Mon Apr 18, 2011 8:36 pm
Dear All,
I am wondering how i should do the following in VASP.
I have 100 atoms, and wish to plot Density of states.
Well, i can do this in P4vasp.
But, i wish to get only the DOS of certain atoms, for example say atom no 5, 8, 38, 98, 99 among the 100 atoms considered.
I am wondering how i could do this in VASP.
Your suggestions are welcome and i thank you all in advance.
K
I am wondering how i should do the following in VASP.
I have 100 atoms, and wish to plot Density of states.
Well, i can do this in P4vasp.
But, i wish to get only the DOS of certain atoms, for example say atom no 5, 8, 38, 98, 99 among the 100 atoms considered.
I am wondering how i could do this in VASP.
Your suggestions are welcome and i thank you all in advance.
K