Questions about doslplot

Vasp transition state theory tools

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kambiz
Posts: 39
Joined: Tue Mar 01, 2011 12:35 am

Questions about doslplot

Post by kambiz »

Hi,

I d really appreciate if anyone can answer my questions.

1. What s the difference between doslplot.pl and dosplot??

2. I just wanna plot the DOS for a specific atom (blue line). How can I exclude the DOS plot for all systems (Red line)?

3. How can I change the x-axis to E - E(fermi)?

Thanks for your help

Cheers
Kambiz
graeme
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Joined: Tue Apr 26, 2005 4:25 am
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Re: Questions about doslplot

Post by graeme »

The doslplot.pl script generates plot of the local density of states, whereas the dosplot.pl script uses the total density of states.

With the doslplot.pl, you can plot the projection of the DOS onto a single atom.

These script are not particularly complicated. You can open them up and see what they are doing and make modifications or run a slightly different plotting routine. For example, at the end of the doslplot.pl script, you can see the gnuplot commands being run. Feel free to change the data (for example by shifting the energy axis) or how the data is plotted by running gnuplot directly, or any other plotting program that you would like.
kambiz
Posts: 39
Joined: Tue Mar 01, 2011 12:35 am

Re: Questions about doslplot

Post by kambiz »

Thanks,

I d really appreciate it.

Kambiz
kambiz
Posts: 39
Joined: Tue Mar 01, 2011 12:35 am

Re: Questions about doslplot

Post by kambiz »

Just one more question.

I dont see anything related to DOS profiles for spin up and spin down. Is it possible to plot the majority and minority LDOS profiles?

Thank you in advance

Kambiz
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