Can CP2K print PDOS for multiple sets of atoms in one system?

[Jannen]

Hi Marcella,

Thanks very much! 

Best,

        
On Wednesday, June 20, 2018 at 11:24:50 AM UTC-5, Marcella Iannuzzi wrote:
>
> Hi
>
> you have to repeat the LDOS section, one for each list
>
> Regards
> Marcella
>
>
> On Wednesday, June 20, 2018 at 5:59:59 PM UTC+2, Jannen wrote:
>>
>> Dear CP2K users and developers, 
>>
>> I want to print the total density of state and also the PDOS of 1..100 
>> atoms for my system. Can I specify multiple LIST in &LDOS section like 
>> following? Or Is there any way I can do that?  
>>
>>             &LDOS
>>                COMPONENTS TRUE
>>                LIST  1..288
>>                LIST 1..588
>>             &END LDOS
>>
>> Thanks very much!
>>
>
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