[CP2K:1063] Re: Discussion on cp2k-release-supported-features-wishlist

Teodoro Laino teodor... at gmail.com
Wed May 21 07:43:38 UTC 2008


in principle you're right.. but your list is too ambitious at the  
Metadynamics, GAPW would require too much work to go into a release..
So the first one, in my opinion, should be a very basic (I fully  
agree with the Axel original list),
and doesn't matter whether there will be unique features or not.. The  
important is to start somewhere..
and the best is to start with your eyes on the sky and your feet on  
the ground.


On 21 May 2008, at 08:57, ilya wrote:

> Hi!
> I think that you should support unique features of that program
> primarily. To my mind, the more unique the feature the more important
> it should be.
> So the list is something like metadynamics, GPW, GAPW, qm/mm, CSVR,
> etc + some algorithms to perform basic operations such as
> optimizations.
> Ilya.
> On May 19, 1:15 am, Axel <akoh... at gmail.com> wrote:
>> Hi!
>> here's a first sketch of what would be a list of goals for the first
>> release.
>> please adjust and/or put comments here.
>> thanks,
>>      axel.
> >

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