Difference in Electron density

[Pankaj Mishra]

Dear Marcella,

Thank you so much. I will try this. 

On Friday, 15 August 2014 22:49:43 UTC+2, Marcella Iannuzzi wrote:
>
> Hi Pankaj Mishra,
>
> you can easily find information on the format of cube files on the web.
> Anyway, for simple operations with cube files, you can use the 
> cubecruncher program, which is
> distributed with cp2k. It can be found in cp2k/tools/cubecruncher.
> Just compile it and run without any input to get some hints on how to use 
> it and on the available options.
>
> Regards
>
> Marcella
>
> On Friday, August 15, 2014 4:51:59 PM UTC+2, Pankaj Mishra wrote:
>>
>> Dear All,
>>
>> I am calculating the electron density which is written in the cube file. 
>> I can load in vmd and visualize.  I want to take the difference between two 
>> different cube files. I am not very familiar with cube files. So i am not 
>> clear about how to take the
>> difference between two cube files. Is there any way to visualize the 
>> difference in VMD or any other software?  If someone can explain how to 
>> take difference, it will be really helpful.
>>
>> Thank you so much
>>
>> with regards
>>
>> Pankaj Mishra 
>>
>
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