cp2k vs BigDFT

mdsimula...@gmail.com

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Nov 23, 2020, 4:30:41 PM11/23/20

to cp2k

Hello,

Has anyone used BigDFT? How does it compare with CP2K as far as speed and system size?

Thanks,

Stacey

Matt W

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Nov 23, 2020, 4:51:55 PM11/23/20

to cp2k

Hello,

what is better: Red paint or Blue paint?

Matt

mdsimula...@gmail.com

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Nov 24, 2020, 8:22:42 AM11/24/20

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Hi Matt,

I appreciate your humor but in this case I would like a slightly more educated answer. I deal with systems generally in the 1000 to 5000 atom size so I was wondering if anyone has had experience with both CP2K and BigDFT?

Thanks,

Stacey

Rashid Rafeek V Valappil

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Nov 24, 2020, 9:37:25 AM11/24/20

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mattermodeling.stackexchange.com might be a good platform for such questions.

Regards,

Rashid.

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