Discussions

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  Moving i-PI sampling to use FFDirect?

  pdobbelaere started May 22, 2025 in Ideas

  

  

  

  

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  Error: No route to host

  Viren-tyagi asked Jan 9, 2025 in Q&A · Unanswered

  

  

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  Config for local execution

  tbraeckevelt asked Aug 7, 2024 in Q&A · Unanswered

  

  

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  Geometry.save is not an app

  tbraeckevelt asked Aug 7, 2024 in Q&A · Answered

  

  

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  v4.0.0-rc0

  svandenhaute started Jul 29, 2024 in General

  

  

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  CP2K jobs slower with higher number of cores per worker

  bartoszmazurwro asked May 17, 2024 in Q&A · Unanswered

  

  

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  Are there any development instructions?

  Andrew-S-Rosen started Oct 21, 2023 in General

  

  

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  Integrating with Colmena for concurrent training, sampling, reference computations

  WardLT started Jun 22, 2023 in Ideas

  

  

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  v1.0.0

  svandenhaute announced Jun 7, 2023 in Announcements

  

  

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