Discussions

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  Would multiple cpu speed up lammps simulation ?

  unknwon-man asked Nov 15, 2024 in Q&A · Closed · Unanswered

  

  

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  Lammps Segmentation fault (core dumped)

  mariummou asked Aug 8, 2024 in Q&A · Unanswered

  

  

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  How to run lammps with hybrid/overlay and combine LJ interaction with Nequip potential to describe different interactions in a complex system

  HasnainMSajid asked Jul 26, 2024 in Q&A · Unanswered

  

  

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  Restart lammps simulation

  Mathieu-Istas asked Aug 9, 2023 in Q&A · Answered

  

  

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  cpp error after compiling stress branch

  bio15 asked Jul 26, 2023 in Q&A · Closed · Answered

  

  

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  GPUMD interface

  Youhaojen started Jun 13, 2023 in Ideas

  

  

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  Pressure seems to countains only kinetic contribution

  Mathieu-Istas started Apr 26, 2023 in General · Closed

  

  

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  cmake error while build CXX object pair_nequip.cpp.o

  ghost asked Mar 9, 2023 in Q&A · Answered

  

  

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  CPU only Integration with LAMMPS

  npiroozan asked Feb 15, 2023 in Q&A · Answered

  

  

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  Patching PLUMED with Nequip

  nisargjoshi10 asked Jan 30, 2023 in Q&A · Answered

  

  

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  Error while running lammps

  Sokseiha asked Jan 12, 2023 in Q&A · Answered

  

  

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  modified tutorial to run MD of bulk water in NVT

  gabriele16 started Jul 8, 2022 in General

  

  

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  LAMMPS failed with C10::Error

  Geonu-AI asked Jun 29, 2022 in Q&A · Unanswered

  

  

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  LAMMPS failed with model trained with float64

  saeedshahi asked Jun 26, 2022 in Q&A · Answered

  

  

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  Building without MKL

  kkly1995 asked Jun 13, 2022 in Q&A · Unanswered

  

  

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  pair_nequip compilation

  atulcthakur asked May 9, 2022 in Q&A · Answered

  

  

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  cmake compilation question

  nisargjoshi10 asked Apr 19, 2022 in Q&A · Answered

  

  

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  Stress calculation support

  youngjae142 started Mar 25, 2022 in Ideas

  

  

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  compilation error

  ken1944 asked Apr 11, 2022 in Q&A · Answered

  

  

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  NequIP and pair NequIP versions

  youngjae142 asked Mar 23, 2022 in Q&A · Answered

  

  

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