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**I have updated my deepmd-kit(v2.0.3). Some error occured when I run lammps using deepmd potential, below is the error: 2022-03-05 21:06:49.136509: I tensorflow/core/platform/cpu_feature_guard.cc:151] This TensorFlow binary is optimized with oneAPI Deep Neural Network Library (oneDNN) to use the following CPU instructions in performance-critical operations: SSE4.1 SSE4.2 AVX AVX2 FMA
And the pair style setting in my input file is below: There is no error when I used deepmd-kit 1.3 version. |
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Replies: 2 comments
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I have solved this problem, just reinstall deepmd-kit and lammps-dp by |
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In the latest stable version of LAMMPS, you must use |
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I have solved this problem, just reinstall deepmd-kit and lammps-dp by
conda create -n deepmd deepmd-kit=2.0.0=*cpu libdeepmd=2.0.0=*cpu lammps-dp=2.0.0 horovod -c https://conda.deepmodeling.org
and set the path to conda envs, and change the submit file.