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DPA2 potential function problem #3858

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xwxwshi opened this issue Jun 6, 2024 · 4 comments
Closed

DPA2 potential function problem #3858

xwxwshi opened this issue Jun 6, 2024 · 4 comments
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@xwxwshi
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xwxwshi commented Jun 6, 2024

Summary

I'm running lammps with DPA2's potential function and I get this error and it terminates, can you help me?

DeePMD-kit Version

3.0

Backend and its version

tensorflow 2.16.1

Python Version, CUDA Version, GCC Version, LAMMPS Version, etc

No response

Details

wecom-temp-178265-f65d693b33d7cb6eea9b5c8114b030a6
wecom-temp-476747-706b9ed4e4da362014789014a40633dc
@xwxwshi xwxwshi added the wontfix label Jun 6, 2024
@iProzd
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iProzd commented Jun 6, 2024

Which version are you using? Now only built-from-source 2024Q1 branch and devel branch support lammps for DPA2.
See 'How to use' section of this page.

@njzjz
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njzjz commented Jun 6, 2024 •
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Duplicate of #3428

@njzjz njzjz marked this as a duplicate of #3428 Jun 6, 2024
@njzjz njzjz added duplicate and removed wontfix labels Jun 6, 2024
@njzjz njzjz closed this as not planned Won't fix, can't repro, duplicate, stale Jun 6, 2024
@Zch102xjtumse
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Duplicate of #3428

Thanks!One small question is,did I just follow the Files changed section to fix?

@njzjz
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njzjz commented Jun 8, 2024

Thanks!One small question is,did I just follow the Files changed section to fix?

@iProzd has provided a good suggestion: #3858 (comment)

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@njzjz @iProzd @xwxwshi @Zch102xjtumse