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QuantumATK W-2024.09 version released on Sep 9, 2024
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TorchX_MACE_MP_0_L0_2023
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Topic: TorchX_MACE_MP_0_L0_2023 (Read 1350 times)
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nimamat
New QuantumATK user
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TorchX_MACE_MP_0_L0_2023
«
on:
November 16, 2024, 10:44 »
Hello,
How can we use mace potentials (TorchX_MACE_MP_0_L0_2023)?
Everything can be loaded on this page (
https://docs.quantumatk.com/manual/ForceField.html#pretrained-moment-tensor-potential-mtp-parameter-sets
) except TorchX_MACE_MP* and it shows the error "NameError: name 'TorchX_MACE_MP_0_L0_2023' is not defined" in QuantumATk 2023.
Thanks in advance.
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AsifShah
QuantumATK Guru
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Re: TorchX_MACE_MP_0_L0_2023
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Reply #1 on:
November 17, 2024, 14:48 »
Hi,
I think its available in latest 2024 package
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Anders Blom
QuantumATK Staff
Supreme QuantumATK Wizard
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Re: TorchX_MACE_MP_0_L0_2023
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Reply #2 on:
November 18, 2024, 23:11 »
Yes, it was added to W-2024.09
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