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support calculator lists #240

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alinelena opened this issue Aug 2, 2024 · 1 comment
Open

support calculator lists #240

alinelena opened this issue Aug 2, 2024 · 1 comment
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enhancement New/improved feature or request

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@alinelena
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will be nice to be able to support for a structure, structures calculator lists.

eg, I want to have for a system, energies, forces stresses with mace and sevennet
we will need to think of best approach

@ElliottKasoar
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We may be able to extend/subclass one of the mixing calculator classes, or at least implement something similar to the Mixer base class, without the need for weights.

@ElliottKasoar ElliottKasoar added enhancement New/improved feature or request janus and removed janus labels Aug 2, 2024
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