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PhBaseWorkChain: better handler for convergence #986

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Commits on Nov 23, 2023

  1. PhBaseWorkChain: better handler for convergence

    Plain lowering down the alpha mix could not work always.
    The `nmix_ph` is already an improvement, leading to the usage
    of more iterations into the mixing. The rate of the alpha mix change
    is also increased, and below a certain threshold a multi mix approach
    is tried. Afterwards, the handler finishes the strategies.
    bastonero committed Nov 23, 2023
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Commits on Nov 27, 2023

  1. Improve logic

    bastonero committed Nov 27, 2023
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Commits on Nov 28, 2023

  1. Merge branch 'main' of https://github.com/aiidateam/aiida-quantumespr…

    …esso into handler/ph/convergence
    bastonero committed Nov 28, 2023
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  2. Improve ph protocols

    Add `alpha_mix` and `ndim_ph`.
    bastonero committed Nov 28, 2023
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