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Add more ways to specify integration grid and BZ sampling #283

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davidbowler opened this issue Oct 31, 2023 · 0 comments
Open

Add more ways to specify integration grid and BZ sampling #283

davidbowler opened this issue Oct 31, 2023 · 0 comments
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@davidbowler
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area: main-source Relating to the src/ directory (main Conquest source code) improves: output Making output clearer or more consistent priority: minor time: days type: enhancement Planned enhancement being suggested by developers
Milestone
Release v1.4

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@davidbowler
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It would be useful to be able to specify the integration grid in terms of a grid spacing required, and to specify BZ integration in terms of a spacing in reciprocal space (these are both easy to do!).

It would also be useful to remove the restriction on numbers of grid points which were imposed by using GPFA (multiple of 2, 3, 5, 7 only) and possibly to introduce flexibility in terms of block size to make grid spacing easier to fit.
@davidbowler davidbowler added area: main-source Relating to the src/ directory (main Conquest source code) improves: output Making output clearer or more consistent priority: minor time: days type: enhancement Planned enhancement being suggested by developers labels Oct 31, 2023
@davidbowler davidbowler added this to the Release v1.3 milestone Oct 31, 2023
@davidbowler davidbowler self-assigned this Oct 31, 2023
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area: main-source Relating to the src/ directory (main Conquest source code) improves: output Making output clearer or more consistent priority: minor time: days type: enhancement Planned enhancement being suggested by developers
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Release v1.4
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@davidbowler