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Parallelize over basis #626

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Parallelize over basis #626

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Commits on Dec 17, 2021

  1. Hamiltonian_Heisenberg.cu: Split gradient functions into separate dev… 

    …ice functions
    Moritz committed Dec 17, 2021
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  2. Refactor Hamiltonian_Heisenberg.cu: Reduced number of arguments in ke… 

    …rnel calls.

Now passes pointers to fields in Hamiltonian and geometry in helper struct.
    Moritz committed Dec 17, 2021
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  3. Hamiltonian_Heisenberg.cu: Reduced of arguments in kernel calls further. 

    Now passes pointers to interaction data in helper structs.
    Moritz committed Dec 17, 2021
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Commits on Jul 26, 2022

  1. Merge branch 'hamiltonian_cuda_improvements' of github.com:MSallerman… 

    …n/spirit into parallelize_over_basis
    Moritz committed Jul 26, 2022
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  2. Added a new struct that orders pairs according to the left interactio… 

    …n atom.
    Moritz committed Jul 26, 2022
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Commits on Jul 27, 2022

  1. Hamiltonian_Heisenberg.cu: Used pair sorting to implement parallel ex… 

    …change over spins
    Moritz committed Jul 27, 2022
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  2. Pair_Sorting: Implemented Pair subsorting to slightly improve perform… 

    …ance and some comment changes
    Moritz committed Jul 27, 2022
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  3. Hamiltonian_Heisenberg.cu: DMI now also uses sorted pairs

    Moritz committed Jul 27, 2022
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  4. Geometry: check for co-incident positions is now only performed if n_… 

    …cell_atoms<100

The reason is that this check scales quadratically in n_cell_atoms.
    Moritz committed Jul 27, 2022
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Commits on Aug 24, 2022

  1. Merge branch 'develop' of github.com:spirit-code/spirit into parallel… 

    …ize_over_basis
    Moritz committed Aug 24, 2022
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