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Excited states #269

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Excited states #269

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Commits on Jul 3, 2024

  1. Added ability to calculate excited states with Gram-Schmidt orthogona… 

    …listion
    @jamie-tay
    jamie-tay committed Jul 3, 2024
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Commits on Jul 9, 2024

  1. Apply suggestions from code review 

    Rewrite orthogonalization of vectors, make orthogonalization_interval a keyword argument, fix spelling

Co-authored-by: Joachim Brand <j.brand@massey.ac.nz>
Co-authored-by: mtsch <matijacufar@gmail.com>
    @jamie-tay @joachimbrand @mtsch
    3 people authored Jul 9, 2024
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Commits on Jul 10, 2024

  1. Update documentation, add Base.show method for GramSchmidt

    @jamie-tay
    jamie-tay committed Jul 10, 2024
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Commits on Jul 18, 2024

  1. Merge branch 'develop' into feature/excited-states

    @jamie-tay
    jamie-tay committed Jul 18, 2024
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Commits on Aug 8, 2024

  1. Add automatic generation of starting vectors

    @jamie-tay
    jamie-tay committed Aug 8, 2024
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  2. Add tests for excited states

    @jamie-tay
    jamie-tay committed Aug 8, 2024
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  3. fix imports

    @jamie-tay
    jamie-tay committed Aug 8, 2024
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Commits on Sep 14, 2024

  1. Update src/fciqmc.jl 

    Co-authored-by: Joachim Brand <joachim.brand@gmail.com>
    @jamie-tay @joachimbrand
    jamie-tay and joachimbrand authored Sep 14, 2024
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Commits on Sep 15, 2024

  1. Update documentation, fix imports

    @jamie-tay
    jamie-tay committed Sep 15, 2024
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Commits on Sep 17, 2024

  1. Add minimum_size option for build_basis

    @jamie-tay
    jamie-tay committed Sep 17, 2024
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