All pull requests

Pull requests

• Update cmake macro simple_run_and_check

  cmake
  #6387·ye-luo opened Nov 3, 2026Contributor·

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  3

• Fix two-body kSpaceJastrow updates under particle-by-particle moves

  c/c++cmake
  #6386·gcarleo opened Nov 3, 2026·6 tasks done·

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  1

  10

• Nexus: add support for shared_ranks and distributed_ranks for B-spline sposets

  documentationnexuspython
  #6376·prckent opened Oct 29, 2026Contributor·

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  27

• Nexus: Refactor nxs-redo, add user docs

  documentationnexuspython
  #6375·brockdyer03 opened Oct 29, 2026Contributor·

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• Derive test output prefixes from QMCPACK inputs

  cmake
  #6368·1cbyc opened Oct 27, 2026·

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  1

  2

• Nexus: Organize imports in Nexus library, tests, and apps

  nexuspython
  #6359·brockdyer03 opened Oct 24, 2026Contributor·

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  5

• Nexus: Update eshdf, add docs

  documentationnexuspython
  #6356·brockdyer03 opened Oct 24, 2026Contributor·

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• Nexus: Add tests that actually run simulations codes

  nexuspython
  #6345·brockdyer03 opened Oct 21, 2026Contributor·

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  1

• Nexus: Refactor Simulation status flags for automatic logging, re-enable debug setting

  nexuspython
  #6339·brockdyer03 opened Oct 17, 2026Contributor·

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  7

• Nexus: Improve pseudoset.py and related code

  documentationnexuspython
  #6338·brockdyer03 opened Oct 17, 2026Contributor·

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  9

• Bump handlebars from 4.7.9 to 4.7.10 in /external_codes/boost_multi/multi/doc

  dependenciesjavascript
  #6334·dependabot[bot] opened Oct 16, 2026Bot·

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• [Do not merge] Tighter ctest pass condition and less suppress at asan

  cmake
  #6318·ye-luo opened Oct 9, 2026Contributor·

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• Nexus: Add new example for QE that shows use of pp.x

  nexuspython
  #6309·brockdyer03 opened Oct 5, 2026Contributor·

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  18

• Nexus: Start development guide

  documentationnexuspython
  #6308·brockdyer03 opened Oct 5, 2026Contributor·

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  1

• Add a per-step vmc.dat file

  c/c++cmakedocumentationnexuspython
  #6272·jtkrogel opened Sep 23, 2026Contributor·

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  32

• Nexus: Remove legacy settings compatibility

  nexuspython
  #6271·brockdyer03 opened Sep 22, 2026Contributor·

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  3

• [WIP] VMCBatch all particle move

  c/c++cmake
  #6265·PDoakORNL opened Sep 21, 2026Contributor·

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• Nexus: Add linter workflow

  nexus
  #6261·brockdyer03 opened Sep 20, 2026Contributor·

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  5

• Nexus: Refactor machines.py to simplify adding a new supercomputer

  documentationnexuspython
  #6243·brockdyer03 opened Sep 16, 2026Contributor·

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  5

• Nexus: Migrate Simulation.application_results to use bit flags over set of strings

  nexuspython
  #6242·brockdyer03 opened Sep 16, 2026Contributor·

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  9

• Nexus: Update qdens command-line argument parsing

  nexuspython
  #6213·brockdyer03 opened Sep 8, 2026Contributor·

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  7

• Update QMCPACK documentation style

  documentationpython
  #6195·brockdyer03 opened Sep 1, 2026Contributor·

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  3

  

• Supercell tiling and Hessian support for plane-wave orbitals

  c/c++cmakedocumentation
  #6177·prckent opened Aug 29, 2026Contributor·

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  18

• Nexus: [Draft] Expanding dynamic workflows

  nexuspython
  #6146·kayahans opened Aug 21, 2026Contributor·

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  1

• fixed issue with possible zero-sized gemm call in TWFFastDeriv code

  #6004·kgasperich opened Jun 22, 2026Contributor·

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  16