Issues: OrderN/CONQUEST-release
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test_003 fails with XC_LIBRARY = CQ
area: testing
Relating to the test suite
type: bug
type: question
Issue to be discussed by developers
#347
opened Apr 24, 2024 by
tkoskela
Refactor duplicated code in m_kern_exx_ subroutines
needs: diagnosis
Diagnosis required for bug or issue
time: days
type: maintenance
Refactoring, updating etc
#346
opened Apr 22, 2024 by
tkoskela
Backtrack line minimisation can fail
area: main-source
Relating to the src/ directory (main Conquest source code)
improves: stability
Fix or enhance issues with stability or robustness
needs: confirmation
Bug or issue needing confirmation
priority: minor
time: days
type: question
Issue to be discussed by developers
#343
opened Apr 5, 2024 by
davidbowler
Investigate FFTs
improves: speed
Speed-up of code
needs: diagnosis
Diagnosis required for bug or issue
time: days
type: enhancement
Planned enhancement being suggested by developers
#339
opened Mar 12, 2024 by
tkoskela
Output error with variable spin and Methfessel-Paxton smearing
area: main-source
Relating to the src/ directory (main Conquest source code)
improves: stability
Fix or enhance issues with stability or robustness
priority: minor
time: hours
type: bug
#336
opened Feb 27, 2024 by
davidbowler
Separate system specific and non system specific things in system.make
area: main-source
Relating to the src/ directory (main Conquest source code)
improves: stability
Fix or enhance issues with stability or robustness
priority: minor
time: hours
type: maintenance
Refactoring, updating etc
#329
opened Feb 16, 2024 by
tkoskela
Possible bug when running on one MPI process
needs: diagnosis
Diagnosis required for bug or issue
type: bug
#321
opened Feb 7, 2024 by
tkoskela
Changing the order of atoms in velocity.dat
area: main-source
Relating to the src/ directory (main Conquest source code)
improves: functionality
Adding functionality to code
needs: assignment
A developer must be assigned
priority: minor
time: weeks
type: enhancement
Planned enhancement being suggested by developers
#312
opened Jan 29, 2024 by
tsuyoshi38
Instructions for installation (Ubuntu/WSL)
area: manual
Relating to the manual
area: tutorials
Relating to the tutorials
time: hours
#310
opened Jan 26, 2024 by
AugustinLu
Repeated code in testsuite
area: testing
Relating to the test suite
priority: minor
type: maintenance
Refactoring, updating etc
#304
opened Jan 12, 2024 by
tkoskela
Add more ways to specify integration grid and BZ sampling
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
Further threading ideas: spin and van der Waals
area: main-source
Relating to the src/ directory (main Conquest source code)
help wanted
Extra attention is needed
type: question
Issue to be discussed by developers
#278
opened Oct 10, 2023 by
davidbowler
Make develop the default branch?
help wanted
Extra attention is needed
type: request
User request for new feature
#277
opened Oct 9, 2023 by
tkoskela
Document benchmark systems
area: testing
Relating to the test suite
type: enhancement
Planned enhancement being suggested by developers
#275
opened Oct 4, 2023 by
ilectra
Ensure that all file open commands fail gracefully
area: main-source
Relating to the src/ directory (main Conquest source code)
improves: stability
Fix or enhance issues with stability or robustness
priority: minor
time: days
type: maintenance
Refactoring, updating etc
Think about threaded ScaLAPACK alternatives for eigenvalue solve
improves: speed
Speed-up of code
type: question
Issue to be discussed by developers
#252
opened Aug 29, 2023 by
tkoskela
Idea: Test do concurrent
area: main-source
Relating to the src/ directory (main Conquest source code)
priority: minor
time: days
#250
opened Aug 24, 2023 by
tkoskela
Reduce code duplication in PAO_grid_transform_module
area: PAOs
Relating to PAO generation and form
improves: stability
Fix or enhance issues with stability or robustness
priority: minor
type: maintenance
Refactoring, updating etc
#244
opened Aug 16, 2023 by
tkoskela
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