Ecosyste.ms: Issues
An open API service for providing issue and pull request metadata for open source projects.
GitHub / wannier-developers/wannier90 issues and pull requests
#536 - Print phase factor for plotting MLWF
Pull Request -
State: closed - Opened by qiaojunfeng 13 days ago
#535 - Fix write_tb with MPI
Pull Request -
State: closed - Opened by qiaojunfeng 16 days ago
#534 - correct error printout and stop in postw90.x
Pull Request -
State: closed - Opened by JeromeCCP9 16 days ago
#533 - Translationally-invariant computation for position-related matrix elements
Pull Request -
State: closed - Opened by sjhong6230 16 days ago
- 6 comments
#532 - `wannier_plot_format = xcrysden` doesn't ensure the generation of XSF file.
Issue -
State: open - Opened by hongyi-zhao 16 days ago
#531 - Large number of updates in preparation for Wannier v4.0
Pull Request -
State: closed - Opened by JeromeCCP9 18 days ago
#530 - Explicit kpath -- see #519
Pull Request -
State: closed - Opened by JeromeCCP9 18 days ago
#529 - Test required for higher_order_nearest_shells=T case
Issue -
State: open - Opened by JeromeCCP9 19 days ago
Labels: enhancement
#528 - add documentation for explicit_kpath
Pull Request -
State: closed - Opened by JeromeCCP9 19 days ago
#527 - Fixes for make -j
Pull Request -
State: closed - Opened by jryates 22 days ago
#526 - The wannier interface is returning 128 projections while NUM_WANN is 104.
Issue -
State: closed - Opened by hongyi-zhao about 1 month ago
- 1 comment
#525 - NUM_WANN non-collinear calculation, no spin orbit coupling, need to multiply by 2?
Issue -
State: open - Opened by matphy1 2 months ago
Labels: question
#524 - The non-Hamiltonian of seedname_r.dat
Issue -
State: open - Opened by LiuyichenYanwushang 3 months ago
- 2 comments
Labels: question
#523 - fix typo
Pull Request -
State: closed - Opened by jin-saltandpepper 3 months ago
- 2 comments
#522 - \gamma_{yzz} appears twice
Issue -
State: closed - Opened by jin-saltandpepper 3 months ago
- 2 comments
#521 - Type Mismatch and Segmentation Fault in comm.F90 Using include 'mpi.h' in GNU Fortran (GCC) 12.3.0
Issue -
State: open - Opened by stefan-wolfsheimer 3 months ago
- 1 comment
#520 - Is the Hamiltonian of wannier90 an orthogonal basis?
Issue -
State: closed - Opened by woyolo990422 4 months ago
- 1 comment
#519 - User specified list of k-points for the band structure calculation
Pull Request -
State: closed - Opened by npaulish 4 months ago
- 1 comment
#518 - Small fixes for variable allocation
Pull Request -
State: closed - Opened by npaulish 4 months ago
- 3 comments
#517 - auto projections using libwannier90
Issue -
State: closed - Opened by simonganne01 5 months ago
- 2 comments
#516 - Development branch compilation error Cannot rename module file ‘w90_constants.mod0’ to ‘w90_constants.mod’: No such file or directory
Issue -
State: closed - Opened by deKeijzer 6 months ago
- 1 comment
#515 - Fermi surface calculation problem
Issue -
State: closed - Opened by DFTsher 6 months ago
- 1 comment
#514 - develop branch doesn't generate `libwannier.a`.
Issue -
State: closed - Opened by hongyi-zhao 6 months ago
- 3 comments
#513 - Larger relative errors for some of the tests when compiling with LLVM based intel oneapi compilers.
Issue -
State: closed - Opened by hongyi-zhao 6 months ago
- 5 comments
#512 - Some of the parallel benchmark tests of the `develop` branch failed.
Issue -
State: closed - Opened by hongyi-zhao 6 months ago
- 1 comment
#511 - Inquiry on Calculating Berry Curvature in 3D Brillouin Zone Using Wannier90
Issue -
State: open - Opened by Weian-Guo 6 months ago
Labels: question
#510 - make write_rmn parallel
Pull Request -
State: closed - Opened by JeromeCCP9 7 months ago
- 1 comment
#509 - write_rmn broken with MPI
Issue -
State: closed - Opened by jaemolihm 7 months ago
- 2 comments
Labels: bug
#508 - SCDM control WF centers
Issue -
State: open - Opened by Lijiuyin 7 months ago
Labels: question
#507 - Python 3.11 complains about invalid escape sequence in `test-suite/tools/parsers/parse_wpout.py`
Issue -
State: closed - Opened by merkys 7 months ago
- 5 comments
#506 - add more whitespace checking and fixes (replaces #404)
Pull Request -
State: closed - Opened by JeromeCCP9 7 months ago
- 2 comments
#505 - Fix merge issue503
Pull Request -
State: closed - Opened by JeromeCCP9 8 months ago
#504 - Higher-order finite difference
Pull Request -
State: closed - Opened by manxkim 9 months ago
- 2 comments
#503 - Parallelization of Wannier functions plotting disappeared in the latest develop branch
Issue -
State: closed - Opened by npaulish 9 months ago
- 6 comments
#502 - free(): invalid next size (fast)
Issue -
State: closed - Opened by simonganne01 9 months ago
- 1 comment
Labels: Library
#501 - move parameter tables to CSV and read into MD
Pull Request -
State: closed - Opened by jimustafa 9 months ago
- 5 comments
#500 - Fixed bug in writing checkpoint file in parallel mode
Pull Request -
State: closed - Opened by sjhong6230 9 months ago
- 2 comments
#499 - Error in wannier90 using Wien2k+wien2wannier
Issue -
State: closed - Opened by shahramyalameha 10 months ago
- 5 comments
#498 - Implementation of Stengel-Spaldin Functional in Wannierization
Pull Request -
State: closed - Opened by sjhong6230 10 months ago
- 3 comments
#497 - Error in postw90.x when calculate complex optical conductivity
Issue -
State: closed - Opened by suhang20001115 10 months ago
- 3 comments
#496 - Compiling question openMPI gfortran
Issue -
State: open - Opened by macfenchel123 11 months ago
- 1 comment
#495 - problem with xsf writing in parallel
Issue -
State: closed - Opened by pleoluxbg 11 months ago
- 3 comments
#493 - Use readthedocs for documentation
Pull Request -
State: closed - Opened by qiaojunfeng 11 months ago
- 1 comment
Labels: documentation
#491 - Update docs index page
Pull Request -
State: closed - Opened by qiaojunfeng 11 months ago
Labels: documentation
#490 - Fix bounds error when assigning M matrices
Pull Request -
State: closed - Opened by qiaojunfeng 11 months ago
Labels: bug
#489 - Add missing author
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
#488 - Update README.rst
Pull Request -
State: closed - Opened by mostofi 12 months ago
- 2 comments
#487 - Cmake
Pull Request -
State: open - Opened by LecrisUT 12 months ago
- 5 comments
#486 - Add mpi to `bands_plot`
Pull Request -
State: closed - Opened by jiang-yuha0 12 months ago
- 1 comment
#485 - Initialize github pages
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
- 4 comments
Labels: documentation
#484 - Add docs versioning
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
Labels: documentation
#483 - Add markdownlint to pre-commit
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
Labels: documentation
#482 - Update makefile for docs
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
#481 - Fix mkdocs deploy
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
#480 - Fix `make docs`
Issue -
State: closed - Opened by giovannipizzi 12 months ago
- 1 comment
#479 - Add linting for markdown files in mkdocs
Issue -
State: closed - Opened by giovannipizzi 12 months ago
Labels: documentation
#478 - Add documentation for IBZ
Pull Request -
State: closed - Opened by giovannipizzi 12 months ago
#477 - Fixing the python plotting scripts generated in kslice.F90
Pull Request -
State: closed - Opened by mikibonacci 12 months ago
#476 - Deploy docs on develop branch
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
#475 - Support for multiple version of the documentation
Issue -
State: closed - Opened by giovannipizzi 12 months ago
- 2 comments
Labels: documentation
#474 - Call mpi_finalize in the end of postw90 dry run
Pull Request -
State: closed - Opened by npaulish 12 months ago
#473 - Fix issue with parallel build (missing dependency in Makefile)
Pull Request -
State: closed - Opened by mikibonacci 12 months ago
#472 - Fix the issue of parallel compilation of Wannier90
Pull Request -
State: closed - Opened by hongyi-zhao 12 months ago
- 1 comment
#471 - Units of `zona`
Issue -
State: open - Opened by verena-neufeld 12 months ago
Labels: question
#470 - Migrate user guide/examples to mkdocs
Pull Request -
State: closed - Opened by qiaojunfeng 12 months ago
#469 - Fix/segfault hamiltonian get hr
Pull Request -
State: closed - Opened by mikibonacci 12 months ago
#468 - Add documentation after code refactoring and new library mode
Issue -
State: open - Opened by giovannipizzi 12 months ago
Labels: Library, documentation
#467 - Add back tests for library
Issue -
State: closed - Opened by giovannipizzi 12 months ago
- 1 comment
Labels: Library
#466 - Merge the new library interface
Pull Request -
State: closed - Opened by JeromeCCP9 12 months ago
#465 - pw2wannier: encapsulation of compute_amn and compute_mmn for use elsewhere in QE
Issue -
State: open - Opened by JeromeCCP9 12 months ago
- 1 comment
Labels: enhancement
#464 - Contributing.md
Issue -
State: open - Opened by jryates 12 months ago
#463 - Order of projections in nnkp file
Issue -
State: open - Opened by stepan-tsirkin about 1 year ago
- 2 comments
Labels: enhancement, help wanted, question
#462 - .dylib file on M1 Mac
Issue -
State: closed - Opened by verena-neufeld about 1 year ago
- 1 comment
#461 - Issue with Parallel Compilation of Wannier90.
Issue -
State: closed - Opened by hongyi-zhao about 1 year ago
- 3 comments
Labels: bug, Compilation
#460 - [Feature request] Input tag to allow user specified list of k-points for band structure
Issue -
State: closed - Opened by npaulish about 1 year ago
- 1 comment
Labels: enhancement
#459 - Developing the nerwann module to calculate thermomagnetic coefficients
Pull Request -
State: open - Opened by Emad-Rezaei about 1 year ago
- 1 comment
#458 - Missing `library_interface` interface
Issue -
State: closed - Opened by LecrisUT over 1 year ago
- 1 comment
Labels: enhancement, Library
#457 - Allow for `1D` inputs
Issue -
State: open - Opened by LecrisUT over 1 year ago
Labels: enhancement
#456 - Fix typo in tutorial about Tungsten
Pull Request -
State: closed - Opened by nujabse over 1 year ago
- 1 comment
#455 - Design of `library_interface.F90`
Issue -
State: closed - Opened by LecrisUT over 1 year ago
- 2 comments
Labels: enhancement, Library
#454 - Cmake
Pull Request -
State: closed - Opened by LecrisUT over 1 year ago
- 10 comments
#453 - Fails to run postproc_setup for a slab of height 1
Issue -
State: closed - Opened by Matt-Ord over 1 year ago
- 1 comment
#452 - Parallelization of band structure calculation
Issue -
State: closed - Opened by mywangbit over 1 year ago
Labels: enhancement
#451 - wannier90 to calculate Lindhard response function
Issue -
State: closed - Opened by aali28 over 1 year ago
- 1 comment
Labels: question
#450 - Fixing typo in Omega_I
Pull Request -
State: closed - Opened by elchatz over 1 year ago
- 1 comment
#449 - Linear optical response and second-harmonic generation implementation & incorporation of many-body excitonic effects into the linear and quadratic optical responses
Pull Request -
State: open - Opened by peio-gg over 1 year ago
#448 - Add projectability-disentangled Wannier functions
Pull Request -
State: closed - Opened by qiaojunfeng over 1 year ago
#447 - document for the IBZ calculation
Pull Request -
State: closed - Opened by t-koretsune over 1 year ago
#446 - www.wannier.org could not be visited due to an dns error
Issue -
State: closed - Opened by alas-go over 1 year ago
#445 - user guide: fix a minor typo
Pull Request -
State: closed - Opened by pranabdas over 1 year ago
#444 - Fedora packaging
Pull Request -
State: open - Opened by LecrisUT almost 2 years ago
#443 - License clarification
Issue -
State: closed - Opened by LecrisUT almost 2 years ago
- 4 comments
Labels: question
#442 - Better Pre-commits
Pull Request -
State: open - Opened by LecrisUT almost 2 years ago
- 2 comments
#441 - Modern cmake
Pull Request -
State: closed - Opened by LecrisUT almost 2 years ago
- 7 comments
#440 - Cmake
Pull Request -
State: closed - Opened by LecrisUT almost 2 years ago
#439 - Segmentation fault for large systems
Issue -
State: closed - Opened by schuyann almost 2 years ago
- 4 comments
Labels: bug, Priority
#438 - Jerk and injection current implementations
Pull Request -
State: open - Opened by irukoa almost 2 years ago
#437 - Failure in kmesh_get for dense k-grid
Issue -
State: open - Opened by lwoncheol about 2 years ago
- 1 comment
Labels: Library
#436 - Failure in kmesh_get
Issue -
State: open - Opened by jaemolihm about 2 years ago
- 1 comment
Labels: Priority, Library
#435 - [FEATURE REQUEST] Wannier library for C
Issue -
State: closed - Opened by gcistaro about 2 years ago
- 2 comments
Labels: enhancement, Library