yambo-code/aiida-yambo issues and pull requests

#263 - use ypp or yambopy to plot BSE spectra?

Issue - State: open - Opened by mikibonacci about 2 months ago - 6 comments

#262 - If not QP calc in BSE, bands for BSE are not detected automatically

Issue - State: open - Opened by mikibonacci 2 months ago
Labels: enhancement

#261 - Introduce a pydantic basemodel to manage input and output parameters, results

Issue - State: open - Opened by mikibonacci 2 months ago

#260 - Update index.md

Pull Request - State: closed - Opened by mikibonacci 12 months ago

#259 - Update index.md

Pull Request - State: closed - Opened by mikibonacci 12 months ago

#258 - ModuleNotFoundError: No module named 'aiida_quantumespresso.utils.pseudopotential'

Issue - State: closed - Opened by AmberLEE123456 12 months ago

#257 - Bugfix aiida2

Pull Request - State: closed - Opened by mikibonacci over 1 year ago

#256 - Missing new and updated documentation

Issue - State: open - Opened by mikibonacci over 1 year ago

#255 - Clean&Easy-to-maintain code: yambopy full integration into the aiida-yambo plugin

Issue - State: open - Opened by mikibonacci over 1 year ago

#254 - Merge pull request #252 from yambo-code/bugfix

Pull Request - State: closed - Opened by mikibonacci about 2 years ago

#253 - new versions on pypi

Issue - State: open - Opened by mikeatm over 2 years ago - 2 comments

#252 - docs updated for accurate->precise protocol

Pull Request - State: closed - Opened by mikibonacci over 2 years ago

#251 - bug in QP_list_merger fixed

Pull Request - State: closed - Opened by mikibonacci almost 3 years ago

#250 - Qp splitter

Pull Request - State: closed - Opened by mikibonacci almost 3 years ago

#249 - Qp splitter

Pull Request - State: closed - Opened by mikibonacci almost 3 years ago

#248 - Qp splitter

Pull Request - State: closed - Opened by mikibonacci almost 3 years ago

#247 - Bump paramiko from 2.7.1 to 2.10.1 in /docs

Pull Request - State: closed - Opened by dependabot[bot] almost 3 years ago
Labels: dependencies

#246 - Allow restart from several workflow types

Pull Request - State: closed - Opened by qiaojunfeng almost 3 years ago - 2 comments

#245 - Minor fix for `get_builder_from_protocol`

Pull Request - State: closed - Opened by qiaojunfeng almost 3 years ago

#244 - Various fix for protocol

Pull Request - State: closed - Opened by qiaojunfeng almost 3 years ago

#243 - Bump numpy from 1.17.5 to 1.21.0 in /docs

Pull Request - State: closed - Opened by dependabot[bot] about 3 years ago
Labels: dependencies

#242 - Bump ipython from 7.9.0 to 7.16.3 in /docs

Pull Request - State: closed - Opened by dependabot[bot] about 3 years ago
Labels: dependencies

#241 - Bump babel from 2.8.0 to 2.9.1 in /docs

Pull Request - State: closed - Opened by dependabot[bot] over 3 years ago
Labels: dependencies

#240 - Develop convergence

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#239 - Develop convergence

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#238 - bugfix

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#237 - Devel tasks

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#236 - game over detection

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#235 - Devel tasks

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#234 - Devel tasks

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#233 - -500 for errors

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#232 - smart conv multiple vars hints

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#231 - Develop convergence

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#230 - error if gw0 but not ndbqp

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#229 - Devel tasks

Pull Request - State: closed - Opened by mikibonacci over 3 years ago - 1 comment

#228 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#227 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#226 - Bump urllib3 from 1.25.8 to 1.26.5 in /docs

Pull Request - State: closed - Opened by dependabot[bot] over 3 years ago
Labels: dependencies

#225 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci over 3 years ago

#224 - Bump flask-cors from 3.0.8 to 3.0.9 in /docs

Pull Request - State: closed - Opened by dependabot[bot] almost 4 years ago
Labels: dependencies

#223 - Bump pygments from 2.5.2 to 2.7.4 in /docs

Pull Request - State: closed - Opened by dependabot[bot] almost 4 years ago
Labels: dependencies

#222 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#221 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#220 - Bump pyyaml from 5.1.2 to 5.4 in /docs

Pull Request - State: closed - Opened by dependabot[bot] almost 4 years ago
Labels: dependencies

#219 - Devel aiida parsing

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago - 1 comment

#218 - defaults and bf

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#217 - Dev 2.0

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#216 - Bump jinja2 from 2.11.1 to 2.11.3 in /docs

Pull Request - State: closed - Opened by dependabot[bot] almost 4 years ago
Labels: dependencies

#215 - support also nscf parents, memory error detection fixed

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#214 - parallelism

Pull Request - State: closed - Opened by mikibonacci almost 4 years ago

#213 - Bump cryptography from 3.2 to 3.3.2 in /docs

Pull Request - State: closed - Opened by dependabot[bot] about 4 years ago
Labels: dependencies

#212 - Dev 2.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#211 - t verbosity

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#210 - fix

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#209 - Dev 2.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#208 - bf

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#207 - bf ywfl mapping not in ctx

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#206 - pre calc type def

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#205 - fix in scf+nscf def

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#204 - bg3.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#203 - bf2.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#202 - bfix

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#201 - pre inputs with add pars

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#200 - Dev 2.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#199 - Dev 2.0

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#198 - Bug fixes

Pull Request - State: closed - Opened by mikibonacci about 4 years ago

#197 - Develop

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#196 - Bug fixes

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#195 - Develop

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#194 - Gpu nodes

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#193 - Workflow crash (undefined/None variable)

Issue - State: closed - Opened by giovannipizzi over 4 years ago - 4 comments

#192 - Bump cryptography from 2.8 to 3.2 in /docs

Pull Request - State: closed - Opened by dependabot[bot] over 4 years ago
Labels: dependencies

#191 - Bug fixes

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#190 - Bug fixes

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#189 - Whole YamboConvergence workchain excepts if one of the steps fails, rather than returning nicely a non-zero error code

Issue - State: closed - Opened by giovannipizzi over 4 years ago - 2 comments

#188 - Strange parsing of warnings

Issue - State: closed - Opened by giovannipizzi over 4 years ago - 1 comment

#187 - Develop

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#186 - django patched

Pull Request - State: closed - Opened by mikibonacci over 4 years ago

#185 - Bump django from 2.2.10 to 2.2.13 in /docs

Pull Request - State: closed - Opened by dependabot[bot] over 4 years ago
Labels: dependencies