Ecosyste.ms: Issues

An open API service for providing issue and pull request metadata for open source projects.

GitHub / libAtoms/matscipy issues and pull requests

#270 - MAINT: Upper bound numpy version <2.0.0

Pull Request - State: closed - Opened by thomas-rocke about 1 month ago

#269 - Better handling for atomman and ovito optional deps

Issue - State: open - Opened by thomas-rocke about 1 month ago

#267 - numpy 2 compatibility

Issue - State: open - Opened by jameskermode about 1 month ago

#266 - Disloc self_consistency bugfix & generalised kink mapping

Pull Request - State: closed - Opened by thomas-rocke about 2 months ago

#265 - Unexpected Vacancy in Generating a Straight Edge Dislocation

Issue - State: closed - Opened by Weixinyi-Cindy 2 months ago - 4 comments

#264 - New release after numpy2 fix

Issue - State: closed - Opened by stefaanhessmann 3 months ago - 3 comments

#263 - Action Required: Fix Renovate Configuration

Issue - State: open - Opened by renovate[bot] 4 months ago

#262 - DOC: fixes the interactive visualisations

Pull Request - State: closed - Opened by pgrigorev 4 months ago

#261 - NGLView visualisations are broken in the published documentation

Issue - State: closed - Opened by pgrigorev 4 months ago - 2 comments

#260 - Update softprops/action-gh-release action to v2

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#259 - Update mikepenz/action-junit-report action to v4

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#258 - Update actions/upload-artifact action to v4

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#257 - Update actions/setup-python action to v5 - autoclosed

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#256 - Update actions/checkout action to v4

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#255 - Update pypa/cibuildwheel action to v2.19.2 - autoclosed

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#254 - Modernization: CI and numpy 2.0

Pull Request - State: closed - Opened by pastewka 4 months ago

#253 - Dependency Dashboard

Issue - State: open - Opened by renovate[bot] 4 months ago

#252 - Update dependency nglview to v3.1.2

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#251 - Update dependency docs/nglview to v3.1.2

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#250 - Configure Renovate

Pull Request - State: closed - Opened by renovate[bot] 4 months ago

#249 - ASE neb changes

Issue - State: closed - Opened by jameskermode 4 months ago

#248 - numpy 2

Issue - State: closed - Opened by jameskermode 4 months ago - 4 comments

#247 - Optionally return the dislocation core fit error.

Pull Request - State: closed - Opened by imaliyov 4 months ago - 9 comments

#246 - Calling neighborlist in C++

Issue - State: closed - Opened by CheukHinHoJerry 4 months ago - 3 comments

#245 - Pair potential for the real part of the Ewald sum

Issue - State: closed - Opened by cagrikymk 6 months ago - 2 comments

#244 - WIP: Disloc kink structure generation

Pull Request - State: closed - Opened by thomas-rocke 6 months ago - 1 comment

#243 - Switch arm64 from Cirrus to GHA

Issue - State: closed - Opened by jameskermode 8 months ago - 1 comment

#242 - DOC: update reference in non-reactive potential files

Pull Request - State: closed - Opened by threich 8 months ago

#241 - Hotfix for quadrupoles of CCDDs with no partial distance

Pull Request - State: closed - Opened by thomas-rocke 10 months ago - 1 comment

#240 - Add JOSS badge and citation guide

Pull Request - State: closed - Opened by threich 10 months ago

#239 - Create CITATION.cff

Pull Request - State: closed - Opened by threich 10 months ago - 1 comment

#238 - DOC: typos

Pull Request - State: closed - Opened by threich 10 months ago - 1 comment

#237 - DOC: minor fixes in paper

Pull Request - State: closed - Opened by threich 10 months ago

#236 - DOC: Typos, reference fixes

Pull Request - State: closed - Opened by pastewka 10 months ago - 1 comment

#235 - Use UTF-8 instead of inline Math

Pull Request - State: closed - Opened by xuanxu 10 months ago

#234 - DOC: Replaced $\mu$ by unicode micro sign

Pull Request - State: closed - Opened by pastewka 10 months ago

#233 - DOC: Fixed references

Pull Request - State: closed - Opened by pastewka 10 months ago

#232 - JOSS: Fix affiliation for Lei Zhang

Pull Request - State: closed - Opened by jameskermode 10 months ago

#231 - DOC: Removed duplicate Jana2019 entry

Pull Request - State: closed - Opened by pastewka 10 months ago

#230 - DOC: Changed isbn to correct issn

Pull Request - State: closed - Opened by pastewka 10 months ago

#229 - Improve performance of unittests

Issue - State: open - Opened by thomas-rocke 10 months ago

#228 - DOC: Updated ChangeLog.md

Pull Request - State: closed - Opened by pastewka 10 months ago - 2 comments

#227 - DOC: JOSS final editorial changes

Pull Request - State: closed - Opened by pastewka 10 months ago

#226 - Clean up extra files created by running docs + tests

Issue - State: open - Opened by thomas-rocke 10 months ago - 7 comments

#225 - Update quasi_static_crack.ipynb

Pull Request - State: closed - Opened by jameskermode 10 months ago

#224 - pin nglview version to 3.0.8

Pull Request - State: closed - Opened by jotelha 10 months ago - 6 comments

#222 - Interactive visualisation of atomic structures in documentation is broken

Issue - State: closed - Opened by threich 10 months ago - 12 comments

#221 - Building documentation requires Fenics

Issue - State: closed - Opened by pastewka 10 months ago - 4 comments

#220 - MAINT: Move scripts to (installable) CLI

Pull Request - State: closed - Opened by pastewka 10 months ago - 7 comments

#219 - TST: electrochemistry CLI pipe output test fails in CI ...

Issue - State: closed - Opened by jotelha 10 months ago - 3 comments

#218 - MAINT: Remodel electrochemistry module interface API to adhere to PEP-8 conventions

Pull Request - State: closed - Opened by jotelha 10 months ago - 7 comments

#217 - BUG: Fix electrochemistry tests

Pull Request - State: closed - Opened by pastewka 10 months ago

#216 - Part of the electrochemistry module does not follow coding style

Issue - State: closed - Opened by pastewka 10 months ago - 2 comments

#215 - v0.8.1 and v0.9.0 releases

Issue - State: closed - Opened by jameskermode 10 months ago - 4 comments

#212 - DOC: fix ADF example

Pull Request - State: closed - Opened by threich 10 months ago

#211 - Some fenics log messages are written to stdout instead of stderr

Issue - State: closed - Opened by jotelha 10 months ago - 1 comment

#210 - documentation addressing Joss review issue 186

Pull Request - State: closed - Opened by jotelha 10 months ago - 3 comments

#209 - Minor optimization in the documentation.

Pull Request - State: closed - Opened by aklemenz 11 months ago

#208 - MAINT: Addressing JOSS review reports

Pull Request - State: closed - Opened by pastewka 11 months ago

#206 - ENH: Cubic Crystal Dislocation Quadrupoles

Pull Request - State: closed - Opened by thomas-rocke 11 months ago - 6 comments

#205 - Conda-forge build not working for version 0.8.0

Issue - State: open - Opened by davkovacs 12 months ago - 5 comments

#204 - BUG: Fix path lims being incorrectly calculated

Pull Request - State: closed - Opened by thomas-rocke 12 months ago - 1 comment

#203 - Generalise surface reconstruction code

Issue - State: open - Opened by jameskermode about 1 year ago

#202 - Documentation appearance

Issue - State: open - Opened by pgrigorev about 1 year ago - 3 comments
Labels: enhancement, question

#201 - AnisotropicDislocation

Pull Request - State: closed - Opened by lakshenoy about 1 year ago - 3 comments

#200 - Cosmetic changes to plasticity docs.

Pull Request - State: closed - Opened by pgrigorev about 1 year ago

#199 - DOC: fix for ImportError during documentation build

Pull Request - State: closed - Opened by pgrigorev about 1 year ago

#198 - disable failing arm64 linux builds

Pull Request - State: closed - Opened by jameskermode about 1 year ago

#197 - Additional NCFlex features and updates

Pull Request - State: closed - Opened by Fraser-Birks about 1 year ago - 1 comment

#196 - option for 3D NCFlex simulations

Pull Request - State: closed - Opened by Fraser-Birks about 1 year ago

#195 - Adding mixed mode NCFlex on top of 3D NCFlex

Pull Request - State: closed - Opened by Fraser-Birks about 1 year ago

#194 - 2D disloc. grad.

Pull Request - State: closed - Opened by lakshenoy about 1 year ago

#193 - Dislocation simplification & generalisation

Pull Request - State: closed - Opened by thomas-rocke about 1 year ago - 17 comments

#192 - Joss review issue 184, 185, issue 186

Pull Request - State: closed - Opened by jotelha about 1 year ago

#191 - Editable install won't run

Issue - State: closed - Opened by jotelha about 1 year ago - 1 comment

#189 - JOSS Review: Examples and Tutorials

Issue - State: closed - Opened by rashatwi about 1 year ago - 1 comment

#188 - DOC: Plasticity documentation update

Pull Request - State: closed - Opened by pgrigorev about 1 year ago - 2 comments

#187 - fix: protecting sympy imports in manybody potential tests

Pull Request - State: closed - Opened by prs513rosewood about 1 year ago

#186 - [JOSS Review] Documentation

Issue - State: closed - Opened by mbarzegary about 1 year ago - 2 comments

#185 - [JOSS Review] Tests

Issue - State: closed - Opened by mbarzegary about 1 year ago - 2 comments

#184 - [JOSS Review] Reproducibility and functionality

Issue - State: closed - Opened by mbarzegary about 1 year ago - 1 comment

#183 - [JOSS Review] Paper and statement of need

Issue - State: closed - Opened by mbarzegary about 1 year ago - 2 comments

#182 - Add EU funders to JOSS acknowlegements

Pull Request - State: closed - Opened by jameskermode about 1 year ago

#181 - Update README.rst

Pull Request - State: closed - Opened by computerscienceiscool about 1 year ago - 1 comment

#180 - DOC: Fix author list

Pull Request - State: closed - Opened by thomas-rocke about 1 year ago

#179 - DOC: Rocke contributions

Pull Request - State: closed - Opened by thomas-rocke about 1 year ago - 2 comments

#178 - Gamma surface & stacking fault tools

Pull Request - State: closed - Opened by thomas-rocke about 1 year ago - 11 comments

#177 - 23 opls doc

Pull Request - State: closed - Opened by aklemenz about 1 year ago - 2 comments

#175 - CommitteeUncertainty compatibility with ACEHAL BiasCalculator

Pull Request - State: closed - Opened by thomas-rocke over 1 year ago - 2 comments

#174 - Elastic constants assumed stress error

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

#173 - DOC: Import relevant API documentation

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

#172 - Documentation for the plasticity section.

Pull Request - State: closed - Opened by pgrigorev over 1 year ago - 2 comments