SMTG-UCL/ShakeNBreak issues and pull requests

#60 - Develop

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

#59 - Develop

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

#58 - Develop

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

#57 - Develop

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

#56 - `v3.1.0`; extending compatibility to `python=3.11`

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

#55 - Bump the python-packages group with 1 update

Pull Request - State: closed - Opened by dependabot[bot] about 1 year ago - 1 comment
Labels: dependencies

#54 - Develop

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

#53 - Version `2.0.0`

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

#52 - Develop

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

#51 - Develop

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

#50 - Missing "Defects_dict" when importing Json from doped

Issue - State: closed - Opened by geli7676 over 1 year ago - 2 comments

#49 - Develop

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

#48 - Develop

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

#47 - Question about Structure Generation

Issue - State: closed - Opened by tommyxuecong over 1 year ago - 3 comments

#46 - Importing library error

Issue - State: closed - Opened by AndresOrtegaGuerrero over 1 year ago - 7 comments

#45 - Fix numpy typing docs issue

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

#44 - Develop

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

#43 - fix version number

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

#42 - Develop

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

#41 - `snb-regenerate` dict error

Issue - State: closed - Opened by kantaimperial over 1 year ago - 2 comments

#40 - add JOSS badge to readme/docs

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#39 - update bib entry and version

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#38 - Update paper

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#37 - Develop

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#36 - Confirmed, docs plots actually included this time

Pull Request - State: closed - Opened by kavanase almost 2 years ago

#35 - Develop

Pull Request - State: closed - Opened by kavanase almost 2 years ago

#34 - Develop

Pull Request - State: closed - Opened by kavanase almost 2 years ago

#33 - Develop

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#32 - merge develop to main

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#31 - Merge from `Pymatgen>2022.8.23_compatibility` to `main`

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#30 - Pymatgen>2022.8.23 compatibility

Pull Request - State: closed - Opened by ireaml almost 2 years ago

#29 - Energies & Forces vs Ionic Step in `SnB`

Issue - State: closed - Opened by kavanase almost 2 years ago

#28 - I love the smell of fresh PRs in the morning ☕️

Pull Request - State: closed - Opened by kavanase almost 2 years ago

#27 - Bond-Length-Dependent Rattle `stdev`?

Issue - State: closed - Opened by kavanase almost 2 years ago - 11 comments

#26 - Develop

Pull Request - State: closed - Opened by kavanase almost 2 years ago

#25 - Develop

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

#24 - Develop

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

#23 - Develop

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

#22 - Develop

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

#21 - Develop

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

#20 - Develop

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

#19 - Merge develop to main

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

#18 - Update develop

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

#17 - Develop

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

#16 - Merge develop to main

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

#15 - Merge `io_cp2k_qe` to `develop`

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

#14 - Merge develop and main

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

#13 - Merge and remove `.idea` folder

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

#12 - Merge main and develop

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

#11 - Merge Develop

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

#10 - Merge Develop to Main

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

#9 - Folder Structure

Issue - State: closed - Opened by kavanase over 2 years ago - 5 comments
Labels: question

#8 - Potential Feature: Distance-dependent Atom Rattling

Issue - State: closed - Opened by kavanase over 2 years ago - 9 comments
Labels: enhancement

#7 - Potential Feature: Minimum Interatomic Distance in Generated Structures

Issue - State: closed - Opened by kavanase over 2 years ago - 5 comments
Labels: enhancement

#6 - Package Name

Issue - State: closed - Opened by kavanase over 2 years ago - 3 comments

#5 - Package Development

Issue - State: closed - Opened by kavanase over 2 years ago - 1 comment
Labels: vital

#4 - Structure I/O Compatibility (CP2K & Quantum Espresso)

Issue - State: closed - Opened by kavanase over 2 years ago - 2 comments
Labels: enhancement, vital

#3 - CLI Functionality

Issue - State: closed - Opened by kavanase over 2 years ago
Labels: enhancement, vital

#2 - Merge MC Rattling to Develop

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

#1 - example_notebook_bash_script_typos

Issue - State: closed - Opened by zccalgh over 2 years ago - 1 comment

GitHub / SMTG-UCL/ShakeNBreak issues and pull requests