Ecosyste.ms: Issues

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GitHub / Teoroo-CMC/CCS issues and pull requests

#27 - Basic setup of LSP, linting and formatting tools

Pull Request - State: closed - Opened by trgsv 7 months ago

#26 - fix r distance values in write_LAMMPS

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

#25 - Linting and Formatting

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

#24 - Possible bug in ccs_export_sktable

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

#22 - Allow for fixation of certain interactions.

Issue - State: open - Opened by ThijsSmolders over 1 year ago - 1 comment

#21 - Allow for weighting of force fitting

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

#20 - Forces

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

#19 - Make CCS calculator compliant with ASE standards

Issue - State: open - Opened by ThijsSmolders almost 2 years ago

#18 - Bug in specifying spline arguments for Xx-ELEMENT specifications.

Issue - State: closed - Opened by ThijsSmolders almost 2 years ago - 1 comment

#17 - Switch finding can be slow for many pairs

Issue - State: open - Opened by ThijsSmolders almost 2 years ago

#16 - Use itertools to loop over elements

Issue - State: open - Opened by ThijsSmolders almost 2 years ago

#15 - Adding acknowledgements and contributors

Issue - State: closed - Opened by ThijsSmolders almost 2 years ago - 1 comment

#14 - Dictionary of which element pairs to fit is randomly ordered

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

#13 - Innermost datapoint below rmin set in CCS_params.json

Issue - State: open - Opened by ThijsSmolders almost 2 years ago

#12 - CCS potentials with LAMMPS

Pull Request - State: closed - Opened by aksam432 almost 2 years ago - 1 comment

#11 - LAMMPS interface for CCS potential.

Pull Request - State: closed - Opened by aksam432 almost 2 years ago

#10 - Incompatibility with latest release of fortnet-python

Issue - State: open - Opened by vanderhe almost 2 years ago - 1 comment

#9 - Questionable files checked in

Issue - State: closed - Opened by vanderhe almost 2 years ago - 1 comment

#8 - Namespace package

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

#7 - docs: trying to add notebook to docs

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

#6 - Merging development of ci-cd workflow in original teoroo/ccs repo

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

#5 - Updated README.md

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

#4 - Change code style to be in line with PEP8 format

Pull Request - State: closed - Opened by vanderhe about 2 years ago - 4 comments

#3 - Fetch script crashes for non-periodic systems

Issue - State: closed - Opened by vanderhe about 2 years ago - 1 comment

#2 - Update copyright year and clean up code/imports

Pull Request - State: closed - Opened by vanderhe over 2 years ago - 8 comments

#1 - Jolla develop

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