Ecosyste.ms: Issues

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GitHub / jochym/qe-util issues and pull requests

#13 - qeio: fix indentation issue

Pull Request - State: closed - Opened by farhi about 7 years ago - 1 comment

#12 - qeio: handle warning message in atom forces block

Pull Request - State: closed - Opened by farhi about 7 years ago - 1 comment

#11 - Develop test set and package it for conda-forge and bring it to python3

Issue - State: open - Opened by jochym about 7 years ago - 2 comments
Labels: wishlist

#10 - Fix "Avoid mutable default arguments" issue

Pull Request - State: closed - Opened by jochym about 7 years ago

#9 - qeio.py: handle case with missing xml/DFT/LDA_PLUS_U token

Pull Request - State: closed - Opened by farhi over 7 years ago - 4 comments

#8 - qeio: sometimes the 'highest occupied' line in pw.out has only one value

Pull Request - State: closed - Opened by farhi over 7 years ago - 1 comment

#7 - Any plan to support python 3?

Issue - State: open - Opened by protik77 over 7 years ago - 2 comments

#6 - Use env var and better search for PP names

Pull Request - State: closed - Opened by farhi about 8 years ago - 8 comments

#5 - Sub-optimal numerical expressions in QHA formulas

Issue - State: open - Opened by jochym over 10 years ago
Labels: wishlist

#4 - Passwordless login

Issue - State: closed - Opened by lim520 over 10 years ago - 1 comment
Labels: resolved

#3 - Installation of ipython

Issue - State: closed - Opened by lim520 over 10 years ago - 11 comments
Labels: resolved

#2 - Error in Structural Optimization of BeO.

Issue - State: closed - Opened by lim520 over 10 years ago - 4 comments
Labels: resolved

#1 - No support for ASE edit method.

Issue - State: open - Opened by jochym over 10 years ago
Labels: bug