Ecosyste.ms: Issues
An open API service for providing issue and pull request metadata for open source projects.
GitHub / lmmentel/ase-espresso issues and pull requests
#16 - NotImplementedError: Interactive NEB is not supported
Issue -
State: open - Opened by KS-spec over 2 years ago
- 1 comment
#15 - update the code so that it can take 'vdw_corr' as input parameter
Pull Request -
State: closed - Opened by sandipde almost 4 years ago
- 4 comments
#14 - Issues with PBS
Issue -
State: closed - Opened by sandipde almost 4 years ago
- 4 comments
#13 - pdos calculations
Issue -
State: closed - Opened by Wenbintum about 4 years ago
- 1 comment
#12 - multiple calculators in the same script
Issue -
State: closed - Opened by zulissi almost 5 years ago
- 3 comments
#11 - Expected relaxed atoms to update the ase.atoms positions property
Issue -
State: closed - Opened by mklilley almost 5 years ago
- 1 comment
#10 - TypeError: 'module' object is not callable
Issue -
State: closed - Opened by noncomplete over 5 years ago
- 1 comment
#9 - Format for "Forces acting on atoms" changed in new QE, breaks ase-espresso
Issue -
State: closed - Opened by RKBK over 7 years ago
- 2 comments
#8 - Handling SLURM clusters where $SUBMITDIR is not set
Issue -
State: closed - Opened by RKBK over 7 years ago
- 1 comment
#7 - Correct way to supply SCRATCH name in the Espresso object?
Issue -
State: closed - Opened by RKBK over 7 years ago
- 6 comments
#6 - creation of siteconfig for parallel calculation with the SGE scheduler
Issue -
State: closed - Opened by maxfxam over 7 years ago
- 1 comment
#5 - Added a NEBEspresso tutorial
Pull Request -
State: closed - Opened by rybrogaard almost 8 years ago
#4 - Added new format to k-points and changed command to list
Pull Request -
State: closed - Opened by marshallmcdonnell about 8 years ago
- 1 comment
#3 - Multiespresso
Pull Request -
State: closed - Opened by rybrogaard about 8 years ago
- 2 comments
#2 - Creation of faulty PW input for heavy elements with mass==NaN
Issue -
State: closed - Opened by dev-zero over 8 years ago
#1 - espresso: fix invalid kpoints config generation
Pull Request -
State: closed - Opened by dev-zero over 8 years ago