[gpaw-users] Summary of IRC-meeting
Jens Jørgen Mortensen
jensj at fysik.dtu.dk
Wed Nov 19 11:10:02 CET 2014
Hi!
Present: Marcin, Olga, Ask and me
We discussed a bit some problems with orbital-free DFT with
GGA-functionals and a failing test in the test-suite. Both should be
solved now.
There was also some talk about how to use BLACS to redistribute data
among processes.
Moving GPAW from SVN to GIT was also discussed - possibly hosted on
gitlab.org.
Ask said that he would soon write some documentation about TDDFT with
LCAO. Unfortunately this was soon on a geological time-scale, so it
this new feature may remain a secret in our lifetime!
An experimental command-line tool called "gwap" (GPAW without any
Python) was mentioned. It is one command to run several sub-commands:
atom, dataset, diag, dos, info, rpa, run, test, xc and maybe more in the
future.
Full logs: https://dcwww.fysik.dtu.dk/~jensj/gpaw-stuff/irc-meeting-11.txt
Next meeting: December 16
Jens Jørgen
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