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This project is mirrored from
https://gitlab.com/ase/ase.git
. Pull mirroring updated
Sep 19, 2024
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simonrittmeyer/ase-frac_occ_cif
e49d6dc8
·
fix cif test
·
Oct 19, 2018
ase_pathlib
71475627
·
remove unused imports
·
Oct 23, 2018
io_reformat
0064f4c5
·
Stringify traj and add docstring
·
Oct 25, 2018
constrained-dofs-filter
55749cd4
·
comments
·
Nov 02, 2018
macos_crash_test
f0826969
·
Test suite crashes on macOS since this tests calls fork() in a multithreaded...
·
Nov 04, 2018
grrr-more-testing-ci
859fa493
·
argh
·
Nov 07, 2018
espresso-read-spin
b6813cb1
·
no ibzkpts for for spin polarized
·
Jan 01, 2019
database_lesstables
62931b8e
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dont use old key value pairs for update
·
Feb 13, 2019
auto-change-label
5e3b3017
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Merge branch 'master' into auto-change-label
·
Feb 15, 2019
identify-1BZ-folded-monkhorst-pack-grids
17089757
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Merge branch 'master' into identify-1BZ-folded-monkhorst-pack-grids
·
Feb 20, 2019
cffi
dc501560
·
Does it work on Windows?
·
Feb 22, 2019
remove-parameters-read
ee00a0fd
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remove the Parameters.read() function; we should move to JSON for...
·
Feb 22, 2019
doslist-class
f64566b4
·
add shortcut function to get doslist from a calculator -- currently sums over...
·
Mar 23, 2019
use_iread
dd07e219
·
restore dlp4 file position after building chunk
·
Apr 03, 2019
crystal-data
0b921693
·
add data and methods to tell which crystal systems, lattice systems, and...
·
May 10, 2019
fix-label-directory-issue
9bae0c3b
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add prefix= keyword to Calculator, so we won't need label at all. Handle...
·
Jun 21, 2019
vdW_dict
826382af
·
Enable using TS09 vdW correction when the underlying functional is specified...
·
Jun 25, 2019
psql-test
783e8df9
·
Turn on output for PSQL tests
·
Jun 28, 2019
vasp_create_input2
01f833ac
·
initial commit
·
Jul 18, 2019
cherry-pick-bd212d97
6ee218d9
·
Merge branch '395_fix_docutils_text_to_inline' into 'master'
·
Jul 29, 2019
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