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irreducible-representations
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irrep
GNU General Public License v3.0
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add hdf5 support - new
#85
stepan-tsirkin
closed
2 weeks ago
1
GPAW interface
#84
stepan-tsirkin
closed
2 weeks ago
0
Request to bring back '_correct_Ecut0 ' to handle VASP unfold error ' computed ncnt=*** != input nplane=*** ','
#83
bmondal94
opened
1 month ago
0
* new method for symsep -
#82
stepan-tsirkin
closed
2 weeks ago
6
irreptables is not upgrading
#81
bmondal94
closed
1 month ago
6
Compatibility with spglib
#80
MIraola
closed
1 month ago
0
requirements for spglib version
#79
stepan-tsirkin
closed
1 month ago
1
Read sym
#77
MIraola
closed
1 month ago
0
Reading and writing of prefix.sym file for quantum espresso
#76
stepan-tsirkin
closed
1 month ago
1
Write prefix.sym file
#75
stepan-tsirkin
closed
1 month ago
0
Compatibility banduppy
#74
MIraola
closed
1 month ago
2
(VASP) Unfolding issue with irrep-1.9.1
#73
bmondal94
closed
1 month ago
22
[ERROR] while running the example code from README with IrRep 1.9.0
#71
R3aptor
opened
2 months ago
2
Revisiting the structure of the code
#70
MIraola
closed
1 month ago
4
"some eigenvalues are not unitary" Error
#69
sumannandi121998
opened
7 months ago
3
How to specify the spin channel in irrep?
#68
lhz0302
closed
7 months ago
0
Testing
#67
MIraola
closed
11 months ago
1
Release
#66
stepan-tsirkin
closed
1 year ago
0
made uploadpypi also upload source code
#65
stepan-tsirkin
closed
1 year ago
0
Error message suggests shiftUC and refUC
#64
gersonjferreira
closed
2 months ago
0
Bug in graphene. Works for K but not for K'?
#63
gersonjferreira
opened
1 year ago
3
Facing some issues to calculate the C3z eigen value for some bands at some specific k-points
#62
ziaqau
opened
1 year ago
5
use only one tolerance to compare translational parts of symmetries
#61
MIraola
closed
1 year ago
2
use only one tolerance to compare translational parts of symmetries
#60
MIraola
closed
1 year ago
0
fixed bug for abinit with PAW
#58
stepan-tsirkin
closed
1 year ago
0
Record size error with Abinit
#57
lucabuia
closed
1 year ago
6
Add `kset` property for `IrrepTable` class
#56
Cloudiiink
closed
1 year ago
1
allowed to correct Ecut0 for VASP
#55
stepan-tsirkin
closed
1 year ago
0
Offline installation
#54
zhoumeimei-yeah
closed
1 year ago
2
makes search of conventional cell non-default behaviour (issue #11 in banduppy)
#53
MIraola
closed
1 year ago
1
unable to use Check Topological Mat. for vasp-spinor example
#52
aali28
closed
1 year ago
5
fix bug when printing refUC and lattice vectors (issue #50 by xuey06)…
#51
MIraola
closed
1 year ago
0
How to understand reference cell?
#50
xuey06
closed
1 year ago
6
Option to avoid saving irreps.dat
#49
gersonjferreira
closed
1 year ago
2
Fix show gk
#48
mikelgda
closed
2 years ago
0
option to select bands in symm_matrix
#47
gersonjferreira
closed
1 year ago
2
Show k transform
#46
mikelgda
closed
2 years ago
0
Long records abinit
#45
MIraola
closed
2 years ago
0
Check transformation of unit cell
#44
MIraola
closed
2 years ago
0
Correct bugs
#43
MIraola
closed
2 years ago
0
W fstorage
#42
stepan-tsirkin
closed
1 month ago
2
fixed byg in Kpoint.NG which was causing errors in unfolding
#41
stepan-tsirkin
closed
2 years ago
0
python testing on 3.8,3.9 (not 3.7)
#40
stepan-tsirkin
closed
2 years ago
0
Adding hdf5 support
#39
MSteggles
closed
2 weeks ago
7
Modifications for hdf5 support?
#38
MSteggles
closed
2 years ago
3
Is the `trace.txt` generated by `irrep` completely compliant with the specification implemented in `vasp2trace`?
#37
hongyi-zhao
opened
2 years ago
0
The `Check Topological Mat routine` no longer exists.
#36
hongyi-zhao
opened
2 years ago
0
New versions of abinit
#35
stepan-tsirkin
closed
2 years ago
2
zero eigenvalue for inversion symmetry
#34
bfocassio
closed
2 years ago
2
JSON output error: Object of type complex is not JSON serializable
#33
bfocassio
closed
2 years ago
3
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