Releases: quanshengwu/wannier_tools
Releases · quanshengwu/wannier_tools
WannierTools V2.3.0
- Fixed a bug.
- Add Translate_to_WS_calc in the CONTROL namelist. This works for BulkFS_plane_calc.
WannierTools V2.2.9
Added two new functionalities:
- Calculate the energy levels at given k points in the KPOINTS_3D card. This is called the point mode.
- Calculate anomalous Hall conductivity (AHC).
WannierTools V2.2.8
Fixed a bug in readinput.f90
Fixed a bug in fermisurface.f90.
Use two vectors to specify the SURFACE
Updates:
Discard the Miller indicies
Discard the third vector in the SURFACE card. The surface plane is specified only by two lattice vectors sitting on it.
WannierTools V2.2.7
Fixed a bug in fermisurface.f90.
Use two vectors to specify the SURFACE
Updates:
Discard the Miller indicies
Discard the third vector in the SURFACE card. The surface plane is specified only by two lattice vectors sitting on it.
WannierTools V2.2.6
Use two vectors to specify the SURFACE
Updates:
- Discard the Miller indicies
- Discard the third vector in the SURFACE card. The surface plane is specified only by two lattice vectors sitting on it.
WannierTools V2.2.5
Fix a bug in spintexture.f90. The spin was rotated according to the coordinate transformation.
WannierTools V2.2.4
- Fixed several bugs
- Remove the 2d folder
- Add an 1T'-MoS2 example to show how to study topological properties of 2D materials with WannierTools.
WannierTools V2.2.3
- Add a BulkBand_plane_calc mode. You can plot the Dirac cone in a specified plane.
WannierTools V2.2.2
Fixed some small bugs. please read update commets in V2.2.1
WannierTools V2.2.1
- The Miller indices are used to specify the surface you want to study instead of SURFACE CARD. You can find the auto-generated SURFACE card in the WT.out by searching "Miller".
- You can use very dense grid like 501501501 to calculate the high-accuracy total density of state (DOS) without the worry of memory leaks.
- Some other smaller bugs fixed.
- Enjoy!