Releases: QuantumMaterialsModelling/bands4vasp
Releases · QuantumMaterialsModelling/bands4vasp
bands4vasp 0.5
[0.5] - 2025-07-29
Fixed
- Fixed a bug in the
--pre-logic: sampling now works on arbitrary planes (not only special ones).
Added
- Preview function for the
--pre-logic. It is interactive when possible and falls back to a static preview in headless environments. - New INPAR parameter
PREPREVIEWto control preview behavior. - New INPAR parameter
FSURTICSto independently toggle Fermi‑surface tics on/off.
Changed
- Corner edge vectors of the Fermi surface can now be output correctly in Cartesian or reciprocal coordinates via
FSUREDGEVECwich replacedFSURCART. - Default output format set to PNG, and pngcairo is now the default gnuplot terminal.
- Fermi‑surface spectral function revised for improved results.
Documentation
- Expanded documentation and tutorial to cover the new parameters and workflows.
v0.4
Update README.md
v0.3
Delete bands4vasp_v0.2 directory