This is the most contributers to a release so far!
- Bug fixes
- Fix error in P monoclinic (*b*-unique) "Bradcrack" high-symmetry path (C. N. Savory)
- Fix appearance of y-axis formatter for optics plots (E. Rubinstein & Adam J. Jackson)
- Prevent an error when requesting DOS subplots with no total DOS (Z. Xing)
- Fix missing f0 orbitals in orbital projected DOS plots (utf)
- Update phonon-bandplot to use latest phonopy API (utf)
- New features
- Additional properties from dielectric function (AJJ & K. T. Butler)
- any combination of absorption, loss, dielectric and complex refractive index components can be requested as a set of subplots
- Allow full 3x3 supercell matrix to be specified for phonon band structures (AJJ)
- Band structure label manipulation with '' (AJJ)
- place before a label to make it invisible in plot
- place at end to make unique point that avoids confusing pymatgen; the label will be displayed without any trailing characters
- Aspect ratio control for band structures (A. M. Ganose)
- New interfaces
- Questaal is now supported. Pretty much everything works except
orbital-decomposed band structures and phonons. (AJJ)
- Generate a *syml.ext* band path file using **sumo-kgen** reading from a
site.ext or init.ext file. (The site file is generally the correct
choice.)
- Plot electronic band structure generated with **lmf** using
**sumo-bandplot** reading from *bnds.ext* and *syml.ext* files.
- Plot a total DOS from **lmf** with **sumo-dosplot** reading *ext.dos*
- Plot a PDOS from **lmf** by moving the total dos to *tdos.ext*
and using Questaal tools to generate a *dos.ext* with orbital
information before running **sumo-dosplot**.
- Plot optical properties with **sumo-optplot** from dielectric
function written by **lmf** (*opt.ext*) or **bethesalpeter**
(*ext.eps_BSE*). Optical spectra from multiple sources
(e.g. VASP and bethesalpeter) may be plotted alongside one
another.